246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[3x6] 4:4:3: 4:3:4: 4:4:4:3: C[3x6]-4:C[5]-4:P[5]-3: C[5,5]-4:P[5]-3:C-4: C[6,6]-4:C[6,6]-4:C[6,6]-4:P[5]-3: P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C) P[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]C[5])(CF3) C[3x6](C[6,6]C[3x6]HH)3(P[5]C[5]P[5]) P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C){1|Fe<10>,5|C<4>,6|H<1>} P[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]C[5])(CF3){2|H<1>,6|C<4>} C[3x6](C[6,6]C[3x6]HH)3(P[5]C[5]P[5]){4|H<1>,7|C<4>} 103.3040 0.000 1 103.3040 0.000 1 103.3040 0.000 1 103.3040 0.000 1 103.3040 0.000 1 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:3:4: 3:3:4: 3:4:4:1: P[5]-3:As[5]-3:C[6]-4: P[5]-3:P[5]-3:C[6]-4: P[5]-3:C[6]-4:C[6]-4:H-1: P[5](P[5]C[6]P[5])(As[5]P[5]Li)(C[6]C[6]2H) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) C[6](P[5]As[5]P[5])(C[6]C[6]HH)2(H) P[5](P[5]C[6]P[5])(As[5]P[5]Li)(C[6]C[6]2H){5|H<1>,6|C<4>} P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){1|Li<4>,6|H<1>,7|C<4>} C[6](P[5]As[5]P[5])(C[6]C[6]HH)2(H){1|Li<4>,2|C<4>,2|P<3>,4|H<1>} 99.4898 0.684 2 99.4898 0.468 2 99.4898 0.468 2 99.4898 0.468 2 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:3:4: 3:3:4: 4:4:3:1: P[5]-3:P[5]-3:C[6]-4: P[5]-3:As[5]-3:C[6]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) P[5](P[5]C[6]P[5])(As[5]P[5]Li)(C[6]C[6]2H) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){1|Li<4>,6|H<1>,7|C<4>} P[5](P[5]C[6]P[5])(As[5]P[5]Li)(C[6]C[6]2H){5|H<1>,6|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|As<3>,1|P<3>,3|C<4>,4|H<1>} 99.4365 1.913 2 99.4365 3.659 2 99.4365 3.659 2 100.9897 6.474 10 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:3:4: 3:3:4: 4:4:3:1: P[5]-3:P[5]-3:C[6]-4: P[5]-3:P[5]-3:C[6]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){1|Li<4>,6|H<1>,7|C<4>} P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){1|Li<4>,6|H<1>,7|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|As<3>,1|P<3>,3|C<4>,4|H<1>} 102.0755 1.722 2 102.1910 4.264 4 101.3780 6.939 8 100.9897 6.474 10 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:3:4: 3:3:4: 4:4:3:1: P[5]-3:P[5]-3:C[6]-4: P[5]-3:P[5]-3:C[6]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,7|C<4>} P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,7|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|As<2>,1|P<3>,3|C<4>,4|H<1>} 102.3065 3.126 2 102.1910 4.264 4 101.3780 6.939 8 100.9897 6.474 10 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:3:4: 3:3:4: 4:4:3:1: P[5]-3:P[5]-3:C[6]-4: P[5]-3:P[5]-3:C[6]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]C[6]P[5])2(C[6]C[6]2H) P[5](P[5]C[6]P[5])2(C[6]C[6]2H) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])2(C[6]C[6]2H){6|H<1>,9|C<4>} P[5](P[5]C[6]P[5])2(C[6]C[6]2H){6|H<1>,9|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|P<3>,1|P<4>,3|C<4>,4|H<1>} 100.5650 3.188 4 100.5650 10.166 4 101.3780 6.939 8 100.9897 6.474 10 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:3:4: 3:4:2: 4:4:3:1: P[5]-3:P[5]-3:C[6]-4: P[5]-3:C[6]-4:As[5]-2: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,7|C<4>} P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]){5|H<1>,6|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|As<2>,1|P<3>,3|C<4>,4|H<1>} 99.5726 1.713 2 99.5726 2.935 2 99.5726 2.935 2 99.5726 2.935 2 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:3:4: 3:4:4: 4:4:3:1: P[5]-3:P[5]-3:C[6]-4: P[5]-3:C[6]-4:P[5]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]C[6]P[5])2(C[6]C[6]2H) P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])2(C[6]C[6]2H){6|H<1>,9|C<4>} P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,6|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|P<3>,1|P<4>,3|C<4>,4|H<1>} 100.6470 1.545 4 100.6470 2.386 4 100.6470 2.386 4 100.6470 2.386 4 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:4:2: 3:3:4: 3:4:4:1: P[5]-3:C[6]-4:As[5]-2: P[5]-3:P[5]-3:C[6]-4: P[5]-3:C[6]-4:C[6]-4:H-1: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) C[6](P[5]As[5]P[5])(C[6]C[6]HH)2(H) P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]){5|H<1>,6|C<4>} P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,7|C<4>} C[6](P[5]As[5]P[5])(C[6]C[6]HH)2(H){2|C<4>,2|P<3>,4|H<1>} 99.9268 1.178 2 99.9268 1.388 2 99.9268 1.388 2 99.9268 1.388 2 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:4:4: 3:3:4: 4:4:3:1: P[5]-3:C[6]-4:P[5]-4: P[5]-3:P[5]-3:C[6]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) P[5](P[5]C[6]P[5])2(C[6]C[6]2H) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,6|C<4>} P[5](P[5]C[6]P[5])2(C[6]C[6]2H){6|H<1>,9|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){2|P<3>,4|C<4>,4|H<1>} 102.2893 0.838 4 102.2893 0.702 4 102.2893 0.702 4 102.2893 0.702 4 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 3:4:4: 4:3:4: 4:4:3:1: P[5]-3:C[6]-4:P[5]-4: P[5]-4:P[5]-3:C[6]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,7|C<4>} P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,9|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|P<3>,1|P<4>,4|C<4>,4|H<1>} 102.2960 0.000 1 102.2960 0.000 1 102.2960 0.000 1 102.2960 0.000 1 101.0121 4.145 26 101.0969 4.180 27 246 246 466 0:SP3_SP3_SP3 P[5] P[5] C[6] 4:3:4: 3:4:4: 4:4:3:1: P[5]-4:P[5]-3:C[6]-4: P[5]-3:C[6]-4:P[5]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H) P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,9|C<4>} P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,7|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|P<3>,1|P<4>,4|C<4>,4|H<1>} 104.3970 0.000 1 104.3970 0.000 1 104.3970 0.000 1 104.3970 0.000 1 101.0121 4.145 26 101.0969 4.180 27 246 246 466 6:SP3_SP3_SP3 P[5,6] P[5,6] C[6] 3:3:4: 3:4:3: 3:3:1:1: P[5,6]-3:N[5]-3:C[6]-4: P[5,6]-3:C[6]-4:C[5]-3: P[5,6]-3:C[6]-3:H-1:H-1: P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH) P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O) C[6](P[5,6]P[5,6]N[5])(C[6]C[6]C)(H)2 P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH){1|C<4>,1|O<1>,2|H<1>,4|C<3>} P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} C[6](P[5,6]P[5,6]N[5])(C[6]C[6]C)(H)2{2|C<4>,3|C<3>} 97.6309 0.000 1 97.6309 0.000 1 97.6309 0.000 1 97.6309 0.000 1 99.6465 8.125 2 99.6465 8.125 2 246 246 466 6:SP3_SP3_SP3 P[5,6] P[5,6] C[6] 3:4:3: 3:3:4: 3:3:1:1: P[5,6]-3:C[6]-4:C[5]-3: P[5,6]-3:N[5]-3:C[6]-4: P[5,6]-3:C[6]-3:H-1:H-1: P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O) P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH) C[6](P[5,6]P[5,6]C[5])(C[6]C[6]C)(H)2 P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH){1|C<4>,1|O<1>,2|H<1>,4|C<3>} C[6](P[5,6]P[5,6]C[5])(C[6]C[6]C)(H)2{1|C<3>,1|N<3>,1|O<1>,2|C<4>} 101.6620 0.000 1 101.6620 0.000 1 101.6620 0.000 1 101.6620 0.000 1 99.6465 8.125 2 99.6465 8.125 2 246 246 474 5:SP3_SP3_SP3 P[4x5] P[3x5,6] C[5,5] 3:3:4: 3:3:3: 3:3:3:3: P[3x5,6]-3:P[3x5,6]-3:C[5,5]-4: P[3,5,5,6]-3:P[3,5,6]-3:P[4x5]-3: P[3,5,5]-3:P[4x5]-3:C[6a]-3:C[6a]-3: P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(C[5,5]P[3,5,5]C[6a]2) P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]) C[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(C[6a]C[6a]2)2 P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(C[5,5]P[3,5,5]C[6a]2){1|Nb<5>,4|C<3>} P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]){2|C<3>,3|O<2>} C[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(C[6a]C[6a]2)2{2|P<3>,4|C<3>,4|H<1>} 97.9976 0.162 2 97.9976 0.026 2 97.9976 0.026 2 97.9976 0.026 2 97.9976 0.026 2 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5,5] P[5,5] C[5] 3:4:3: 3:4:3: 3:3:4:1: P[5,5]-3:C[5]-4:C[5]-3: P[5,5]-3:C[5]-4:C[5]-3: P[5,5]-3:C[5]-3:C-4:H-1: P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O) P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O) C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(CC3)(H) P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O){1|H<1>,1|O<2>,3|C<4>} P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O){1|H<1>,1|O<2>,3|C<4>} C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(CC3)(H){1|C<3>,1|C<4>,2|O<2>} 93.0130 0.000 2 93.0130 0.000 2 93.0130 0.000 2 93.0130 0.000 2 93.0130 0.000 2 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5,6] P[5,6] C[5] 3:3:4: 3:3:4: 3:4:4:1: P[5,6]-3:C[5,6]-3:C[5]-4: P[5,6]-3:C[5,6]-3:Ge[5]-4: P[5,6]-3:Ge[5]-4:C-4:H-1: P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC) C[5](P[5,6]C[5,6]P[5,6])(Ge[5]P[5,6]CC)(CH3)(H) P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH){1|C<3>,1|P<3>,5|C<4>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC){1|Ge<4>,1|C<3>,1|P<3>,2|C<4>,2|H<1>} C[5](P[5,6]C[5,6]P[5,6])(Ge[5]P[5,6]CC)(CH3)(H){1|Ge<4>,1|P<3>,2|C<3>} 97.7585 0.000 1 97.7585 0.000 1 97.7585 0.000 1 97.7585 0.000 1 97.7585 0.000 1 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5,5] 4:3:1: 3:3:3: 4:3:3:1: C[5,5]-4:P[5]-3:H-1: P[5]-3:P[5]-3:C[5]-3: C[5,5]-4:C[5]-3:P[5]-3:H-1: P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H) P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2) C[5,5](C[5,5]C[5,6]P[5]H)(C[5]C[5,6]H)(P[5]P[5]H)(H) P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H){1|C<4>,2|H<1>,4|C<3>} P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2){1|C<4>,5|C<3>,5|H<1>} C[5,5](C[5,5]C[5,6]P[5]H)(C[5]C[5,6]H)(P[5]P[5]H)(H){4|C<3>} 99.1048 0.000 1 99.1048 0.000 1 99.1048 0.000 1 99.1048 0.000 1 99.1915 0.015 2 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5,5] 4:3:3: 3:3:3: 3:4:3:1: C[5,5]-4:P[5]-3:C[5]-3: P[5]-3:P[5]-3:C[5]-3: C[5,6]-3:C[5,5]-4:P[5]-3:H-1: P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2) P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2) C[5,5](C[5,6]C[5,6]C[6])(C[5,5]C[5]P[5]H)(P[5]C[5]P[5])(H) P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2){1|C<4>,5|H<1>,6|C<3>} P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2){1|C<4>,5|C<3>,5|H<1>} C[5,5](C[5,6]C[5,6]C[6])(C[5,5]C[5]P[5]H)(P[5]C[5]P[5])(H){1|C<2>,1|C<4>,3|C<3>,3|H<1>} 99.2782 0.000 1 99.2782 0.000 1 99.2782 0.000 1 99.2782 0.000 1 99.1915 0.015 2 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5] 3:3:4: 3:3:3: 3:4:1:1: P[5]-3:C[6a]-3:C[5]-4: C[6a]-3:P[5]-3:P[5]-3: P[5]-3:C[5]-4:H-1:H-1: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH) P[5](C[6a]C[6a]N[6a])(P[5]C[6a]C[5])2 C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|N<2>,4|C<3>,4|H<1>} P[5](C[6a]C[6a]N[6a])(P[5]C[6a]C[5])2{5|H<1>,6|C<3>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{4|C<3>} 98.0585 0.184 2 98.0585 0.034 2 98.0585 0.034 2 98.0585 0.034 2 98.4649 3.196 10 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5] 3:3:4: 3:3:3: 4:3:1:1: P[5]-3:C[6a]-3:C[5]-4: P[5]-3:P[5]-3:C[6a]-3: P[5]-4:P[5]-3:H-1:H-1: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH) P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[5](P[5]C[6a]P[5]Os)(P[5]C[6a]P[5])(H)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH){1|Os<4>,2|H<1>,6|C<3>} P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){1|Os<4>,4|H<1>,7|C<3>} C[5](P[5]C[6a]P[5]Os)(P[5]C[6a]P[5])(H)2{6|C<3>} 101.5510 0.334 2 101.5510 0.111 2 101.5510 0.111 2 101.5510 0.111 2 98.4649 3.196 10 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5] 3:4:3: 3:3:3: 3:4:1:1: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:P[5]-3:P-3: P[5]-3:C[5]-4:H-1:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P) P[5](P[5]C[6a]C[5])2(PC[6a]C) C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P){3|C<3>,4|H<1>} P[5](P[5]C[6a]C[5])2(PC[6a]C){4|C<3>,4|H<1>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{1|P<3>,3|C<3>} 97.0470 0.006 2 97.0470 0.000 2 97.0470 0.000 2 97.2066 0.213 4 98.4649 3.196 10 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5] 3:4:3: 3:3:3: 3:4:1:1: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:P[5]-3:P[5]-3: P[5]-3:C[5]-4:H-1:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2) P[5](P[5]C[6a]C[5])2(P[5]P[5]2) C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2){2|P<3>,3|C<3>,4|H<1>} P[5](P[5]C[6a]C[5])2(P[5]P[5]2){2|C<4>,4|H<1>,6|C<3>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{1|P<3>,3|C<3>} 97.3663 0.733 2 97.3663 0.538 2 97.3663 0.538 2 97.2066 0.213 4 98.4649 3.196 10 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5] 3:4:3: 4:3:3: 3:4:1:1: C[6a]-3:C[5]-4:P[5]-3: P[5]-4:P[5]-3:P[5]-3: P[5]-3:C[5]-4:H-1:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2) P[5](P[5]C[6a]C[5]Fe)(P[5]C[6a]C[5])(P[5]P[5]2) C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2){1|Fe<5>,1|P<3>,1|P<4>,3|C<3>,4|H<1>} P[5](P[5]C[6a]C[5]Fe)(P[5]C[6a]C[5])(P[5]P[5]2){1|Fe<5>,2|C<4>,4|H<1>,6|C<3>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{1|Fe<5>,1|P<3>,3|C<3>} 99.3549 0.000 1 99.3549 0.000 1 99.3549 0.000 1 99.3549 0.000 1 98.4649 3.196 10 97.8124 5.188 17 246 246 474 5:SP3_SP3_SP3 P[5] P[5] C[5] 4:4:3: 4:3:4: 4:3:4:1: C[3x6]-4:C[5]-4:P[5]-3: C[5,5]-4:P[5]-3:C-4: C[5,5]-4:P[5]-3:C-4:H-1: P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C) P[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]C[5])(CF3) C[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]P[5])(CH3)(H) P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C){1|Fe<10>,5|C<4>,6|H<1>} P[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]C[5])(CF3){2|H<1>,6|C<4>} C[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]P[5])(CH3)(H){1|H<1>,6|C<4>} 97.2485 0.000 1 97.2485 0.000 1 97.2485 0.000 1 97.2485 0.000 1 98.4649 3.196 10 97.8124 5.188 17 246 246 474 6:SP3_SP3_SP3 P[5,6] P[5,6] C[5,6] 3:4:3: 3:3:3: 3:4:1:1: P[5,6]-3:C[5,6]-4:C[5]-3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[5,6]-4:H-1:H-1: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) C[5,6](P[5,6]P[5,6]C[5])(C[5,6]C[5]C[6]C)(H)2 P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]){3|C<4>,5|C<3>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){3|C<4>,3|H<1>,5|C<3>} C[5,6](P[5,6]P[5,6]C[5])(C[5,6]C[5]C[6]C)(H)2{1|C<4>,1|H<1>,4|C<3>} 93.5798 0.000 1 93.5798 0.000 1 93.5798 0.000 1 93.5798 0.000 1 93.5798 0.000 1 93.5798 0.000 1 246 246 490 0:SP3_SP3_SP3 P[5,5] P[3x5] C 3:3:4: 4:3:3: 3:1:1:1: P[3x5]-3:P[3,5,5]-3:C-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[5,5]-3:H-1:H-1:H-1: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) C(P[5,5]P[3,5,5]P[3x5])(H)3 P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3){1|Ga<4>,2|N<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|Cl<1>,2|N<3>,4|C<3>} C(P[5,5]P[3,5,5]P[3x5])(H)3 107.1850 0.000 1 107.6750 0.480 2 107.6750 0.480 2 107.6750 0.480 2 107.6750 0.480 2 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5,5] P[3x5] C 3:3:4: 4:3:3: 3:1:1:1: P[3x5]-3:P[3,5,5]-3:C-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[5,5]-3:H-1:H-1:H-1: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) C(P[5,5]P[3,5,5]P[3x5])(H)3 P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3){1|Ga<4>,2|N<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|O<2>,2|N<3>,4|C<3>} C(P[5,5]P[3,5,5]P[3x5])(H)3 108.1650 0.000 1 107.6750 0.480 2 107.6750 0.480 2 107.6750 0.480 2 107.6750 0.480 2 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 3:2:4: 4:3:4: 3:4:4:4: P[5]-3:N[5]-2:C-4: P[5]-4:P[5]-3:C-4: P[5]-3:C-4:C-4:C-4: P[5](P[5]P[5]C)(N[5]C[5])(CC3) P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3) C(P[5]N[5]P[5])(CH3)3 P[5](P[5]P[5]C)(N[5]C[5])(CC3){3|C<4>} P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3){1|C<4>} C(P[5]N[5]P[5])(CH3)3 103.3610 0.000 1 103.3610 0.000 1 103.3610 0.000 1 103.3610 0.000 1 99.6584 11.450 9 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 3:3:4: 3:3:1: 3:3:1:1: P[5]-3:C[5]-3:C-4: N[5]-3:P[5]-3:Cl-1: P[5]-3:C-3:H-1:H-1: P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH) P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl) C(P[5]C[5]P[5])(CCN)(H)2 P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH){1|C<3>,1|C<4>} P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl){1|C<4>,1|H<1>,2|C<3>} C(P[5]C[5]P[5])(CCN)(H)2 98.3159 0.000 1 98.3159 0.000 1 98.3159 0.000 1 98.3159 0.000 1 99.6584 11.450 9 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 3:3:4: 3:3:4: 3:4:4:1: C[5,6a]-3:P[5]-3:C-4: C[5,6a]-3:P[5]-3:C[5]-4: P[5]-3:C-4:C-4:H-1: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C)(C[5]C[5]2Fe) C(P[5]C[5,6a]P[5])(CH3)2(H) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH){1|Fe<10>,1|H<1>,2|C<4>,3|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C)(C[5]C[5]2Fe){2|C<4>,3|C<3>,3|H<1>} C(P[5]C[5,6a]P[5])(CH3)2(H) 98.2926 0.000 1 98.2926 0.000 1 98.2926 0.000 1 98.2926 0.000 1 99.6584 11.450 9 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 4:3:4: 3:2:4: 3:4:4:4: P[5]-4:P[5]-3:C-4: P[5]-3:N[5]-2:C-4: P[5]-3:C-4:C-4:C-4: P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3) P[5](P[5]P[5]C)(N[5]C[5])(CC3) C(P[5]P[5]2)(CH3)3 P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3){1|C<4>} P[5](P[5]P[5]C)(N[5]C[5])(CC3){3|C<4>} C(P[5]P[5]2)(CH3)3 103.9260 0.000 1 103.9260 0.000 1 103.9260 0.000 1 103.9260 0.000 1 99.6584 11.450 9 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 4:3:4: 4:3:4: 3:1:1:1: P[5]-4:P[5]-3:C-4: P[5]-4:P[5]-3:C-4: P[5]-3:H-1:H-1:H-1: P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3) P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3) C(P[5]P[5]2)(H)3 P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3){3|C<4>,4|C<3>} P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3){1|C<4>,2|C<3>} C(P[5]P[5]2)(H)3 100.3020 0.000 1 100.3020 0.000 1 98.1212 9.512 2 98.1212 9.512 2 99.6584 11.450 9 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 4:3:4: 4:3:4: 3:1:1:1: P[5]-4:P[5]-3:C-4: P[5]-4:P[5]-3:C-4: P[5]-3:H-1:H-1:H-1: P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3) P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3) C(P[5]P[5]2)(H)3 P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3){1|C<4>,2|C<3>} P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3){3|C<4>,4|C<3>} C(P[5]P[5]2)(H)3 95.9404 0.000 1 95.9404 0.000 1 98.1212 9.512 2 98.1212 9.512 2 99.6584 11.450 9 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 4:3:4: 4:3:4: 3:4:1:1: P[5]-4:P[5]-3:C-4: P[5]-4:P[5]-3:C-4: P[5]-3:C-4:H-1:H-1: P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH) P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH) C(P[5]P[5]2)(CH3)(H)2 P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH){2|H<1>,6|C<3>} P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH){2|H<1>,6|C<3>} C(P[5]P[5]2)(CH3)(H)2 101.4065 1.834 2 101.4065 3.362 2 101.4065 3.362 2 101.4065 3.362 2 99.6584 11.450 9 101.1160 19.724 11 246 246 490 0:SP3_SP3_SP3 P[5] P[5] C 4:3:4: 4:4:3: 3:1:1:1: C[5,5]-4:P[5]-3:C-4: C[3x6]-4:C[5]-4:P[5]-3: P[5]-3:F-1:F-1:F-1: P[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]C[5])(CF3) P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C) C(P[5]C[5,5]P[5])(F)3 P[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]C[5])(CF3){2|H<1>,6|C<4>} P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C){1|Fe<10>,5|C<4>,6|H<1>} C(P[5]C[5,5]P[5])(F)3 93.9750 0.000 1 93.9750 0.000 1 93.9750 0.000 1 93.9750 0.000 1 99.6584 11.450 9 101.1160 19.724 11 246 246 542 5:SP3_SP2_SP3 P[5,5] P[5,5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:P[5,5]-3: P[5,5]-3:C[5]-3:C[5]-3: P[5,5]-3:C[6a]-3:C[5]-3: P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2) P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2 N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C) P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2){2|C<4>,2|H<1>,4|C<3>} P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2{2|C<3>,2|C<4>} N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|H<1>,2|C<4>,5|C<3>} 91.7614 0.000 1 91.7614 0.000 1 91.7614 0.000 1 91.7614 0.000 1 91.7614 0.000 1 95.2056 6.903 5 246 246 542 5:SP3_SP2_SP3 P[5] P[5] N[5] 3:3:1: 3:3:4: 3:3:3: N[5]-3:P[5]-3:Cl-1: P[5]-3:C[5]-3:C-4: C[6a]-3:P[5]-3:C[5]-3: P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl) P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH) N[5](C[6a]C[6a]2)(P[5]P[5]Cl)(C[5]C[5]C) P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl){1|C<4>,1|H<1>,2|C<3>} P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH){1|C<3>,1|C<4>} N[5](C[6a]C[6a]2)(P[5]P[5]Cl)(C[5]C[5]C){1|H<1>,2|C<3>,3|C<4>} 95.4479 0.000 1 95.4479 0.000 1 95.4479 0.000 1 95.4479 0.000 1 96.0667 4.262 4 95.2056 6.903 5 246 246 542 5:SP3_SP2_SP3 P[5] P[5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:P[5]-3: N[5]-3:N[5]-3:P[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(P[5]N[5]2) P[5](N[5]C[6a]C[5])2(P[5]N[5]2) N[5](P[5]N[5]P[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(P[5]N[5]2){2|H<1>,8|C<3>} P[5](N[5]C[6a]C[5])2(P[5]N[5]2){2|H<1>,8|C<3>} N[5](P[5]N[5]P[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,2|N<3>,3|C<3>} 97.6959 0.355 2 97.6959 0.126 2 97.6959 0.126 2 96.2729 6.137 3 96.0667 4.262 4 95.2056 6.903 5 246 246 542 5:SP3_SP2_SP3 P[5] P[5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C) N[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]C) P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>} P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|C<4>,2|H<1>,5|C<3>} N[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]C){2|C<4>,6|C<3>} 93.4270 0.000 1 93.4270 0.000 1 93.4270 0.000 1 96.2729 6.137 3 96.0667 4.262 4 95.2056 6.903 5 246 246 542 5:SP3_SP3_SP3 P[5,5] P[5,5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:P[5,5]-3: P[5,5]-3:C[5]-3:C[5]-3: P[5,5]-3:C[6a]-3:C[5]-3: P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2) P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2 N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C) P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2){2|C<4>,2|H<1>,4|C<3>} P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2{2|C<3>,2|C<4>} N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|H<1>,2|C<4>,5|C<3>} 93.0918 0.000 1 93.0918 0.000 1 93.0918 0.000 1 93.0918 0.000 1 93.0918 0.000 1 93.9301 0.325 4 246 246 542 5:SP3_SP3_SP3 P[5,6] P[5,6] N[5] 3:3:4: 3:4:3: 3:3:3: P[5,6]-3:N[5]-3:C[6]-4: P[5,6]-3:C[6]-4:C[5]-3: P[5,6]-3:C[6a]-3:C[5]-3: P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH) P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O) N[5](P[5,6]P[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]C) P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH){1|C<4>,1|O<1>,2|H<1>,4|C<3>} P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} N[5](P[5,6]P[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]C){1|O<1>,2|H<1>,3|C<3>,3|C<4>} 94.0569 0.000 1 94.0569 0.000 1 94.0569 0.000 1 94.0569 0.000 1 94.0569 0.000 1 93.9301 0.325 4 246 246 542 5:SP3_SP3_SP3 P[5] P[5] N[5] 3:3:3: 3:3:3: 3:3:4: N[5]-3:N[5]-3:P[5]-3: N[5]-3:N[5]-3:P[5]-3: P[5]-3:C[5]-3:C-4: P[5](N[5]C[5]C)2(P[5]N[5]2) P[5](N[5]C[5]C)2(P[5]N[5]2) N[5](P[5]N[5]P[5])(C[5]C[5]H)(CC3) P[5](N[5]C[5]C)2(P[5]N[5]2){2|C<3>,2|C<4>,2|H<1>} P[5](N[5]C[5]C)2(P[5]N[5]2){2|C<3>,2|C<4>,2|H<1>} N[5](P[5]N[5]P[5])(C[5]C[5]H)(CC3){1|C<4>,1|H<1>,2|N<3>} 94.2859 0.061 2 94.2859 0.004 2 94.2859 0.004 2 94.2859 0.004 2 94.2859 0.004 2 93.9301 0.325 4 246 246 562 5:SP3_SP3_SP3 P[5,6] P[5,6] Si[5] 3:3:4: 3:4:4: 3:2:4:4: P[6,6]-3:P[5,6]-3:Si[5]-4: P[5,6]-3:Si[6]-4:Si[5]-4: P[5,6]-3:O[5]-2:C-4:C-4: P[5,6](P[6,6]Si[6,6]Si[6])(P[5,6]Si[5]Si[6])(Si[5]O[5]CC) P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC) Si[5](P[5,6]P[5,6]P[6,6])(O[5]Si[5])(CCCH)2 P[5,6](P[6,6]Si[6,6]Si[6])(P[5,6]Si[5]Si[6])(Si[5]O[5]CC){1|O<2>,1|P<3>,8|C<4>} P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC){3|Si<4>,2|C<4>} Si[5](P[5,6]P[5,6]P[6,6])(O[5]Si[5])(CCCH)2{3|Si<4>,2|C<4>} 99.3477 0.000 1 99.3477 0.000 1 99.3477 0.000 1 99.3477 0.000 1 98.1476 2.880 2 98.1476 2.880 2 246 246 562 5:SP3_SP3_SP3 P[5,6] P[5,6] Si[5] 3:4:4: 3:3:4: 3:2:4:4: P[5,6]-3:Si[6]-4:Si[5]-4: P[6,6]-3:P[5,6]-3:Si[5]-4: P[5,6]-3:O[5]-2:C-4:C-4: P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC) P[5,6](P[6,6]Si[6,6]Si[6])(P[5,6]Si[5]Si[6])(Si[5]O[5]CC) Si[5](P[5,6]P[5,6]Si[6])(O[5]Si[5])(CCCH)2 P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC){3|Si<4>,2|C<4>} P[5,6](P[6,6]Si[6,6]Si[6])(P[5,6]Si[5]Si[6])(Si[5]O[5]CC){1|O<2>,1|P<3>,8|C<4>} Si[5](P[5,6]P[5,6]Si[6])(O[5]Si[5])(CCCH)2{2|P<3>,4|C<4>} 96.9475 0.000 1 96.9475 0.000 1 96.9475 0.000 1 96.9475 0.000 1 98.1476 2.880 2 98.1476 2.880 2 246 246 606 5:SP3_SP3_SP3 P[5,6] P[5,6] Ge[5] 3:3:4: 3:3:4: 3:4:4:4: P[5,6]-3:C[5,6]-3:Ge[5]-4: P[5,6]-3:C[5,6]-3:C[5]-4: P[5,6]-3:C[5]-4:C-4:C-4: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC) P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH) Ge[5](P[5,6]C[5,6]P[5,6])(C[5]P[5,6]CH)(CSi2H)2 P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC){1|Ge<4>,1|C<3>,1|P<3>,2|C<4>,2|H<1>} P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH){1|C<3>,1|P<3>,5|C<4>} Ge[5](P[5,6]C[5,6]P[5,6])(C[5]P[5,6]CH)(CSi2H)2{1|C<4>,1|P<3>,2|C<3>} 105.3610 0.000 1 105.3610 0.000 1 105.3610 0.000 1 105.3610 0.000 1 105.3610 0.000 1 105.3610 0.000 1 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:3: 3:2:3: C[6a]-3:P[5]-3:P[5]-3: C[6a]-3:P[5]-3:P[5]-3: C[6a]-3:N[6a]-2:P[5]-3: P[5](C[6a]C[6a]N[6a])(P[5]C[6a]P[5])2 P[5](C[6a]C[6a]N[6a])(P[5]C[6a]P[5])2 C[6a](C[6a]C[6a]H)(N[6a]C[6a])(P[5]P[5]2) P[5](C[6a]C[6a]N[6a])(P[5]C[6a]P[5])2{1|H<1>,2|N<2>,6|C<3>} P[5](C[6a]C[6a]N[6a])(P[5]C[6a]P[5])2{1|H<1>,2|N<2>,6|C<3>} C[6a](C[6a]C[6a]H)(N[6a]C[6a])(P[5]P[5]2){2|H<1>,2|P<3>,3|C<3>} 99.4268 2.260 10 99.4268 5.108 10 99.4268 5.108 10 99.4268 5.108 10 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:3: 3:3:3: N[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C) C[6a](P[5]N[5]P[5])(C[6a]C[6a]H)2 P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>} P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|C<4>,2|H<1>,5|C<3>} C[6a](P[5]N[5]P[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>} 99.7591 0.000 1 99.7591 0.000 1 99.7591 0.000 1 99.7941 3.475 10 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:3: 3:3:3: P[5]-3:C[6a]-3:C[5]-3: N[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C) P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|C<4>,2|H<1>,5|C<3>} P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|N<3>,2|H<1>,4|C<3>} 96.9242 0.000 1 96.9242 0.000 1 96.9242 0.000 1 99.7941 3.475 10 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){1|C<4>,2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){1|C<4>,2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|P<3>,1|P<4>,2|H<1>,3|C<3>} 98.4170 0.951 2 100.0661 4.151 6 100.1573 3.140 8 99.7941 3.475 10 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|C<4>,2|H<1>,7|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|C<4>,2|H<1>,7|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|P<3>,1|P<4>,2|H<1>,3|C<3>} 101.9505 0.712 2 100.0661 4.151 6 100.1573 3.140 8 99.7941 3.475 10 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|H<1>,9|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|H<1>,9|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|P<3>,1|P<4>,2|H<1>,3|C<3>} 99.8308 2.587 2 100.0661 4.151 6 100.1573 3.140 8 99.7941 3.475 10 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,2|N<3>,7|C<3>} P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,2|N<3>,7|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|Ga<4>,1|P<3>,2|H<1>,3|C<3>} 100.4306 1.013 2 100.4306 1.026 2 100.1573 3.140 8 99.7941 3.475 10 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:4: 3:2:3: C[6a]-3:P[5]-3:P[5]-3: P[5]-3:C[6a]-3:C[5]-4: C[6a]-3:N[6a]-2:P[5]-3: P[5](C[6a]C[6a]N[6a])(P[5]C[6a]C[5])2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH) C[6a](C[6a]C[6a]H)(N[6a]C[6a])(P[5]P[5]2) P[5](C[6a]C[6a]N[6a])(P[5]C[6a]C[5])2{5|H<1>,6|C<3>} P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|N<2>,4|C<3>,4|H<1>} C[6a](C[6a]C[6a]H)(N[6a]C[6a])(P[5]P[5]2){2|C<4>,2|H<1>,3|C<3>} 100.6437 1.785 2 100.6437 3.187 2 100.6437 3.187 2 100.6437 3.187 2 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:4: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[5]-4: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){1|Os<4>,4|H<1>,7|C<3>} P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH){1|Os<4>,2|H<1>,6|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|C<4>,1|P<4>,2|H<1>,3|C<3>} 100.2228 0.563 2 100.2228 0.317 2 100.2228 0.317 2 98.9284 3.116 4 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 3:3:4: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:P[5]-4: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|C<4>,2|H<1>,7|C<3>} P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC){2|H<1>,6|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|P<3>,1|P<4>,2|H<1>,3|C<3>} 97.6341 1.526 2 97.6341 2.330 2 97.6341 2.330 2 98.9284 3.116 4 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 4:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: Ga[5,5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,2|N<3>,7|C<3>} P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|Ga<4>,1|P<3>,2|H<1>,3|C<3>} 103.9325 0.426 2 103.9325 0.182 2 103.9325 0.182 2 100.0396 8.347 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 4:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]C[5]Os)(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){1|Os<4>,4|H<1>,7|C<3>} P[5](P[5]C[6a]C[5]Os)(P[5]C[6a]P[5])(C[6a]C[6a]2){4|H<1>,7|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|C<4>,1|P<4>,2|H<1>,3|C<3>} 100.6745 1.064 2 100.6745 1.133 2 99.2610 6.140 10 100.0396 8.347 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 4:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|H<1>,9|C<3>} P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|P<3>,1|P<4>,2|H<1>,3|C<3>} 97.3553 3.117 2 97.3553 9.715 2 99.2610 6.140 10 100.0396 8.347 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 4:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|B<4>,2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2){1|B<4>,2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){2|H<1>,2|P<4>,3|C<3>} 98.8033 3.058 4 98.8033 9.351 4 99.2610 6.140 10 100.0396 8.347 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:3: 4:3:3: 3:3:3: P[5]-3:P[5]-3:C[6a]-3: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){1|C<4>,2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|P<3>,1|P<4>,2|H<1>,3|C<3>} 100.6685 0.549 2 100.6685 0.302 2 99.2610 6.140 10 100.0396 8.347 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:4: 3:3:3: 3:3:3: P[5]-3:C[6a]-3:C[5]-4: C[6a]-3:P[5]-3:P[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH) P[5](C[6a]C[6a]N[6a])(P[5]C[6a]C[5])2 C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|N<2>,4|C<3>,4|H<1>} P[5](C[6a]C[6a]N[6a])(P[5]C[6a]C[5])2{5|H<1>,6|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<4>,1|P<3>,2|C<3>,4|H<1>} 101.0667 3.202 2 101.0667 10.254 2 101.0667 10.254 2 102.8557 5.017 6 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:4: 3:3:3: 3:3:3: P[5]-3:C[6a]-3:C[5]-4: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH) P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH){1|Os<4>,2|H<1>,6|C<3>} P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){1|Os<4>,4|H<1>,7|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|P<3>,1|P<4>,2|C<3>,4|H<1>} 102.6835 0.810 2 102.6835 0.656 2 102.6835 0.656 2 102.8557 5.017 6 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:3:4: 3:3:3: 3:3:3: P[5]-3:C[6a]-3:P[5]-4: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC){2|H<1>,6|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|C<4>,2|H<1>,7|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){2|C<3>,2|C<4>,2|H<1>,2|P<3>} 104.8170 0.139 2 104.8170 0.019 2 104.8170 0.019 2 102.8557 5.017 6 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:4:3: 3:3:3: 3:3:3: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:P[5]-3:P-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P) P[5](P[5]C[6a]C[5])2(PC[6a]C) C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P){3|C<3>,4|H<1>} P[5](P[5]C[6a]C[5])2(PC[6a]C){4|C<3>,4|H<1>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<3>,1|C<4>,2|P<3>,4|H<1>} 100.2232 1.916 2 100.2232 3.671 2 100.2232 3.671 2 100.4046 1.268 4 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:4:3: 3:3:3: 3:3:3: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:P[5]-3:P[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2) P[5](P[5]C[6a]C[5])2(P[5]P[5]2) C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2){2|P<3>,3|C<3>,4|H<1>} P[5](P[5]C[6a]C[5])2(P[5]P[5]2){2|C<4>,4|H<1>,6|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<3>,1|C<4>,2|P<3>,4|H<1>} 100.5860 0.025 2 100.5860 0.001 2 100.5860 0.001 2 100.4046 1.268 4 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 3:4:3: 4:3:3: 3:3:3: C[6a]-3:C[5]-4:P[5]-3: P[5]-4:P[5]-3:P[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2) P[5](P[5]C[6a]C[5]Fe)(P[5]C[6a]C[5])(P[5]P[5]2) C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2){1|Fe<5>,1|P<3>,1|P<4>,3|C<3>,4|H<1>} P[5](P[5]C[6a]C[5]Fe)(P[5]C[6a]C[5])(P[5]P[5]2){1|Fe<5>,2|C<4>,4|H<1>,6|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<3>,1|C<4>,1|P<3>,1|P<4>,4|H<1>} 103.4800 0.000 1 103.4800 0.000 1 103.4800 0.000 1 103.4800 0.000 1 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 4:3:3: 3:3:3: 3:3:3: Ga[5,5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](P[5]Ga[5,5]P[5])(C[6a]C[6a]H)2 P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,2|N<3>,7|C<3>} C[6a](P[5]Ga[5,5]P[5])(C[6a]C[6a]H)2{2|C<3>,2|H<1>,2|N<3>,2|P<3>} 105.0760 2.369 2 105.0760 5.611 2 105.0760 5.611 2 103.2241 4.194 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 4:3:3: 3:3:3: 3:3:3: P[5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|H<1>,9|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){2|H<1>,2|P<3>,4|C<3>} 104.7360 1.153 2 104.7360 1.328 2 102.8537 3.588 10 103.2241 4.194 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 4:3:3: 3:3:3: 3:3:3: P[5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]C[5]Os)(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]C[5]Os)(P[5]C[6a]P[5])(C[6a]C[6a]2){4|H<1>,7|C<3>} P[5](P[5]C[6a]C[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){1|Os<4>,4|H<1>,7|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|Os<4>,1|C<4>,1|P<3>,2|H<1>,3|C<3>} 101.8210 1.437 2 101.8210 2.065 2 102.8537 3.588 10 103.2241 4.194 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 4:3:3: 3:3:3: 3:3:3: P[5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2){1|B<4>,2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|B<4>,2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|B<4>,1|P<3>,1|P<4>,2|H<1>,3|C<3>} 102.0090 1.921 4 102.0090 3.688 4 102.8537 3.588 10 103.2241 4.194 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 4:3:3: 3:3:3: 3:3:3: P[5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){1|C<4>,2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|C<4>,2|H<1>,2|P<3>,3|C<3>} 103.6935 2.087 2 103.6935 4.354 2 102.8537 3.588 10 103.2241 4.194 12 100.8509 6.636 63 100.8509 6.636 63 246 246 643 0:SP3_SP2_SP3 P[5] P[5] C[6a] 4:3:3: 4:3:3: 3:3:3: P[5]-4:P[5]-3:C[6a]-3: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](P[5]C[6a]P[5]Rh)(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5]Rh)(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5]Rh)(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5]Rh)(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|Rh<4>,1|P<3>,1|P<4>,2|H<1>,3|C<3>} 101.4990 0.594 2 101.4990 0.353 2 101.4990 0.353 2 101.4990 0.353 2 100.8509 6.636 63 100.8509 6.636 63 246 246 658 6:SP3_SP3_SP3 P[5,6] P[5,6] Si[6] 3:4:4: 3:3:4: 3:3:4:4: P[5,6]-3:Si[6]-4:Si[5]-4: P[6,6]-3:P[5,6]-3:Si[5]-4: P[6,6]-3:P[5,6]-3:C-4:C-4: P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC) P[5,6](P[6,6]Si[6,6]Si[6])(P[5,6]Si[5]Si[6])(Si[5]O[5]CC) Si[6](P[6,6]Si[6,6]Si[6])(P[5,6]P[5,6]Si[5])(CCCH)2 P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC){3|Si<4>,2|C<4>} P[5,6](P[6,6]Si[6,6]Si[6])(P[5,6]Si[5]Si[6])(Si[5]O[5]CC){1|O<2>,1|P<3>,8|C<4>} Si[6](P[6,6]Si[6,6]Si[6])(P[5,6]P[5,6]Si[5])(CCCH)2{1|Si<4>,1|P<3>,2|O<2>,6|C<4>} 91.6808 0.000 1 91.6808 0.000 1 91.6808 0.000 1 91.6808 0.000 1 91.6808 0.000 1 91.6808 0.000 1 246 246 727 5:SP3_SP2_SP3 P[3x5,6,6] P[4x5,6,6] C[5,6,6a] 3:3:3: 3:3:3: 3:3:3: P[3x5,4x6]-3:P[4x5,6,6]-3:C[5,6,6a]-3: P[3x5,6,6]-3:P[3x5,6,6]-3:P[4x5,6,6]-3: P[3x5,6,6]-3:C[5,6,6a]-3:C[6a]-3: P[3x5,6,6](P[3x5,4x6]P[3x5,4x6]P[3x5,6,6])(P[4x5,6,6]P[3x5,6,6]P[4x5,6,6])(C[5,6,6a]C[5,6,6a]C[6a]) P[4x5,6,6](P[3x5,6,6]P[3x5,4x6]C[5,6,6a])2(P[4x5,6,6]P[3x5,6,6]2) C[5,6,6a](P[3x5,6,6]P[3x5,4x6]P[4x5,6,6])(C[5,6,6a]P[3x5,6,6]C[6a])(C[6a]C[6a]H) P[3x5,6,6](P[3x5,4x6]P[3x5,4x6]P[3x5,6,6])(P[4x5,6,6]P[3x5,6,6]P[4x5,6,6])(C[5,6,6a]C[5,6,6a]C[6a]){1|H<1>,1|P<3>,3|C<3>} P[4x5,6,6](P[3x5,6,6]P[3x5,4x6]C[5,6,6a])2(P[4x5,6,6]P[3x5,6,6]2){4|C<3>} C[5,6,6a](P[3x5,6,6]P[3x5,4x6]P[4x5,6,6])(C[5,6,6a]P[3x5,6,6]C[6a])(C[6a]C[6a]H){1|C<3>,2|H<1>,3|P<3>} 92.5117 0.283 8 92.5117 0.080 8 92.5117 0.080 8 92.5117 0.080 8 92.5117 0.080 8 95.0518 12.951 15 246 246 727 5:SP3_SP2_SP3 P[5,5] P[5,5] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:P[5,5]-3:P[5]-3: C[5,6a]-3:P[5,5]-3:P[5]-3: C[5,6a]-3:P[5,5]-3:C[6a]-3: P[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]C[5,6a]P[5])(P[5]C[5,6a]Li) P[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]C[5,6a]P[5])(P[5]C[5,6a]Li) C[5,6a](C[5,6a]C[6a]P[5])(P[5,5]P[5,5]P[5])(C[6a]C[6a]H) P[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]C[5,6a]P[5])(P[5]C[5,6a]Li){1|Li<4>,1|H<1>,4|C<3>} P[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]C[5,6a]P[5])(P[5]C[5,6a]Li){1|Li<4>,1|H<1>,4|C<3>} C[5,6a](C[5,6a]C[6a]P[5])(P[5,5]P[5,5]P[5])(C[6a]C[6a]H){2|Li<4>,2|H<1>,3|C<3>} 97.1739 0.012 2 97.1739 0.000 2 97.1739 0.000 2 97.1739 0.000 2 97.1739 0.000 2 95.0518 12.951 15 246 246 727 5:SP3_SP2_SP3 P[5] P[5] C[5,6a] 3:3:4: 3:3:4: 3:3:3: C[5,6a]-3:P[5]-3:C-4: C[5,6a]-3:P[5]-3:C[5]-4: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C)(C[5]C[5]2Fe) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]C) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH){1|Fe<10>,1|H<1>,2|C<4>,3|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C)(C[5]C[5]2Fe){2|C<4>,3|C<3>,3|H<1>} C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]C){1|C<4>,1|H<1>,3|C<3>} 93.7559 0.000 1 93.7559 0.000 1 93.7559 0.000 1 98.2672 17.109 5 98.2672 17.109 5 95.0518 12.951 15 246 246 727 5:SP3_SP2_SP3 P[5] P[5] C[5,6a] 3:3:4: 3:3:4: 3:3:3: C[5,6a]-3:P[5]-3:C[5]-4: C[5,6a]-3:P[5]-3:C-4: C[5,6a,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C)(C[5]C[5]2Fe) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(P[5]C[5]P[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C)(C[5]C[5]2Fe){2|C<4>,3|C<3>,3|H<1>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH){1|Fe<10>,1|H<1>,2|C<4>,3|C<3>} C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(P[5]C[5]P[5])(C[6a]C[6a]H){1|Fe<10>,1|H<1>,3|C<3>,3|C<4>} 94.1399 0.000 1 94.1399 0.000 1 94.1399 0.000 1 98.2672 17.109 5 98.2672 17.109 5 95.0518 12.951 15 246 246 727 5:SP3_SP2_SP3 P[5] P[5] C[5,6a] 3:3:4: 3:3:4: 3:3:3: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN){1|H<1>,2|N<3>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN){1|H<1>,2|N<3>,6|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2){1|H<1>,1|P<4>,2|N<3>,4|C<3>} 100.3410 0.000 1 100.3410 0.000 1 101.1468 3.086 3 98.2672 17.109 5 98.2672 17.109 5 95.0518 12.951 15 246 246 727 5:SP3_SP2_SP3 P[5] P[5] C[5,6a] 3:3:4: 3:3:4: 3:3:3: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO){1|H<1>,1|N<3>,1|O<1>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO){1|H<1>,1|N<3>,1|O<1>,6|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2){1|H<1>,1|N<3>,1|O<1>,1|P<4>,4|C<3>} 99.9374 0.000 1 99.9374 0.000 1 101.1468 3.086 3 98.2672 17.109 5 98.2672 17.109 5 95.0518 12.951 15 246 246 727 5:SP3_SP2_SP3 P[5] P[5] C[5,6a] 3:3:4: 3:3:4: 3:3:3: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO){1|Se<1>,1|H<1>,1|O<2>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO){1|Se<1>,1|H<1>,1|O<2>,6|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2){1|Se<1>,1|H<1>,1|O<2>,1|P<4>,4|C<3>} 103.1620 0.000 1 103.1620 0.000 1 101.1468 3.086 3 98.2672 17.109 5 98.2672 17.109 5 95.0518 12.951 15 246 246 727 6:SP3_SP2_SP3 P[3x5,6,6] P[3x5,4x6] C[5,6,6a] 3:3:3: 3:3:3: 3:3:3: P[3x5,4x6]-3:P[4x5,6,6]-3:C[5,6,6a]-3: P[3x5,6,6]-3:P[3x5,6,6]-3:P[3x5,4x6]-3: P[3x5,6,6]-3:C[5,6,6a]-3:C[6a]-3: P[3x5,6,6](P[3x5,4x6]P[3x5,4x6]P[3x5,6,6])(P[4x5,6,6]P[3x5,6,6]P[4x5,6,6])(C[5,6,6a]C[5,6,6a]C[6a]) P[3x5,4x6](P[3x5,6,6]P[4x5,6,6]C[5,6,6a])2(P[3x5,4x6]P[3x5,6,6]2) C[5,6,6a](P[3x5,6,6]P[3x5,4x6]P[4x5,6,6])(C[5,6,6a]P[3x5,6,6]C[6a])(C[6a]C[6a]H) P[3x5,6,6](P[3x5,4x6]P[3x5,4x6]P[3x5,6,6])(P[4x5,6,6]P[3x5,6,6]P[4x5,6,6])(C[5,6,6a]C[5,6,6a]C[6a]){1|H<1>,1|P<3>,3|C<3>} P[3x5,4x6](P[3x5,6,6]P[4x5,6,6]C[5,6,6a])2(P[3x5,4x6]P[3x5,6,6]2){4|C<3>} C[5,6,6a](P[3x5,6,6]P[3x5,4x6]P[4x5,6,6])(C[5,6,6a]P[3x5,6,6]C[6a])(C[6a]C[6a]H){1|C<3>,2|H<1>,3|P<3>} 100.1786 0.821 8 100.1786 0.675 8 100.1786 0.675 8 100.1786 0.675 8 100.1786 0.675 8 100.1786 0.675 8 246 246 790 0:SP3_SP-NON_SP3 P[5] P[5] Cl 3:3:1: 3:3:4: 3: N[5]-3:P[5]-3:Cl-1: P[5]-3:C[5]-3:C-4: P[5]-3: P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl) P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH) Cl(P[5]N[5]P[5]) P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl){1|C<4>,1|H<1>,2|C<3>} P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH){1|C<3>,1|C<4>} Cl(P[5]N[5]P[5]) 92.2885 0.000 1 92.2885 0.000 1 92.2885 0.000 1 92.2885 0.000 1 92.2885 0.000 1 92.2885 0.000 1 246 246 818 0:SP3_SP2_SP3 P[5,6] P[5,6] C[5] 3:3:3: 3:3:3: 3:3:3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[6a]-3:C[5]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){1|H<1>,3|C<4>,6|C<3>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){1|H<1>,3|C<4>,6|C<3>} C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C){2|C<4>,2|H<1>,4|C<3>} 102.1065 1.232 2 102.1065 1.519 2 102.1065 1.519 2 102.1065 1.519 2 101.9892 0.859 4 100.9237 8.611 15 246 246 818 0:SP3_SP2_SP3 P[5,6] P[5,6] C[5] 3:3:3: 3:4:3: 3:3:3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[5,6]-4:C[5]-3: P[5,6]-3:C[6a]-3:C[5]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]) C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){3|C<4>,3|H<1>,5|C<3>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]){3|C<4>,5|C<3>} C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C){2|H<1>,3|C<3>,3|C<4>} 102.5800 0.000 1 102.5800 0.000 1 102.5800 0.000 1 102.5800 0.000 1 101.9892 0.859 4 100.9237 8.611 15 246 246 818 0:SP3_SP2_SP3 P[5,6] P[5,6] C[5] 3:4:3: 3:3:3: 3:3:3: P[5,6]-3:C[5,6]-4:C[5]-3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[5]-3:C[6a]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) C[5](P[5,6]C[5,6]P[5,6])(C[5]C[5,6]C)(C[6a]C[6a]2) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]){3|C<4>,5|C<3>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){3|C<4>,3|H<1>,5|C<3>} C[5](P[5,6]C[5,6]P[5,6])(C[5]C[5,6]C)(C[6a]C[6a]2){2|C<4>,4|C<3>,4|H<1>} 101.1640 0.000 1 101.1640 0.000 1 101.1640 0.000 1 101.1640 0.000 1 101.9892 0.859 4 100.9237 8.611 15 246 246 818 0:SP3_SP2_SP3 P[5] P[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:P[5]-3: C[5]-3:C[5]-3:P[5]-3: C[5,6]-3:C[5a]-3:P[5]-3: P[5](C[5]C[5,6]C[5a])2(P[5]C[5]2) P[5](C[5]C[5,6]C[5a])2(P[5]C[5]2) C[5](C[5,6]C[5,6]C[6])(C[5a]C[5a]S[5a])(P[5]C[5]P[5]) P[5](C[5]C[5,6]C[5a])2(P[5]C[5]2){2|C<4>,2|S<2>,6|C<3>} P[5](C[5]C[5,6]C[5a])2(P[5]C[5]2){2|C<4>,2|S<2>,6|C<3>} C[5](C[5,6]C[5,6]C[6])(C[5a]C[5a]S[5a])(P[5]C[5]P[5]){2|C<4>,3|H<1>,5|C<3>} 101.5567 2.952 8 101.5567 8.716 8 101.5567 8.716 8 101.5567 8.716 8 100.5362 11.179 11 100.9237 8.611 15 246 246 818 0:SP3_SP2_SP3 P[5] P[5] C[5] 3:3:3: 4:3:1: 4:3:3: P[5]-3:P[5]-3:C[5]-3: C[5,5]-4:P[5]-3:H-1: C[5]-4:C[5]-3:P[5]-3: P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2) P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H) C[5](C[5]C[5,6]HH)(C[5]C[5,6]H)(P[5]P[5]2) P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2){1|C<4>,5|C<3>,5|H<1>} P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H){1|C<4>,2|H<1>,4|C<3>} C[5](C[5]C[5,6]HH)(C[5]C[5,6]H)(P[5]P[5]2){1|C<2>,1|H<1>,2|C<3>,2|C<4>} 96.8245 0.000 1 96.8245 0.000 1 96.8245 0.000 1 96.8245 0.000 1 100.5362 11.179 11 100.9237 8.611 15 246 246 818 0:SP3_SP2_SP3 P[5] P[5] C[5] 3:3:3: 4:3:3: 4:3:3: P[5]-3:P[5]-3:C[5]-3: C[5,5]-4:P[5]-3:C[5]-3: C[5]-4:C[5]-3:P[5]-3: P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2) P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2) C[5](C[5]C[5,6]HH)(C[5]C[5,6]H)(P[5]P[5]2) P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2){1|C<4>,5|C<3>,5|H<1>} P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2){1|C<4>,5|H<1>,6|C<3>} C[5](C[5]C[5,6]HH)(C[5]C[5,6]H)(P[5]P[5]2){1|C<2>,1|H<1>,2|C<3>,2|C<4>} 101.3730 0.000 1 101.3730 0.000 1 101.3730 0.000 1 101.3730 0.000 1 100.5362 11.179 11 100.9237 8.611 15 246 246 818 0:SP3_SP2_SP3 P[5] P[5] C[5] 4:3:3: 3:3:3: 3:4:3: C[5,5]-4:P[5]-3:C[5]-3: P[5]-3:P[5]-3:C[5]-3: P[5]-3:C[5]-4:C[5]-3: P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2) P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2) C[5](P[5]C[5,5]P[5])(C[5]C[5,6a]HH)(C[5]C[5,6a]H) P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2){1|C<4>,5|H<1>,6|C<3>} P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2){1|C<4>,5|C<3>,5|H<1>} C[5](P[5]C[5,5]P[5])(C[5]C[5,6a]HH)(C[5]C[5,6a]H){1|C<4>,1|H<1>,1|P<3>,4|C<3>} 95.2480 0.000 1 95.2480 0.000 1 95.2480 0.000 1 95.2480 0.000 1 100.5362 11.179 11 100.9237 8.611 15 246 246 818 5:SP3_SP2_SP3 P[5,5] P[5,5] C[5] 3:3:3: 3:3:3: 3:3:1: P[5,5]-3:C[5]-3:C[5]-3: N[5]-3:N[5]-3:P[5,5]-3: P[5,5]-3:C[5]-3:H-1: P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2 P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2) C[5](P[5,5]P[5,5]C[5])(C[5]N[5]C)(H) P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2{2|C<3>,2|C<4>} P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2){2|C<4>,2|H<1>,4|C<3>} C[5](P[5,5]P[5,5]C[5])(C[5]N[5]C)(H){1|H<1>,1|N<3>,2|C<3>} 89.7696 1.506 2 89.7696 2.267 2 89.7696 2.267 2 89.7696 2.267 2 90.3256 1.168 4 93.2272 33.132 9 246 246 818 5:SP3_SP2_SP3 P[5,5] P[5,5] C[5] 3:4:3: 3:4:3: 3:3:2: P[5,5]-3:C[5]-4:C[5]-3: P[5,5]-3:C[5]-4:C[5]-3: P[5,5]-3:C[5]-3:O-2: P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O) P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O) C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(OSi) P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O){1|H<1>,1|O<2>,3|C<4>} P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O){1|H<1>,1|O<2>,3|C<4>} C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(OSi){2|C<3>,2|C<4>,2|H<1>} 90.8817 0.000 2 90.8817 0.000 2 90.8817 0.000 2 90.8817 0.000 2 90.3256 1.168 4 93.2272 33.132 9 246 246 818 5:SP3_SP2_SP3 P[5,6] P[5,6] C[5,6] 3:3:4: 3:3:4: 3:3:3: P[5,6]-3:C[5,6]-3:C[5]-4: P[5,6]-3:C[5,6]-3:Ge[5]-4: P[5,6]-3:P[5,6]-3:C-3: P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC) C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH) P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH){1|C<3>,1|P<3>,5|C<4>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC){1|Ge<4>,1|C<3>,1|P<3>,2|C<4>,2|H<1>} C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH){1|Ge<4>,1|C<3>,1|H<1>,4|C<4>} 105.2110 0.000 1 105.2110 0.000 1 105.2110 0.000 1 103.0085 9.702 2 103.0085 9.702 2 93.2272 33.132 9 246 246 818 5:SP3_SP2_SP3 P[5,6] P[5,6] C[5,6] 3:3:4: 3:3:4: 3:3:3: P[5,6]-3:C[5,6]-3:Ge[5]-4: P[5,6]-3:C[5,6]-3:C[5]-4: P[5,6]-3:P[5,6]-3:C-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC) P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH) C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC){1|Ge<4>,1|C<3>,1|P<3>,2|C<4>,2|H<1>} P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH){1|C<3>,1|P<3>,5|C<4>} C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH){1|Ge<4>,1|C<3>,1|H<1>,4|C<4>} 100.8060 0.000 1 100.8060 0.000 1 100.8060 0.000 1 103.0085 9.702 2 103.0085 9.702 2 93.2272 33.132 9 246 246 818 5:SP3_SP2_SP3 P[5,6] P[5,6] C[5] 3:4:3: 3:3:4: 3:3:1: P[5,6]-3:C[6]-4:C[5]-3: P[5,6]-3:N[5]-3:C[6]-4: P[5,6]-3:C[5]-3:O-1: P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O) P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH) C[5](P[5,6]P[5,6]C[6])(C[5]N[5]C)(O) P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH){1|C<4>,1|O<1>,2|H<1>,4|C<3>} C[5](P[5,6]P[5,6]C[6])(C[5]N[5]C)(O){1|C<4>,2|C<3>,2|H<1>} 92.2242 0.000 1 92.2242 0.000 1 92.2242 0.000 1 92.2242 0.000 1 92.2242 0.000 1 93.2272 33.132 9 246 246 818 5:SP3_SP2_SP3 P[5] P[5] C[5] 3:3:3: 3:3:3: 3:3:3: P[5]-3:C[6a]-3:C[5]-3: N[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[5]-3:C-3: P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C) P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) C[5](P[5]C[6a]P[5])(C[5]N[5]C)(CCN) P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|C<4>,2|H<1>,5|C<3>} P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>} C[5](P[5]C[6a]P[5])(C[5]N[5]C)(CCN){4|C<3>} 90.6585 0.000 1 90.6585 0.000 1 90.6585 0.000 1 90.6585 0.000 1 89.7506 1.649 2 93.2272 33.132 9 246 246 818 5:SP3_SP2_SP3 P[5] P[5] C[5] 3:3:4: 3:3:1: 3:3:1: P[5]-3:C[5]-3:C-4: N[5]-3:P[5]-3:Cl-1: C[5]-3:P[5]-3:H-1: P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH) P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl) C[5](C[5]N[5]C)(P[5]P[5]C)(H) P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH){1|C<3>,1|C<4>} P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl){1|C<4>,1|H<1>,2|C<3>} C[5](C[5]N[5]C)(P[5]P[5]C)(H){1|Cl<1>,1|C<3>} 88.8426 0.000 1 88.8426 0.000 1 88.8426 0.000 1 88.8426 0.000 1 89.7506 1.649 2 93.2272 33.132 9 246 246 818 6:SP3_SP2_SP3 P[5,6] P[5,6] C[5,6] 3:3:3: 3:3:3: 3:4:3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[6]-4:C[5]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) C[5,6](P[5,6]P[5,6]C[5])(C[6]C[6a]C[6]H)(C[5]C[5]C) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){1|H<1>,3|C<4>,6|C<3>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){1|H<1>,3|C<4>,6|C<3>} C[5,6](P[5,6]P[5,6]C[5])(C[6]C[6a]C[6]H)(C[5]C[5]C){1|C<4>,1|H<1>,6|C<3>} 89.5653 0.754 2 89.5653 0.568 2 89.5653 0.568 2 89.5653 0.568 2 92.0294 18.499 3 92.0294 18.499 3 246 246 818 6:SP3_SP2_SP3 P[5,6] P[5,6] C[5,6] 3:3:3: 3:4:3: 4:3:3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[5,6]-4:C[5]-3: C[6]-4:P[5,6]-3:C[5]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]) C[5,6](C[6]C[5,6]C[6a]H)(P[5,6]P[5,6]C[5])(C[5]C[5]C) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){3|C<4>,3|H<1>,5|C<3>} P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]){3|C<4>,5|C<3>} C[5,6](C[6]C[5,6]C[6a]H)(P[5,6]P[5,6]C[5])(C[5]C[5]C){3|C<4>,5|C<3>} 96.9576 0.000 1 96.9576 0.000 1 96.9576 0.000 1 96.9576 0.000 1 92.0294 18.499 3 92.0294 18.499 3 246 246 852 5:SP3_SP3_SP3 P[3x5,6] P[4x5] P[3,5,5,6] 3:3:3: 3:3:3: 3:3:3: P[3,5,5,6]-3:P[3,5,6]-3:P[4x5]-3: P[3x5,6]-3:P[3x5,6]-3:P[5,5]-3: P[3,5,5,6]-3:P[3,5,5]-3:P[3x5,6]-3: P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]P[3])(P[4x5]P[3x5,6]P[5,5]) P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P) P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]P[5,5])(P[3x5,6]P[3,5,6]P[4x5]) P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]P[3])(P[4x5]P[3x5,6]P[5,5]){2|P<2>} P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P){1|P<3>} P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]P[5,5])(P[3x5,6]P[3,5,6]P[4x5]){1|P<2>,2|P<3>} 102.9460 0.202 2 102.9460 0.041 2 102.9460 0.041 2 102.9460 0.041 2 101.1999 4.101 4 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[3x5,6] P[4x5] P[3,5,5,6] 3:3:3: 3:3:4: 3:3:3: P[3,5,5,6]-3:P[3,5,6]-3:P[4x5]-3: P[3x5,6]-3:P[3x5,6]-3:C[5,5]-4: P[3,5,5,6]-3:P[3,5,5]-3:P[3x5,6]-3: P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]) P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(C[5,5]P[3,5,5]C[6a]2) P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]C[5,5])(P[3x5,6]P[3,5,6]P[4x5]) P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]){2|C<3>,3|O<2>} P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(C[5,5]P[3,5,5]C[6a]2){1|Nb<5>,4|C<3>} P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]C[5,5])(P[3x5,6]P[3,5,6]P[4x5]){1|Nb<5>,1|P<3>,2|C<3>} 99.4538 0.256 2 99.4538 0.066 2 99.4538 0.066 2 99.4538 0.066 2 101.1999 4.101 4 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[3x5,6] P[4x5] P[3,5,6] 3:3:3: 3:3:3: 3:3:3: P[3,5,5,6]-3:P[3,5,6]-3:P[4x5]-3: P[3x5,6]-3:P[3x5,6]-3:P[5,5]-3: P[3x5,6]-3:P[3,5,6]-3:P[3]-3: P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]P[3])(P[4x5]P[3x5,6]P[5,5]) P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P) P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]P[3])(P[3]P[3,5,6]P) P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]P[3])(P[4x5]P[3x5,6]P[5,5]){2|P<2>} P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P){1|P<3>} P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]P[3])(P[3]P[3,5,6]P){3|P<3>} 101.6810 0.945 2 101.6810 0.892 2 101.6810 0.892 2 101.6810 0.892 2 101.8598 0.454 4 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[3x5,6] P[4x5] P[3,5,6] 3:3:3: 3:3:4: 3:3:5: P[3,5,5,6]-3:P[3,5,6]-3:P[4x5]-3: P[3x5,6]-3:P[3x5,6]-3:C[5,5]-4: P[3x5,6]-3:P[3,5,6]-3:Nb[3]-5: P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]) P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(C[5,5]P[3,5,5]C[6a]2) P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]Nb[3])(Nb[3]P[3,5,6]O3) P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]){2|C<3>,3|O<2>} P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(C[5,5]P[3,5,5]C[6a]2){1|Nb<5>,4|C<3>} P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]Nb[3])(Nb[3]P[3,5,6]O3){1|C<4>,2|P<3>} 102.0385 0.583 2 102.0385 0.340 2 102.0385 0.340 2 102.0385 0.340 2 101.8598 0.454 4 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5,6] P[3x5,6] P[3,5,5] 3:3:3: 3:3:4: 3:3:3: P[3x5,6]-3:P[5,5,6]-3:P[3,5,5]-3: P[5,5,6]-3:P[5,5,6]-3:Ga[5,5,6]-4: P[3,5,5]-3:P[3,5,5]-3:P[5,5,6]-3: P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2) P[3x5,6](P[5,5,6]P[3,5,5]P[5,5,6])2(Ga[5,5,6]P[3,5,5]N[6]2) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5,6])(P[5,5,6]P[3x5,6]P[5,5,6]) P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2){1|Ga<4>,2|N<3>,3|P<3>} P[3x5,6](P[5,5,6]P[3,5,5]P[5,5,6])2(Ga[5,5,6]P[3,5,5]N[6]2){3|P<3>,4|C<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5,6])(P[5,5,6]P[3x5,6]P[5,5,6]){2|N<3>,3|P<3>} 104.7212 0.183 4 104.7212 0.033 4 104.7212 0.033 4 104.7212 0.033 4 104.7212 0.033 4 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5,6] P[5,5,6] P[3,5,5] 3:3:3: 3:3:3: 3:3:3: P[3x5,6]-3:P[5,5,6]-3:P[3,5,5]-3: P[3x5,6]-3:P[5,5,6]-3:P[3,5,5]-3: P[3,5,5]-3:P[3,5,5]-3:P[5,5,6]-3: P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2) P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5,6])(P[5,5,6]P[3x5,6]P[5,5,6]) P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2){1|Ga<4>,2|N<3>,3|P<3>} P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2){1|Ga<4>,2|N<3>,3|P<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5,6])(P[5,5,6]P[3x5,6]P[5,5,6]){2|N<3>,3|P<3>} 96.9688 0.759 4 96.9688 0.576 4 96.9688 0.576 4 96.9688 0.576 4 96.9688 0.576 4 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5] P[3x5] P[3,5,5] 3:3:1: 3:3:3: 3:3:3: P[3,5,5]-3:P[3x5]-3:H-1: P[5,5]-3:P[5,5]-3:P[5,5]-3: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2)(H) P[3x5](P[5,5]P[3,5,5]Ag)2(P[5,5]P[3,5,5]H) P[3,5,5](P[3,5,5]P[3,5,5]P[5,5])2(P[5,5]P[3x5]H) P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2)(H){2|Ag<3>} P[3x5](P[5,5]P[3,5,5]Ag)2(P[5,5]P[3,5,5]H) P[3,5,5](P[3,5,5]P[3,5,5]P[5,5])2(P[5,5]P[3x5]H){2|Ag<3>} 102.3000 0.000 1 102.3000 0.000 1 102.3000 0.000 1 102.3000 0.000 1 104.6392 2.455 5 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5] P[3x5] P[3,5,5] 3:3:4: 4:3:3: 3:3:3: P[3x5]-3:P[3,5,5]-3:C-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]C) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3){1|Ga<4>,2|N<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|Cl<1>,2|N<3>,4|C<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]C){1|Ga<4>,2|N<3>} 106.2040 0.000 1 106.0365 0.056 2 106.0365 0.056 2 105.2240 0.993 4 104.6392 2.455 5 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5] P[3x5] P[3,5,5] 3:3:4: 4:3:3: 3:3:3: P[3x5]-3:P[3,5,5]-3:C-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]C) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3){1|Ga<4>,2|N<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|O<2>,2|N<3>,4|C<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]C){1|Ga<4>,2|N<3>} 105.8690 0.000 1 106.0365 0.056 2 106.0365 0.056 2 105.2240 0.993 4 104.6392 2.455 5 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5] P[3x5] P[3,5,5] 3:3:4: 4:3:3: 3:3:3: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl){1|C<4>,2|N<3>,4|C<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|Cl<1>,2|N<3>,4|C<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]){1|Cl<1>,1|C<4>,4|N<3>} 104.0360 0.000 1 104.0360 0.000 1 104.4115 0.282 2 105.2240 0.993 4 104.6392 2.455 5 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5] P[3x5] P[3,5,5] 3:3:4: 4:3:3: 3:3:3: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O){1|C<4>,2|N<3>,4|C<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|O<2>,2|N<3>,4|C<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]){1|C<4>,1|O<2>,4|N<3>} 104.7870 0.000 1 104.7870 0.000 1 104.4115 0.282 2 105.2240 0.993 4 104.6392 2.455 5 101.9690 9.257 22 246 246 852 5:SP3_SP3_SP3 P[5,5] P[4x5] P[3,5,5] 3:3:2: 3:3:3: 3:3:3: P[3,5,5]-3:P[4x5]-3:P-2: P[3x5,6]-3:P[3x5,6]-3:P[5,5]-3: P[3,5,5,6]-3:P[3,5,5,6]-3:P[5,5]-3: P[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(PC[5]) P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P) P[3,5,5](P[3,5,5,6]P[3,5,5,6]P[3x5,6])2(P[5,5]P[4x5]P) P[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(PC[5]){2|P<3>} P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P){1|P<3>} P[3,5,5](P[3,5,5,6]P[3,5,5,6]P[3x5,6])2(P[5,5]P[4x5]P){2|P<3>} 101.1230 0.000 1 101.1230 0.000 1 101.1230 0.000 1 101.1230 0.000 1 101.1230 0.000 1 101.9690 9.257 22 246 246 885 5:SP3_SP-NON_SP3 P[3x5,6] P[5,5,6] Ga[5,5,6] 3:3:4: 3:3:3: 3:3:3:3: P[5,5,6]-3:P[5,5,6]-3:Ga[5,5,6]-4: P[3x5,6]-3:P[5,5,6]-3:P[3,5,5]-3: P[3,5,5]-3:P[3x5,6]-3:N[6]-3:N[6]-3: P[3x5,6](P[5,5,6]P[3,5,5]P[5,5,6])2(Ga[5,5,6]P[3,5,5]N[6]2) P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2) Ga[5,5,6](P[3,5,5]P[3,5,5]2)(P[3x5,6]P[5,5,6]2)(N[6]C[6a]C[6])2 P[3x5,6](P[5,5,6]P[3,5,5]P[5,5,6])2(Ga[5,5,6]P[3,5,5]N[6]2){3|P<3>,4|C<3>} P[5,5,6](P[3x5,6]Ga[5,5,6]P[5,5,6])(P[5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5]2){1|Ga<4>,2|N<3>,3|P<3>} Ga[5,5,6](P[3,5,5]P[3,5,5]2)(P[3x5,6]P[5,5,6]2)(N[6]C[6a]C[6])2{2|C<4>,2|P<3>,5|C<3>} 91.7139 0.815 4 91.7139 0.664 4 91.7139 0.664 4 91.7139 0.664 4 91.7139 0.664 4 94.6773 26.289 10 246 246 885 5:SP3_SP-NON_SP3 P[3x5] P[5,5] Ga[5,5,6] 4:3:3: 3:3:4: 3:3:3:3: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3x5]-3:P[3,5,5]-3:C-4: P[3,5,5]-3:N[6]-3:N[6]-3:P[3x5]-3: P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3) Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|Cl<1>,2|N<3>,4|C<3>} P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3){1|Ga<4>,2|N<3>} Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2){1|Ga<4>,3|C<4>,5|C<3>} 102.4880 0.000 1 103.3045 1.333 2 103.3045 1.333 2 97.4283 47.212 4 97.4283 47.212 4 94.6773 26.289 10 246 246 885 5:SP3_SP-NON_SP3 P[3x5] P[5,5] Ga[5,5,6] 4:3:3: 3:3:4: 3:3:3:3: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3x5]-3:P[3,5,5]-3:C-4: P[3,5,5]-3:N[6]-3:N[6]-3:P[3x5]-3: P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3) Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|O<2>,2|N<3>,4|C<3>} P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3){1|Ga<4>,2|N<3>} Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2){1|Ga<4>,3|C<4>,5|C<3>} 104.1210 0.000 1 103.3045 1.333 2 103.3045 1.333 2 97.4283 47.212 4 97.4283 47.212 4 94.6773 26.289 10 246 246 885 5:SP3_SP-NON_SP3 P[3x5] P[5,5] Ga[5,5,6] 4:3:3: 3:3:4: 3:3:3:3: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: P[3,5,5]-3:N[6]-3:N[6]-3:P[3x5]-3: P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl) Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|Cl<1>,2|N<3>,4|C<3>} P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl){1|C<4>,2|N<3>,4|C<3>} Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2){1|Ga<4>,3|C<4>,5|C<3>} 92.5977 0.000 1 92.5977 0.000 1 91.5522 2.186 2 97.4283 47.212 4 97.4283 47.212 4 94.6773 26.289 10 246 246 885 5:SP3_SP-NON_SP3 P[3x5] P[5,5] Ga[5,5,6] 4:3:3: 3:3:4: 3:3:3:3: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: P[3,5,5]-3:N[6]-3:N[6]-3:P[3x5]-3: P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O) Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|O<2>,2|N<3>,4|C<3>} P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O){1|C<4>,2|N<3>,4|C<3>} Ga[5,5,6](P[3,5,5]P[3,5,5]2)(N[6]C[6a]C[6])2(P[3x5]P[5,5]2){1|Ga<4>,3|C<4>,5|C<3>} 90.5067 0.000 1 90.5067 0.000 1 91.5522 2.186 2 97.4283 47.212 4 97.4283 47.212 4 94.6773 26.289 10 246 246 885 5:SP3_SP-NON_SP3 P[5] P[5] Ga[5,5] 4:3:3: 3:3:3: 3:3:3:3: Ga[5,5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: N[5]-3:N[5]-3:P[5]-3:P[5]-3: P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2) Ga[5,5](N[5]C[6a]C[5])2(P[5]C[6a]P[5])2 P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} P[5](P[5]Ga[5,5]C[6a])(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,2|N<3>,7|C<3>} Ga[5,5](N[5]C[6a]C[5])2(P[5]C[6a]P[5])2{10|C<3>,2|H<1>} 95.1019 5.216 2 95.1019 27.212 2 95.1019 27.212 2 95.1019 27.212 2 95.1019 27.212 2 94.6773 26.289 10 246 246 891 5:SP3_SP2_SP3 P[5] P[5] S[5] 2:2:3: 2:2:3: 3:3: S[5]-2:S[5]-2:P[5]-3: S[5]-2:S[5]-2:P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(P[5]S[5]2) P[5](S[5]C[5,6a])2(P[5]S[5]2) S[5](C[5,6a]C[5,6a]C[6a])(P[5]P[5]S[5]) P[5](S[5]C[5,6a])2(P[5]S[5]2){4|C<3>} P[5](S[5]C[5,6a])2(P[5]S[5]2){4|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]P[5]S[5]){1|H<1>,2|C<3>,2|S<2>} 96.8265 0.662 4 96.8265 0.438 4 96.8265 0.438 4 96.8265 0.438 4 96.8265 0.438 4 96.8265 0.438 4 246 246 891 5:SP3_SP3_SP3 P[5,5,6] P[5,6] S[5,5] 2:3:2: 3:2:1: 3:3: S[5,5]-2:P[5,6]-3:S[5,6]-2: P[5,5,6]-3:S[5,6]-2:I-1: P[5,5,6]-3:P[5,5,6]-3: P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]) P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I) S[5,5](P[5,5,6]P[5,6]S[5,6])2 P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]){1|I<1>} P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I){1|P<3>} S[5,5](P[5,5,6]P[5,6]S[5,6])2{2|I<1>} 101.5738 0.275 4 101.5738 0.076 4 101.5738 0.076 4 101.5738 0.076 4 101.5738 0.076 4 101.5738 0.076 4 246 246 891 6:SP3_SP3_SP3 P[5,5,6] P[5,6] S[5,6] 2:3:2: 3:2:1: 3:3: S[5,5]-2:P[5,6]-3:S[5,6]-2: P[5,5,6]-3:S[5,6]-2:I-1: P[5,5,6]-3:P[5,6]-3: P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]) P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I) S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I) P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]){1|I<1>} P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I){1|P<3>} S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I){1|I<1>,1|S<2>} 93.1755 0.634 4 93.1755 0.402 4 93.1755 0.402 4 93.1755 0.402 4 93.1755 0.402 4 97.6909 23.496 8 246 246 891 6:SP3_SP3_SP3 P[5,6] P[5,5,6] S[5,6] 3:2:1: 2:3:2: 3:3: P[5,5,6]-3:S[5,6]-2:I-1: S[5,5]-2:P[5,6]-3:S[5,6]-2: P[5,5,6]-3:P[5,6]-3: P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I) P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]) S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I) P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I){1|P<3>} P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]){1|I<1>} S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I){1|I<1>,1|S<2>} 102.2062 0.229 4 102.2062 0.053 4 102.2062 0.053 4 102.2062 0.053 4 102.2062 0.053 4 97.6909 23.496 8 246 246 940 0:SP3_SP-NON_SP3 P[5,5] P[4x5] P 3:3:2: 3:3:3: 3:3: P[3,5,5]-3:P[4x5]-3:P-2: P[3x5,6]-3:P[3x5,6]-3:P[5,5]-3: P[5,5]-3:C[5]-3: P[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(PC[5]) P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P) P(P[5,5]P[3,5,5]P[4x5])(C[5]N[5]2) P[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(PC[5]){2|P<3>} P[4x5](P[3x5,6]P[3,5,5,6]P[3,5,6])2(P[5,5]P[3,5,5]P){1|P<3>} P(P[5,5]P[3,5,5]P[4x5])(C[5]N[5]2) 100.7330 0.000 1 100.7330 0.000 1 100.7330 0.000 1 100.7330 0.000 1 100.7330 0.000 1 100.7330 0.000 1 246 246 943 0:SP3_SP-NON_SP3 P[5,5] P[3x5] Ga[6] 3:3:4: 4:3:3: 3:3:3:1: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[5,5]-3:N[6]-3:N[6]-3:Cl-1: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(Cl) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl){1|C<4>,2|N<3>,4|C<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|Cl<1>,2|N<3>,4|C<3>} Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(Cl){1|Ga<4>,2|C<4>,3|P<3>,5|C<3>} 106.9790 0.000 1 106.9790 0.000 1 106.9790 0.000 1 106.9790 0.000 1 103.3855 25.826 2 103.3855 25.826 2 246 246 943 0:SP3_SP-NON_SP3 P[5,5] P[3x5] Ga[6] 3:3:4: 4:3:3: 3:3:3:2: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: Ga[5,5,6]-4:P[5,5]-3:P[5,5]-3: P[5,5]-3:N[6]-3:N[6]-3:O-2: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O) P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C) Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(OS) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O){1|C<4>,2|N<3>,4|C<3>} P[3x5](Ga[5,5,6]P[3,5,5]N[6]2)(P[5,5]P[3,5,5]Ga[6])(P[5,5]P[3,5,5]C){1|O<2>,2|N<3>,4|C<3>} Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(OS){1|Ga<4>,2|C<4>,3|P<3>,5|C<3>} 99.7920 0.000 1 99.7920 0.000 1 99.7920 0.000 1 99.7920 0.000 1 103.3855 25.826 2 103.3855 25.826 2 246 246 944 0:SP3_SP-NON_SP3 P[5,6] P[5,5,6] I 3:2:1: 2:3:2: 3: P[5,5,6]-3:S[5,6]-2:I-1: S[5,5]-2:P[5,6]-3:S[5,6]-2: P[5,6]-3: P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I) P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]) I(P[5,6]P[5,5,6]S[5,6]) P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I){1|P<3>} P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]){1|I<1>} I(P[5,6]P[5,5,6]S[5,6]) 96.5557 0.443 4 96.5557 0.197 4 96.5557 0.197 4 96.5557 0.197 4 96.5557 0.197 4 96.5557 0.197 4 246 246 945 0:SP3_SP3_SP3 P[5] P[5] P 3:3:3: 3:4:3: 3:3:4: P[5]-3:P[5]-3:P-3: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:P[5]-3:C-4: P[5](P[5]C[6a]C[5])2(PC[6a]C) P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P) P(C[6a]C[6a]2)(P[5]P[5]2)(CCHH) P[5](P[5]C[6a]C[5])2(PC[6a]C){4|C<3>,4|H<1>} P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P){3|C<3>,4|H<1>} P(C[6a]C[6a]2)(P[5]P[5]2)(CCHH) 95.5003 0.586 2 95.5003 0.344 2 95.5003 0.344 2 95.5003 0.344 2 95.5003 0.344 2 95.5003 0.344 2 246 246 951 0:SP3_SP-NON_SP3 P[5,5] P[3x5] H 3:3:1: 3:3:3: 3: P[3,5,5]-3:P[3x5]-3:H-1: P[5,5]-3:P[5,5]-3:P[5,5]-3: P[5,5]-3: P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2)(H) P[3x5](P[5,5]P[3,5,5]Ag)2(P[5,5]P[3,5,5]H) H(P[5,5]P[3,5,5]P[3x5]) P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2)(H){2|Ag<3>} P[3x5](P[5,5]P[3,5,5]Ag)2(P[5,5]P[3,5,5]H) H(P[5,5]P[3,5,5]P[3x5]) 106.8240 0.000 1 106.8240 0.000 1 106.8240 0.000 1 106.8240 0.000 1 106.8240 0.000 1 97.0318 191.774 2 246 246 951 0:SP3_SP-NON_SP3 P[5] P[5] H 4:3:1: 3:3:3: 3: C[5,5]-4:P[5]-3:H-1: P[5]-3:P[5]-3:C[5]-3: P[5]-3: P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H) P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2) H(P[5]C[5,5]P[5]) P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H){1|C<4>,2|H<1>,4|C<3>} P[5](P[5]C[5,5]C[5])(P[5]C[5,5]H)(C[5]C[5]2){1|C<4>,5|C<3>,5|H<1>} H(P[5]C[5,5]P[5]) 87.2396 0.000 1 87.2396 0.000 1 87.2396 0.000 1 87.2396 0.000 1 87.2396 0.000 1 97.0318 191.774 2 246 246 955 0:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:2: 4:3:2: 3:2:4:4: P[5]-4:P[5]-3:P[5]-2: P[5]-4:P[5]-3:P[5]-2: P[5]-3:N[5]-2:C-4:C-4: P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]) P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]) P[5](P[5]P[5]2)(N[5]P[5])(CCCH)2 P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]){1|N<2>,1|P<4>,4|C<4>} P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]){1|N<2>,1|P<4>,4|C<4>} P[5](P[5]P[5]2)(N[5]P[5])(CCCH)2{1|P<2>,1|P<4>,2|C<4>} 98.7188 1.675 2 98.7188 2.807 2 98.7188 2.807 2 98.7188 2.807 2 98.7188 2.807 2 98.7188 2.807 2 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 3:3:4: 3:3:3: 3:3:4:4: P[5]-3:C[6a]-3:P[5]-4: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(CH3)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC){2|H<1>,6|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|C<4>,2|H<1>,7|C<3>} P[5](P[5]C[6a]P[5])2(CH3)2{6|C<3>} 94.1558 3.183 2 94.1558 10.134 2 94.1558 10.134 2 94.1558 10.134 2 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 3:3:4: 3:3:4: 3:3:2:1: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:O-2:Se-1: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(OC)(Se) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO){1|Se<1>,1|H<1>,1|O<2>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO){1|Se<1>,1|H<1>,1|O<2>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(OC)(Se){1|H<1>,1|P<4>,4|C<3>} 95.1555 0.000 1 95.1555 0.000 1 95.1555 0.000 1 95.1555 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 3:3:4: 3:3:4: 3:3:3:1: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:N-3:O-1: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)(O) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO){1|H<1>,1|N<3>,1|O<1>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO){1|H<1>,1|N<3>,1|O<1>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)(O){1|H<1>,1|P<4>,4|C<3>} 96.6457 0.000 1 96.6457 0.000 1 96.6457 0.000 1 96.6457 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 3:3:4: 3:3:4: 3:3:3:3: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a]-3:P[5]-3:N-3:N-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN){1|H<1>,2|N<3>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN){1|H<1>,2|N<3>,6|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)2{1|H<1>,1|P<4>,4|C<3>} 97.7135 0.000 1 97.7135 0.000 1 97.7135 0.000 1 97.7135 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 3:4:4: 3:3:4: 3:3:4:4: P[5]-3:C[6]-4:P[5]-4: P[5]-3:P[5]-3:C[6]-4: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) P[5](P[5]C[6]P[5])2(C[6]C[6]2H) P[5](P[5]C[6]P[5])2(CH3)2 P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,6|C<4>} P[5](P[5]C[6]P[5])2(C[6]C[6]2H){6|H<1>,9|C<4>} P[5](P[5]C[6]P[5])2(CH3)2{2|H<1>,6|C<4>} 96.5362 1.081 4 96.5362 1.168 4 96.5362 1.168 4 96.5362 1.168 4 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 3:4:4: 4:3:4: 3:3:4:4: P[5]-3:C[6]-4:P[5]-4: P[5]-4:P[5]-3:C[6]-4: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H) P[5](P[5]C[6]P[5])2(CH3)2 P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,7|C<4>} P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,9|C<4>} P[5](P[5]C[6]P[5])2(CH3)2{2|H<1>,7|C<4>} 101.7860 0.000 1 101.7860 0.000 1 101.7860 0.000 1 101.7860 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:3: 3:3:3: 3:3:3:3: P[5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)2 P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|H<1>,9|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)2{10|C<3>,4|H<1>} 94.0814 3.451 2 94.0814 11.911 2 94.0814 11.911 2 94.0814 11.911 2 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:3: 3:3:3: 3:3:3:4: P[5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3:C-4: P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)(CC3) P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){1|C<4>,2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)(CC3){2|H<1>,8|C<3>} 93.5462 6.752 2 93.5462 45.586 2 93.5462 45.586 2 93.5462 45.586 2 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:3: 3:3:3: 4:3:3:4: P[5]-4:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6a]-3: P[5]-4:P[5]-3:C[6a]-3:B-4: P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2) P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2)(BH3) P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2){1|B<4>,2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2){2|B<4>,2|H<1>,8|C<3>} P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2)(BH3){2|H<1>,8|C<3>} 97.6124 5.179 4 97.6124 26.821 4 97.6124 26.821 4 97.6124 26.821 4 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:4: 3:2:4: 3:3:4:4: P[5]-4:P[5]-3:C-4: P[5]-3:N[5]-2:C-4: C[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3) P[5](P[5]P[5]C)(N[5]C[5])(CC3) P[5](C[5]N[5]C)(P[5]P[5]C)(CC3)(CH3) P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3){1|C<4>} P[5](P[5]P[5]C)(N[5]C[5])(CC3){3|C<4>} P[5](C[5]N[5]C)(P[5]P[5]C)(CC3)(CH3){1|C<4>} 90.6812 0.000 1 90.6812 0.000 1 90.6812 0.000 1 90.6812 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:4: 3:4:4: 3:3:4:4: P[5]-4:P[5]-3:C[6]-4: P[5]-3:C[6]-4:P[5]-4: P[5]-3:P[5]-3:C[6]-4:C-4: P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H) P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3) P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,9|C<4>} P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,7|C<4>} P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3){6|H<1>,9|C<4>} 105.2270 0.000 1 105.2270 0.000 1 105.2270 0.000 1 105.2270 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:4: 4:3:4: 3:3:3:3: P[5]-4:P[5]-3:C-4: P[5]-4:P[5]-3:C-4: C[6a]-3:C[6a]-3:P[5]-3:P[5]-3: P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3) P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3) P[5](C[6a]C[6a]2)2(P[5]P[5]C)2 P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3){3|C<4>,4|C<3>} P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3){1|C<4>,2|C<3>} P[5](C[6a]C[6a]2)2(P[5]P[5]C)2{3|C<4>,4|C<3>,4|H<1>} 93.9588 0.000 1 93.9588 0.000 1 93.9588 0.000 1 93.9588 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:4: 4:3:4: 3:3:4:3: P[5]-4:P[5]-3:C-4: P[5]-4:P[5]-3:C-4: C[6a]-3:C[6a]-3:C[5]-4:P[5]-3: P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH) P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH) P[5](C[6a]C[6a]2)2(C[5]P[5]HH)(P[5]P[5]C) P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH){2|H<1>,6|C<3>} P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH){2|H<1>,6|C<3>} P[5](C[6a]C[6a]2)2(C[5]P[5]HH)(P[5]P[5]C){1|C<4>,4|H<1>,6|C<3>} 97.4231 0.451 2 97.4231 0.204 2 97.4231 0.204 2 97.4231 0.204 2 96.2562 15.273 24 96.2562 15.273 24 246 246 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:3:4: 4:3:4: 3:3:4:4: P[5]-4:P[5]-3:C-4: P[5]-4:P[5]-3:C-4: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3) P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3) P[5](P[5]P[5]C)2(CH3)2 P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3){1|C<4>,2|C<3>} P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3){3|C<4>,4|C<3>} P[5](P[5]P[5]C)2(CH3)2{1|C<4>,2|C<3>} 93.9722 0.000 1 93.9722 0.000 1 93.9722 0.000 1 93.9722 0.000 1 96.2562 15.273 24 96.2562 15.273 24 246 246 960 5:SP3_SP2_SP3 P[5] P[5] N[5] 3:2:4: 4:3:4: 3:3: P[5]-3:N[5]-2:C-4: P[5]-4:P[5]-3:C-4: C[5]-3:P[5]-3: P[5](P[5]P[5]C)(N[5]C[5])(CC3) P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3) N[5](C[5]P[5]C)(P[5]P[5]C) P[5](P[5]P[5]C)(N[5]C[5])(CC3){3|C<4>} P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3){1|C<4>} N[5](C[5]P[5]C)(P[5]P[5]C){3|C<4>} 99.7246 0.000 1 99.7246 0.000 1 99.7246 0.000 1 99.7246 0.000 1 99.7246 0.000 1 99.7246 0.000 1 246 246 974 5:SP3_SP2_SP3 P[5] P[5] As[5] 3:4:2: 3:3:4: 3:3: P[5]-3:C[6]-4:As[5]-2: P[5]-3:P[5]-3:C[6]-4: P[5]-3:P[5]-3: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]) P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H) As[5](P[5]C[6]P[5])2 P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]){5|H<1>,6|C<4>} P[5](P[5]As[5]C[6])(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,7|C<4>} As[5](P[5]C[6]P[5])2{2|H<1>,6|C<4>} 105.8680 0.874 2 105.8680 0.764 2 105.8680 0.764 2 105.8680 0.764 2 105.8680 0.764 2 105.8680 0.764 2 246 246 987 0:SP3_SP-NON_SP3 P[5] P[5] P[5] 4:3:2: 4:3:2: 4:3: P[5]-4:P[5]-3:P[5]-2: P[5]-4:P[5]-3:P[5]-2: P[5]-4:P[5]-3: P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]) P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]) P[5](P[5]N[5]CC)(P[5]P[5]2) P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]){1|N<2>,1|P<4>,4|C<4>} P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]){1|N<2>,1|P<4>,4|C<4>} P[5](P[5]N[5]CC)(P[5]P[5]2){1|P<2>,1|P<4>,2|C<4>} 107.4170 1.908 2 107.4170 3.640 2 107.4170 3.640 2 107.4170 3.640 2 107.4170 3.640 2 107.4170 3.640 2 246 362 362 5:SP3_SPD6_SPD6 P[5] C[5x3,6x5,20x6] C[5x3,6x5,20x6] 6:6:3: 6:6:6:6:6:3: 6:6:6:6:6:3: C[5x3,6x5,20x6]-6:C[5x3,6x5,20x6]-6:C[6a]-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(C[6a]C[6a]2) C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5x3,6x5,20x6]C[6a]) C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5x3,6x5,20x6]C[6a]) P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(C[6a]C[6a]2){10|B<6>,10|H<1>,2|C<3>} C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5x3,6x5,20x6]C[6a]){2|C<3>,5|H<1>,7|B<6>} C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5x3,6x5,20x6]C[6a]){2|C<3>,5|H<1>,7|B<6>} 92.9948 0.000 1 92.9948 0.000 1 92.9948 0.000 1 92.9948 0.000 1 92.9948 0.000 1 92.9948 0.000 1 246 362 542 0:SP3_SP3_SPD6 P[5] C[5x3,5x5,20x6] N[5] 6:3:3: 6:6:6:6:6:3: 3:4:4: C[5x3,5x5,20x6]-6:N[5]-3:N[5]-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: P[5]-3:C[5]-4:C-4: P[5](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[5]C[5]C)2 C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4P[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]N[5]2) N[5](P[5]C[5x3,5x5,20x6]N[5])(C[5]C[5]HH)(CCCH) P[5](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[5]C[5]C)2{1|P<3>,5|B<6>,8|H<1>} C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4P[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]N[5]2){1|B<6>,2|N<3>,4|C<4>,5|H<1>} N[5](P[5]C[5x3,5x5,20x6]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,1|C<6>,2|H<1>,4|B<6>} 101.4311 3.017 4 101.4311 9.100 4 101.4311 9.100 4 101.4311 9.100 4 101.4311 9.100 4 101.4311 9.100 4 246 362 542 5:SP3_SP2_SPD6 P[5] C[5x3,6x5,20x6] N[5] 6:3:3: 6:6:6:6:6:3: 3:3:4: C[5x3,6x5,20x6]-6:C[6a]-3:N[5]-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: P[5]-3:C[5]-3:C-4: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[6a]C[6a]2)(N[5]C[5]C) C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[6a]N[5]) N[5](P[5]C[5x3,6x5,20x6]C[6a])(C[5]C[5x3,6x5,20x6]N)(CCCH) P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[6a]C[6a]2)(N[5]C[5]C){1|N<2>,2|C<3>,5|B<6>,6|H<1>} C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[6a]N[5]){1|B<6>,1|C<4>,1|N<2>,2|C<3>,5|H<1>} N[5](P[5]C[5x3,6x5,20x6]C[6a])(C[5]C[5x3,6x5,20x6]N)(CCCH){2|C<3>,6|B<6>} 90.9808 0.000 1 90.9808 0.000 1 90.9808 0.000 1 90.9808 0.000 1 90.9808 0.000 1 90.9808 0.000 1 246 362 643 0:SP3_SP2_SPD6 P[5] C[5x3,6x5,20x6] C[6a] 6:3:3: 6:6:6:6:6:3: 3:3:3: C[5x3,6x5,20x6]-6:C[6a]-3:N[5]-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[6a]C[6a]2)(N[5]C[5]C) C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[6a]N[5]) C[6a](P[5]C[5x3,6x5,20x6]N[5])(C[6a]C[6a]H)2 P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[6a]C[6a]2)(N[5]C[5]C){1|N<2>,2|C<3>,5|B<6>,6|H<1>} C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[6a]N[5]){1|B<6>,1|C<4>,1|N<2>,2|C<3>,5|H<1>} C[6a](P[5]C[5x3,6x5,20x6]N[5])(C[6a]C[6a]H)2{1|C<4>,1|C<6>,2|C<3>,2|H<1>,4|B<6>} 101.2900 0.000 1 101.2900 0.000 1 101.2900 0.000 1 101.2900 0.000 1 104.3763 22.397 3 104.3763 22.397 3 246 362 643 0:SP3_SP2_SPD6 P[5] C[5x3,6x5,20x6] C[6a] 6:6:3: 6:6:6:6:6:3: 3:3:3: C[5x3,6x5,20x6]-6:C[5x3,6x5,20x6]-6:C[6a]-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(C[6a]C[6a]2) C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5x3,6x5,20x6]C[6a]) C[6a](P[5]C[5x3,6x5,20x6]2)(C[6a]C[6a]H)2 P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(C[6a]C[6a]2){10|B<6>,10|H<1>,2|C<3>} C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5x3,6x5,20x6]C[6a]){2|C<3>,5|H<1>,7|B<6>} C[6a](P[5]C[5x3,6x5,20x6]2)(C[6a]C[6a]H)2{1|C<3>,2|C<6>,2|H<1>,8|B<6>} 105.9195 5.523 2 105.9195 30.506 2 105.9195 30.506 2 105.9195 30.506 2 104.3763 22.397 3 104.3763 22.397 3 246 362 818 5:SP3_SP2_SPD6 P[5] C[5x3,6x5,20x6] C[5] 6:3:3: 6:6:6:6:6:3: 3:3:3: C[5x3,6x5,20x6]-6:C[5]-3:N-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: C[5]-3:P[5]-3:P-3: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]C[5]P)(NCC) C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5]N) C[5](C[5]C[5x3,6x5,20x6]C[6a])(P[5]C[5x3,6x5,20x6]N)(PCN) P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]C[5]P)(NCC){1|C<3>,4|H<1>,5|B<6>} C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5]N){1|B<6>,1|C<3>,1|P<3>,5|H<1>} C[5](C[5]C[5x3,6x5,20x6]C[6a])(P[5]C[5x3,6x5,20x6]N)(PCN){2|C<3>,6|B<6>} 89.5883 0.000 1 89.5883 0.000 1 89.5883 0.000 1 89.5883 0.000 1 89.5883 0.000 1 89.5883 0.000 1 246 362 956 0:SP3_SP3_SPD6 P[5] C[5x3,6x5,20x6] N 6:3:3: 6:6:6:6:6:3: 3:4:4: C[5x3,6x5,20x6]-6:C[5]-3:N-3: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:P[5]-3: P[5]-3:C-4:C-4: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]C[5]P)(NCC) C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5]N) N(P[5]C[5x3,6x5,20x6]C[5])(CH3)2 P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]C[5]P)(NCC){1|C<3>,4|H<1>,5|B<6>} C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(P[5]C[5]N){1|B<6>,1|C<3>,1|P<3>,5|H<1>} N(P[5]C[5x3,6x5,20x6]C[5])(CH3)2 108.1040 0.000 1 108.1040 0.000 1 108.1040 0.000 1 108.1040 0.000 1 108.1040 0.000 1 108.1040 0.000 1 246 466 474 0:SP3_SP3_SP3 P[5] C[3x6] C[5] 4:4:3: 4:4:4:3: 4:3:4:1: C[3x6]-4:C[5]-4:P[5]-3: C[6,6]-4:C[6,6]-4:C[6,6]-4:P[5]-3: C[5,5]-4:P[5]-3:C-4:H-1: P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C) C[3x6](C[6,6]C[3x6]HH)3(P[5]C[5]P[5]) C[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]P[5])(CH3)(H) P[5](C[3x6]C[6,6]3)(C[5]C[5,5]CH)(P[5]C[5,5]C){1|Fe<10>,5|C<4>,6|H<1>} C[3x6](C[6,6]C[3x6]HH)3(P[5]C[5]P[5]){4|H<1>,7|C<4>} C[5](C[5,5]C[5,5]C[5]Fe)(P[5]C[3x6]P[5])(CH3)(H){1|H<1>,6|C<4>} 106.5390 0.000 1 106.5390 0.000 1 106.5390 0.000 1 106.5390 0.000 1 111.5853 21.893 3 111.5853 21.893 3 246 466 474 0:SP3_SP3_SP3 P[5] C[3x6] C[5] 4:4:4: 4:4:4:3: 3:4:4:4: C[3x6]-4:C[5]-4:C[5]-4: C[6,6]-4:C[6,6]-4:C[6,6]-4:P[5]-3: P[5]-3:C[5]-4:Si-4:Si-4: P[5](C[3x6]C[6,6]3)(C[5]C[5]Si2)2 C[3x6](C[6,6]C[3x6]HH)3(P[5]C[5]2) C[5](P[5]C[3x6]C[5])(C[5]C[5]HH)(SiC3)2 P[5](C[3x6]C[6,6]3)(C[5]C[5]Si2)2{10|H<1>,3|C<4>} C[3x6](C[6,6]C[3x6]HH)3(P[5]C[5]2){4|Si<4>,3|H<1>,5|C<4>} C[5](P[5]C[3x6]C[5])(C[5]C[5]HH)(SiC3)2{2|Si<4>,2|H<1>,3|C<4>} 114.1085 2.364 2 114.1085 5.588 2 114.1085 5.588 2 114.1085 5.588 2 111.5853 21.893 3 111.5853 21.893 3 246 466 474 6:SP3_SP3_SP3 P[5,6] C[6] C[5,6] 4:4:3: 3:3:1:1: 3:3:4:3: C[5,6]-4:C[6]-4:C[5]-3: P[5,6]-3:C[6]-3:H-1:H-1: P[5,6]-3:C[6a]-3:C[6]-4:C[5]-3: P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(C[5]C[5]C) C[6](P[5,6]C[5,6]C[5])(C[6]C[6]C)(H)2 C[5,6](P[5,6]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]HH)(C[5]C[5]C) P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(C[5]C[5]C){2|H<1>,3|C<3>,3|C<4>} C[6](P[5,6]C[5,6]C[5])(C[6]C[6]C)(H)2{2|C<4>,4|C<3>} C[5,6](P[5,6]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]HH)(C[5]C[5]C){2|C<4>,4|C<3>,4|H<1>} 99.7929 0.000 1 99.7929 0.000 1 99.7929 0.000 1 99.7929 0.000 1 99.7929 0.000 1 99.7929 0.000 1 246 466 542 0:SP3_SP3_SP3 P[5,6] C[6] N[5] 3:3:4: 3:3:1:1: 3:3:3: P[5,6]-3:N[5]-3:C[6]-4: P[5,6]-3:C[6]-3:H-1:H-1: P[5,6]-3:C[6a]-3:C[5]-3: P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH) C[6](P[5,6]P[5,6]N[5])(C[6]C[6]C)(H)2 N[5](P[5,6]P[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]C) P[5,6](P[5,6]C[5]C[6])(N[5]C[6a]C[5])(C[6]C[6]HH){1|C<4>,1|O<1>,2|H<1>,4|C<3>} C[6](P[5,6]P[5,6]N[5])(C[6]C[6]C)(H)2{2|C<4>,3|C<3>} N[5](P[5,6]P[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]C){1|O<1>,2|H<1>,3|C<3>,3|C<4>} 105.6240 0.000 1 105.6240 0.000 1 105.6240 0.000 1 105.6240 0.000 1 105.6240 0.000 1 105.6240 0.000 1 246 466 818 0:SP3_SP2_SP3 P[5,6] C[6] C[5] 3:4:3: 3:3:1:1: 3:3:1: P[5,6]-3:C[6]-4:C[5]-3: P[5,6]-3:C[6]-3:H-1:H-1: P[5,6]-3:C[5]-3:O-1: P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O) C[6](P[5,6]P[5,6]C[5])(C[6]C[6]C)(H)2 C[5](P[5,6]P[5,6]C[6])(C[5]N[5]C)(O) P[5,6](P[5,6]C[6]N[5])(C[6]C[6]HH)(C[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} C[6](P[5,6]P[5,6]C[5])(C[6]C[6]C)(H)2{1|C<3>,1|N<3>,1|O<1>,2|C<4>} C[5](P[5,6]P[5,6]C[6])(C[5]N[5]C)(O){1|C<4>,2|C<3>,2|H<1>} 95.7629 0.000 1 95.7629 0.000 1 95.7629 0.000 1 95.7629 0.000 1 98.4539 14.484 2 98.4539 14.484 2 246 466 818 0:SP3_SP2_SP3 P[5,6] C[6] C[5] 4:4:3: 3:3:1:1: 3:3:3: C[5,6]-4:C[6]-4:C[5]-3: P[5,6]-3:C[6]-3:H-1:H-1: P[5,6]-3:C[5]-3:C-3: P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(C[5]C[5]C) C[6](P[5,6]C[5,6]C[5])(C[6]C[6]C)(H)2 C[5](P[5,6]C[5,6]C[6])(C[5]C[5]C)(CC[6a]H) P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(C[5]C[5]C){2|H<1>,3|C<3>,3|C<4>} C[6](P[5,6]C[5,6]C[5])(C[6]C[6]C)(H)2{2|C<4>,4|C<3>} C[5](P[5,6]C[5,6]C[6])(C[5]C[5]C)(CC[6a]H){2|C<3>,2|C<4>,2|H<1>} 101.1450 0.000 1 101.1450 0.000 1 101.1450 0.000 1 101.1450 0.000 1 98.4539 14.484 2 98.4539 14.484 2 246 466 955 0:SP3_SP3_SP3 P[5] C[6] P[5] 3:4:4: 4:4:3:1: 3:3:4:4: P[5]-3:C[6]-4:P[5]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])2(CH3)2 P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,6|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){2|P<3>,4|C<4>,4|H<1>} P[5](P[5]C[6]P[5])2(CH3)2{2|H<1>,6|C<4>} 102.4952 1.689 4 102.3274 2.281 5 102.3274 2.281 5 102.3274 2.281 5 103.6972 4.548 10 103.6972 4.548 10 246 466 955 0:SP3_SP3_SP3 P[5] C[6] P[5] 3:4:4: 4:4:3:1: 3:3:4:4: P[5]-3:C[6]-4:P[5]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])2(CH3)2 P[5](P[5]C[6]P[5])(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,7|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|P<3>,1|P<4>,4|C<4>,4|H<1>} P[5](P[5]C[6]P[5])2(CH3)2{2|H<1>,7|C<4>} 101.6560 0.000 1 102.3274 2.281 5 102.3274 2.281 5 102.3274 2.281 5 103.6972 4.548 10 103.6972 4.548 10 246 466 955 0:SP3_SP3_SP3 P[5] C[6] P[5] 4:3:4: 4:4:3:1: 3:3:4:4: P[5]-4:P[5]-3:C[6]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5]-3:P[5]-3:C[6]-4:C-4: P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3) P[5](P[5]C[6]P[5]C)(P[5]C[6]P[5])(C[6]C[6]2H){6|H<1>,9|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){1|P<3>,1|P<4>,4|C<4>,4|H<1>} P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3){6|H<1>,9|C<4>} 104.8590 0.000 1 104.8590 0.000 1 104.8590 0.000 1 104.8590 0.000 1 103.6972 4.548 10 103.6972 4.548 10 246 466 955 0:SP3_SP3_SP3 P[5] C[6] P[5] 4:4:4: 4:4:3:1: 3:3:4:4: P[5]-4:C[6]-4:P[5]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6]P[5]C)(C[6]C[6]2H)(P[5]P[5]CC) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])2(CH3)2 P[5](P[5]C[6]P[5]C)(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,6|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){2|P<3>,4|H<1>,5|C<4>} P[5](P[5]C[6]P[5])2(CH3)2{2|H<1>,7|C<4>} 104.7880 0.000 1 104.7880 0.000 1 104.7880 0.000 1 104.0035 1.231 2 103.6972 4.548 10 103.6972 4.548 10 246 466 955 0:SP3_SP3_SP3 P[5] C[6] P[5] 4:4:4: 4:4:3:1: 3:3:4:4: P[5]-4:C[6]-4:P[5]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5]-3:P[5]-3:C[6]-4:C-4: P[5](P[5]C[6]P[5]C)(C[6]C[6]2H)(P[5]P[5]CC) C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3) P[5](P[5]C[6]P[5]C)(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,6|C<4>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){2|P<3>,4|H<1>,5|C<4>} P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3){6|H<1>,9|C<4>} 103.2190 0.000 1 103.2190 0.000 1 103.2190 0.000 1 104.0035 1.231 2 103.6972 4.548 10 103.6972 4.548 10 246 466 955 0:SP3_SP3_SP3 P[5] C[6] P[5] 4:4:4: 4:4:3:1: 3:4:4:4: C[6]-4:P[5]-4:P[5]-4: C[6]-4:C[6]-4:P[5]-3:H-1: P[5]-3:C[5]-4:C-4:C-4: P[5](C[6]C[6]2H)(P[5]C[5]CC)2 C[6](C[6]C[6]HH)2(P[5]P[5]2)(H) P[5](P[5]C[6]P[5])(C[5]C[5]HH)(CH3)2 P[5](C[6]C[6]2H)(P[5]C[5]CC)2{2|C<4>,8|H<1>} C[6](C[6]C[6]HH)2(P[5]P[5]2)(H){4|H<1>,7|C<4>} P[5](P[5]C[6]P[5])(C[5]C[5]HH)(CH3)2{3|H<1>,4|C<4>} 106.2345 2.604 2 106.2345 6.782 2 106.2345 6.782 2 106.2345 6.782 2 103.6972 4.548 10 103.6972 4.548 10 246 466 974 0:SP3_SP2_SP3 P[5] C[6] As[5] 3:4:2: 3:4:4:1: 3:3: P[5]-3:C[6]-4:As[5]-2: P[5]-3:C[6]-4:C[6]-4:H-1: P[5]-3:P[5]-3: P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]) C[6](P[5]As[5]P[5])(C[6]C[6]HH)2(H) As[5](P[5]C[6]P[5])2 P[5](P[5]C[6]P[5])(C[6]C[6]2H)(As[5]P[5]){5|H<1>,6|C<4>} C[6](P[5]As[5]P[5])(C[6]C[6]HH)2(H){2|C<4>,2|P<3>,4|H<1>} As[5](P[5]C[6]P[5])2{2|H<1>,6|C<4>} 107.2930 2.232 2 107.2930 4.980 2 107.2930 4.980 2 107.2930 4.980 2 107.2930 4.980 2 107.2930 4.980 2 246 474 474 0:SP3_SP3_SP3 P[5,5] C[4x5] C[5] 4:4:4: 4:4:3:1: 3:3:3:4: P[3,5,5]-4:C[4x5]-4:C[5]-4: C[3x5,6]-4:C[3x5,6]-4:P[5,5]-3:H-1: P[5,5]-3:C[5]-3:C[5]-3:C-4: P[5,5](P[3,5,5]C[3,5,5,6]2Mo)(C[4x5]C[3x5,6]2H)(C[5]C[5]2C) C[4x5](C[3x5,6]C[3,5,5,6]C[5,6]C)2(P[5,5]P[3,5,5]C[5])(H) C[5](P[5,5]P[3,5,5]C[4x5])(C[5]C[5]C)2(CH3) P[5,5](P[3,5,5]C[3,5,5,6]2Mo)(C[4x5]C[3x5,6]2H)(C[5]C[5]2C){5|C<3>,5|C<4>} C[4x5](C[3x5,6]C[3,5,5,6]C[5,6]C)2(P[5,5]P[3,5,5]C[5])(H){1|Mo<6>,2|C<3>,5|C<4>} C[5](P[5,5]P[3,5,5]C[4x5])(C[5]C[5]C)2(CH3){1|Mo<6>,1|H<1>,6|C<4>} 111.8890 0.000 1 111.8890 0.000 1 111.8890 0.000 1 111.8890 0.000 1 111.8890 0.000 1 111.8890 0.000 1 246 474 474 5:SP3_SP3_SP3 P[5,5] C[5,5,6] C[5,5,6] 4:4:1: 3:3:3:1: 3:3:3:1: C[5,5,6]-4:C[5,5,6]-4:Cl-1: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: P[5,5](C[5,5,6]C[5,6,6a]2H)2(Cl) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]Cl)(H) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]Cl)(H) P[5,5](C[5,5,6]C[5,6,6a]2H)2(Cl){4|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]Cl)(H){3|H<1>,4|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]Cl)(H){3|H<1>,4|C<3>} 80.6147 0.000 1 80.6147 0.000 1 80.6147 0.000 1 80.6147 0.000 1 79.5610 0.837 3 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5,5] C[5,5,6] C[5,5,6] 4:4:3: 3:3:3:1: 3:3:3:1: C[5,5,6]-4:C[5,5,6]-4:N-3: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: P[5,5](C[5,5,6]C[5,6,6a]2H)2(NSi2) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N)(H) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N)(H) P[5,5](C[5,5,6]C[5,6,6a]2H)2(NSi2){4|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N)(H){3|H<1>,4|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N)(H){3|H<1>,4|C<3>} 78.9682 0.000 1 78.9682 0.000 1 78.9682 0.000 1 79.0341 0.009 2 79.5610 0.837 3 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5,5] C[5,5,6] C[5,5,6] 4:4:3: 3:3:3:1: 3:3:3:1: C[5,5,6]-4:C[5,5,6]-4:N[5,5]-3: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: P[5,5](C[5,5,6]C[5,6,6a]2H)2(N[5,5]C[5,5,6]2) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N[5,5])(H) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N[5,5])(H) P[5,5](C[5,5,6]C[5,6,6a]2H)2(N[5,5]C[5,5,6]2){2|H<1>,8|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N[5,5])(H){2|C<4>,3|H<1>,4|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N[5,5])(H){2|C<4>,3|H<1>,4|C<3>} 79.1001 0.000 1 79.1001 0.000 1 79.1001 0.000 1 79.0341 0.009 2 79.5610 0.837 3 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 3:4:4: 3:3:1:1: 3:3:1:1: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-3:H-1:H-1: P[5]-3:C[5]-3:H-1:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]HH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2 C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)2{2|C<3>,2|C<4>,2|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2{2|C<3>,3|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2{2|C<3>,3|H<1>} 90.7156 0.000 1 90.2350 0.462 2 90.2350 0.462 2 90.2350 0.462 2 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 3:4:4: 3:3:1:1: 3:3:1:1: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-3:H-1:H-1: P[5]-3:C[5]-3:H-1:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]HH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2 C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)2{2|H<1>,4|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2{2|C<3>,3|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2{2|C<3>,3|H<1>} 89.7544 0.000 1 90.2350 0.462 2 90.2350 0.462 2 90.2350 0.462 2 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 3:4:4: 3:4:4:1: 3:4:4:1: C[5a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-4:C-4:H-1: P[5]-3:C[5]-4:C-4:H-1: P[5](C[5a]C[5a,6a]C[5a])(C[5]C[5]CH)2 C[5](P[5]C[5a]C[5])(C[5]C[5]HH)(CH3)(H) C[5](P[5]C[5a]C[5])(C[5]C[5]HH)(CH3)(H) P[5](C[5a]C[5a,6a]C[5a])(C[5]C[5]CH)2{1|P<4>,1|S<2>,2|C<3>,4|H<1>} C[5](P[5]C[5a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} C[5](P[5]C[5a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} 93.3163 0.000 1 93.3163 0.000 1 93.3163 0.000 1 92.5914 0.296 4 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 3:4:4: 3:4:4:1: 3:4:4:1: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-4:C-4:H-1: P[5]-3:C[5]-4:C-4:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]CH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H) C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H) P[5](C[6a]C[6a]2)(C[5]C[5]CH)2{1|P<4>,2|C<3>,5|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} 92.3339 0.431 2 92.3498 0.094 3 92.3498 0.094 3 92.5914 0.296 4 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 3:4:4: 3:4:4:1: 3:4:4:1: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-4:C-4:H-1: P[5]-3:C[5]-4:C-4:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]CH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H) C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H) P[5](C[6a]C[6a]2)(C[5]C[5]CH)2{3|C<3>,5|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} 92.3816 0.000 1 92.3498 0.094 3 92.3498 0.094 3 92.5914 0.296 4 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:1: 4:3:4:4: 4:3:4:4: C[5]-4:C[5]-4:Cl-1: C[5]-4:P[5]-3:Si-4:Si-4: C[5]-4:P[5]-3:Si-4:Si-4: P[5](C[5]C[5]Si2)2(Cl) C[5](C[5]C[5]HH)(P[5]C[5]Cl)(SiC3)2 C[5](C[5]C[5]HH)(P[5]C[5]Cl)(SiC3)2 P[5](C[5]C[5]Si2)2(Cl){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]Cl)(SiC3)2{2|Si<4>,2|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]Cl)(SiC3)2{2|Si<4>,2|H<1>} 96.3793 0.000 1 96.3793 0.000 1 96.3793 0.000 1 96.3793 0.000 1 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:3: 3:3:3:1: 3:3:3:1: C[5]-4:C[5]-4:C[6a]-3: N[5,6a]-3:P[5]-3:C[6a]-3:H-1: N[5,6a]-3:P[5]-3:C[6a]-3:H-1: P[5](C[5]N[5,6a]C[6a]H)2(C[6a]C[6a]2) C[5](N[5,6a]N[5,6a]C[6a])(P[5]C[6a]C[5])(C[6a]C[6a]2)(H) C[5](N[5,6a]N[5,6a]C[6a])(P[5]C[6a]C[5])(C[6a]C[6a]2)(H) P[5](C[5]N[5,6a]C[6a]H)2(C[6a]C[6a]2){2|H<1>,8|C<3>} C[5](N[5,6a]N[5,6a]C[6a])(P[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|O<1>,2|H<1>,8|C<3>} C[5](N[5,6a]N[5,6a]C[6a])(P[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|O<1>,2|H<1>,8|C<3>} 88.2030 0.000 1 88.2030 0.000 1 88.2030 0.000 1 88.2030 0.000 1 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:4: 3:4:3:1: 3:4:3:1: C[5]-4:C[5]-4:C-4: C[6a]-3:C[5]-4:P[5]-3:H-1: C[6a]-3:C[5]-4:P[5]-3:H-1: P[5](C[5]C[6a]C[5]H)2(CP[5]HH) C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]C)(H) C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]C)(H) P[5](C[5]C[6a]C[5]H)2(CP[5]HH){4|C<3>,4|H<1>} C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]C)(H){3|C<3>,5|H<1>} C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]C)(H){3|C<3>,5|H<1>} 92.1775 0.951 2 92.1775 0.905 2 92.1775 0.905 2 92.2831 0.328 4 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:4: 3:4:3:1: 3:4:3:1: C[5]-4:C[5]-4:C[5]-4: C[6a]-3:C[5]-4:P[5]-3:H-1: C[6a]-3:C[5]-4:P[5]-3:H-1: P[5](C[5]C[6a]C[5]H)2(C[5]C[5]2Fe) C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]2)(H) C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]2)(H) P[5](C[5]C[6a]C[5]H)2(C[5]C[5]2Fe){2|C<4>,4|C<3>,6|H<1>} C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]2)(H){1|Fe<10>,2|C<4>,3|C<3>,5|H<1>} C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]2)(H){1|Fe<10>,2|C<4>,3|C<3>,5|H<1>} 92.3887 0.186 2 92.3887 0.035 2 92.3887 0.035 2 92.2831 0.328 4 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:4: 3:4:4:4: 3:4:4:4: C[3x6]-4:C[5]-4:C[5]-4: P[5]-3:C[5]-4:Si-4:Si-4: P[5]-3:C[5]-4:Si-4:Si-4: P[5](C[3x6]C[6,6]3)(C[5]C[5]Si2)2 C[5](P[5]C[3x6]C[5])(C[5]C[5]HH)(SiC3)2 C[5](P[5]C[3x6]C[5])(C[5]C[5]HH)(SiC3)2 P[5](C[3x6]C[6,6]3)(C[5]C[5]Si2)2{10|H<1>,3|C<4>} C[5](P[5]C[3x6]C[5])(C[5]C[5]HH)(SiC3)2{2|Si<4>,2|H<1>,3|C<4>} C[5](P[5]C[3x6]C[5])(C[5]C[5]HH)(SiC3)2{2|Si<4>,2|H<1>,3|C<4>} 97.6067 0.000 1 97.6067 0.000 1 97.6067 0.000 1 97.6067 0.000 1 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:4: 4:3:4:1: 4:3:4:1: C[5]-4:C[5]-4:C-4: C[5]-4:P[5]-3:C-4:H-1: C[5]-4:P[5]-3:C-4:H-1: P[5](C[5]C[5]CH)2(CHHN) C[5](C[5]C[5]HH)(P[5]C[5]C)(CH3)(H) C[5](C[5]C[5]HH)(P[5]C[5]C)(CH3)(H) P[5](C[5]C[5]CH)2(CHHN){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(CH3)(H){1|C<4>,3|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(CH3)(H){1|C<4>,3|H<1>} 93.1789 0.000 1 93.1789 0.000 1 93.1789 0.000 1 93.1789 0.000 1 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:4: 4:3:4:4: 4:3:4:4: C[5]-4:C[5]-4:C-4: C[5]-4:P[5]-3:Si-4:Si-4: C[5]-4:P[5]-3:Si-4:Si-4: P[5](C[5]C[5]Si2)2(CC3) C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2 C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2 P[5](C[5]C[5]Si2)2(CC3){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2{2|Si<4>,2|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2{2|Si<4>,2|H<1>} 98.0240 0.000 1 98.0240 0.000 1 97.2095 1.327 2 97.2095 1.327 2 93.1097 7.507 16 90.9704 32.113 19 246 474 474 5:SP3_SP3_SP3 P[5] C[5] C[5] 4:4:4: 4:3:4:4: 4:3:4:4: C[5]-4:C[5]-4:C-4: C[5]-4:P[5]-3:Si-4:Si-4: C[5]-4:P[5]-3:Si-4:Si-4: P[5](C[5]C[5]Si2)2(CH3) C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2 C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2 P[5](C[5]C[5]Si2)2(CH3){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2{2|Si<4>,2|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2{2|Si<4>,2|H<1>} 96.3949 0.000 1 96.3949 0.000 1 97.2095 1.327 2 97.2095 1.327 2 93.1097 7.507 16 90.9704 32.113 19 246 474 474 6:SP3_SP3_SP3 P[5,6] C[5,5,6] C[5,6] 4:4:3: 3:4:4:1: 4:3:1:1: C[5,5,6]-4:C[5,6]-4:C[6a]-3: P[5,6]-3:C[5,5]-4:C[5,6]-4:H-1: C[5,5,6]-4:P[5,6]-3:H-1:H-1: P[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]HH)(C[6a]C[6a]2) C[5,5,6](P[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]N[5,6]HH)(H) C[5,6](C[5,5,6]C[5,5]N[5,6]H)(P[5,6]C[5,5,6]C[6a])(H)2 P[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]HH)(C[6a]C[6a]2){1|N<3>,2|C<3>,7|H<1>} C[5,5,6](P[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]N[5,6]HH)(H){1|S<4>,2|C<3>,3|H<1>} C[5,6](C[5,5,6]C[5,5]N[5,6]H)(P[5,6]C[5,5,6]C[6a])(H)2{1|C<4>,1|S<4>,2|C<3>,3|H<1>} 89.5218 0.000 1 89.5218 0.000 1 89.5218 0.000 1 89.5218 0.000 1 89.5218 0.000 1 89.5218 0.000 1 246 474 478 5:SP3_SP3_SP3 P[3x5,6] C[5,5] C[4,5,5,6] 4:3:4: 3:3:4:1: 3:3:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:C[5,5]-4: P[3x5,6]-3:P[3x5,6]-3:Si-4:H-1: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH) C[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(SiC3)(H) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]C[5,5])(P[4,4,5]C[4,4,5]2)(CC3) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH){1|P<3>,3|C<4>} C[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(SiC3)(H){2|P<3>,4|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]C[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|Si<4>,1|H<1>,1|P<3>,3|C<4>} 100.6222 2.340 2 100.6222 5.477 2 100.6222 5.477 2 100.6222 5.477 2 100.6222 5.477 2 100.6222 5.477 2 246 474 478 6:SP3_SP3_SP3 P[5,5,6,6] C[3x5,6,6] C[4,5,6,6] 4:4:2: 3:3:2:4: 3:3:2:4: C[3x5,6,6]-4:C[4,5,6,6]-4:Se[5]-2: P[5,5,6,6]-3:P[5,5,6,6]-3:Se[5,5]-2:C-4: P[4,5,5,6]-3:P[5,5,6,6]-3:Se[4,6]-2:C-4: P[5,5,6,6](C[3x5,6,6]P[5,5,6,6]Se[5,5]C)(C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(Se[5]Se[5]) C[3x5,6,6](P[5,5,6,6]C[4,5,6,6]Se[5])2(Se[5,5]P[4,5,5,6])(CC3) C[4,5,6,6](P[4,5,5,6]C[4,5,6,6]Se[5,5])(P[5,5,6,6]C[3x5,6,6]Se[5])(Se[4,6]C[4,5,6,6])(CC3) P[5,5,6,6](C[3x5,6,6]P[5,5,6,6]Se[5,5]C)(C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(Se[5]Se[5]){1|C<4>} C[3x5,6,6](P[5,5,6,6]C[4,5,6,6]Se[5])2(Se[5,5]P[4,5,5,6])(CC3){1|Se<2>,2|C<4>} C[4,5,6,6](P[4,5,5,6]C[4,5,6,6]Se[5,5])(P[5,5,6,6]C[3x5,6,6]Se[5])(Se[4,6]C[4,5,6,6])(CC3){1|Se<2>,1|P<3>,2|C<4>} 101.0500 0.089 2 101.0500 0.008 2 101.0500 0.008 2 101.0500 0.008 2 101.0500 0.008 2 100.9220 0.062 4 246 474 478 6:SP3_SP3_SP3 P[5,6,6] C[5,5,6,6] C[4,5,6,6] 4:4:2: 3:3:2:4: 3:3:3:4: C[4,5,6,6]-4:C[5,5,6,6]-4:Se-2: P[5,6,6]-3:P[5,6,6]-3:Se[5,5]-2:C-4: P[4,5,5,6]-3:P[5,6,6]-3:Se[4,6]-3:C-4: P[5,6,6](C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(C[5,5,6,6]P[5,6,6]Se[5,5]C)(SePt) C[5,5,6,6](P[5,6,6]C[4,5,6,6]Se)2(Se[5,5]P[4,5,5,6])(CC3) C[4,5,6,6](P[4,5,5,6]C[4,5,6,6]Se[5,5])(P[5,6,6]C[5,5,6,6]Se)(Se[4,6]C[4,5,6,6]Pt)(CC3) P[5,6,6](C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(C[5,5,6,6]P[5,6,6]Se[5,5]C)(SePt){1|Se<2>,1|C<4>} C[5,5,6,6](P[5,6,6]C[4,5,6,6]Se)2(Se[5,5]P[4,5,5,6])(CC3){1|Se<3>,2|C<4>} C[4,5,6,6](P[4,5,5,6]C[4,5,6,6]Se[5,5])(P[5,6,6]C[5,5,6,6]Se)(Se[4,6]C[4,5,6,6]Pt)(CC3){1|P<3>,2|C<4>} 100.7940 0.337 2 100.7940 0.113 2 100.7940 0.113 2 100.7940 0.113 2 100.7940 0.113 2 100.9220 0.062 4 246 474 486 5:SP3_SP3_SP3 P[3x5,6] C[4x5] C[3,5,5,6] 4:4:3: 4:3:3:4: 4:3:3:4: C[3,5,5,6]-4:C[4x5]-4:C[5,6]-3: C[3x5,6]-4:P[3x5,6]-3:P[5,5]-3:C-4: P[3,5,5]-4:P[3,5,5,6]-3:P[3x5,6]-3:C-4: P[3x5,6](C[3,5,5,6]P[3,5,5,6]P[3,5,5]C)(C[4x5]C[3x5,6]P[5,5]C)(C[5,6]P[5,6]C) C[4x5](C[3x5,6]P[3,5,5,6]P[5,6]C)(P[3x5,6]C[3,5,5,6]C[5,6])(P[5,5]P[3,5,5]O)(CC3) C[3,5,5,6](P[3,5,5]P[3,5,5,6]P[5,5]Cr)(P[3,5,5,6]C[3x5,6]P[3,5,5])(P[3x5,6]C[4x5]C[5,6])(CC3) P[3x5,6](C[3,5,5,6]P[3,5,5,6]P[3,5,5]C)(C[4x5]C[3x5,6]P[5,5]C)(C[5,6]P[5,6]C){1|Cr<6>,1|C<4>,1|O<1>} C[4x5](C[3x5,6]P[3,5,5,6]P[5,6]C)(P[3x5,6]C[3,5,5,6]C[5,6])(P[5,5]P[3,5,5]O)(CC3){1|Cr<6>,2|C<4>} C[3,5,5,6](P[3,5,5]P[3,5,5,6]P[5,5]Cr)(P[3,5,5,6]C[3x5,6]P[3,5,5])(P[3x5,6]C[4x5]C[5,6])(CC3){1|O<1>,1|P<2>,3|C<4>} 93.2275 0.000 1 93.2275 0.000 1 93.2275 0.000 1 93.2275 0.000 1 93.2275 0.000 1 93.2275 0.000 1 246 474 490 0:SP3_SP3_SP3 P[5] C[5] C 3:4:4: 4:3:2:1: 3:4:4:4: C[5,6a]-3:C[5]-4:C-4: C[5]-4:P[5]-3:O[5]-2:H-1: P[5]-3:C-4:C-4:C-4: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]O[5]H)(CC3) C[5](C[5]O[5]P[5]H)(P[5]C[5,6a]C)(O[5]C[5,6a])(H) C(P[5]C[5,6a]C[5])(CH3)3 P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]O[5]H)(CC3){1|H<1>,1|P<3>,2|C<3>,2|O<2>} C[5](C[5]O[5]P[5]H)(P[5]C[5,6a]C)(O[5]C[5,6a])(H){1|C<4>,4|C<3>} C(P[5]C[5,6a]C[5])(CH3)3 100.7690 0.000 1 100.7690 0.000 1 100.7690 0.000 1 100.7690 0.000 1 104.4028 30.821 11 104.4028 30.821 11 246 474 490 0:SP3_SP3_SP3 P[5] C[5] C 4:4:4: 3:4:3:1: 3:3:1:1: C[5]-4:C[5]-4:C-4: C[6a]-3:C[5]-4:P[5]-3:H-1: P[5]-3:P[5]-3:H-1:H-1: P[5](C[5]C[6a]C[5]H)2(CP[5]HH) C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]C)(H) C(P[5]C[5]2)2(H)2 P[5](C[5]C[6a]C[5]H)2(CP[5]HH){4|C<3>,4|H<1>} C[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]C[5]C)(H){3|C<3>,5|H<1>} C(P[5]C[5]2)2(H)2 101.0375 1.679 4 101.0375 2.819 4 101.0375 2.819 4 101.0375 2.819 4 104.4028 30.821 11 104.4028 30.821 11 246 474 490 0:SP3_SP3_SP3 P[5] C[5] C 4:4:4: 4:3:4:1: 3:3:1:1: C[5]-4:C[5]-4:C-4: C[5]-4:P[5]-3:C-4:H-1: P[5]-3:N-3:H-1:H-1: P[5](C[5]C[5]CH)2(CHHN) C[5](C[5]C[5]HH)(P[5]C[5]C)(CH3)(H) C(P[5]C[5]2)(NCC)(H)2 P[5](C[5]C[5]CH)2(CHHN){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(CH3)(H){1|C<4>,3|H<1>} C(P[5]C[5]2)(NCC)(H)2 100.5132 1.253 2 100.5132 1.569 2 100.5132 1.569 2 100.5132 1.569 2 104.4028 30.821 11 104.4028 30.821 11 246 474 490 0:SP3_SP3_SP3 P[5] C[5] C 4:4:4: 4:3:4:4: 3:1:1:1: C[5]-4:C[5]-4:C-4: C[5]-4:P[5]-3:Si-4:Si-4: P[5]-3:H-1:H-1:H-1: P[5](C[5]C[5]Si2)2(CH3) C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2 C(P[5]C[5]2)(H)3 P[5](C[5]C[5]Si2)2(CH3){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2{2|Si<4>,2|H<1>} C(P[5]C[5]2)(H)3 107.5150 2.174 2 107.5150 4.725 2 107.5150 4.725 2 107.5150 4.725 2 104.4028 30.821 11 104.4028 30.821 11 246 474 490 0:SP3_SP3_SP3 P[5] C[5] C 4:4:4: 4:3:4:4: 3:4:4:4: C[5]-4:C[5]-4:C-4: C[5]-4:P[5]-3:Si-4:Si-4: P[5]-3:C-4:C-4:C-4: P[5](C[5]C[5]Si2)2(CC3) C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2 C(P[5]C[5]2)(CH3)3 P[5](C[5]C[5]Si2)2(CC3){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]C)(SiC3)2{2|Si<4>,2|H<1>} C(P[5]C[5]2)(CH3)3 113.7280 3.377 2 113.7280 11.405 2 113.7280 11.405 2 113.7280 11.405 2 104.4028 30.821 11 104.4028 30.821 11 246 474 542 0:SP3_SP2_SP3 P[5] C[5] N[5] 3:3:4: 3:3:3:1: 3:3:3: N[5]-3:N[5]-3:C[5]-4: C[5]-3:C[5]-3:P[5]-3:H-1: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(C[5]C[5]2H) C[5](C[5]C[5]H)2(P[5]N[5]2)(H) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(C[5]C[5]2H){4|H<1>,6|C<3>} C[5](C[5]C[5]H)2(P[5]N[5]2)(H){2|H<1>,4|C<3>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){2|C<4>,2|H<1>,5|C<3>} 101.4480 0.509 2 101.4480 0.259 2 101.4480 0.259 2 101.4480 0.259 2 103.8093 8.365 4 103.8093 8.365 4 246 474 542 0:SP3_SP2_SP3 P[5] C[5] N[5] 3:3:4: 3:3:3:4: 3:3:3: N[5]-3:N[5]-3:C[5]-4: C[5]-3:C[5]-3:P[5]-3:C-4: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(C[5]C[5]2C) C[5](C[5]C[5]C)2(P[5]N[5]2)(CH3) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(C[5]C[5]2C){2|C<4>,2|H<1>,6|C<3>} C[5](C[5]C[5]C)2(P[5]N[5]2)(CH3){2|C<4>,4|C<3>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,3|C<4>,5|C<3>} 106.1705 1.592 2 106.1705 2.534 2 106.1705 2.534 2 106.1705 2.534 2 103.8093 8.365 4 103.8093 8.365 4 246 474 542 0:SP3_SP3_SP3 P[5,5] C[5,5,6] N[5,5] 4:4:3: 3:3:3:1: 4:4:3: C[5,5,6]-4:C[5,5,6]-4:N[5,5]-3: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: C[5,5,6]-4:C[5,5,6]-4:P[5,5]-3: P[5,5](C[5,5,6]C[5,6,6a]2H)2(N[5,5]C[5,5,6]2) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N[5,5])(H) N[5,5](C[5,5,6]C[5,6,6a]2H)2(P[5,5]C[5,5,6]2) P[5,5](C[5,5,6]C[5,6,6a]2H)2(N[5,5]C[5,5,6]2){2|H<1>,8|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N[5,5])(H){2|C<4>,3|H<1>,4|C<3>} N[5,5](C[5,5,6]C[5,6,6a]2H)2(P[5,5]C[5,5,6]2){2|H<1>,8|C<3>} 109.0485 4.383 2 109.0485 19.214 2 109.0485 19.214 2 109.0485 19.214 2 109.0485 19.214 2 109.0485 19.214 2 246 474 542 5:SP3_SP2_SP3 P[5] C[5] N[5] 5:4:3: 3:3:4:1: 3:2:1: C[3x3,4,3x5,14x6]-5:C[5]-4:N[5]-3: P[5]-3:C[5]-3:Si-4:H-1: P[5]-3:N[5]-2:H-1: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[5]C[5]SiH)(N[5]N[5]H) C[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]N[5]Si)(SiC3)(H) N[5](P[5]C[3x3,4,3x5,14x6]C[5])(N[5]C[5])(H) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[5]C[5]SiH)(N[5]N[5]H){1|Si<4>,1|C<5>,4|H<1>,5|B<6>} C[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]N[5]Si)(SiC3)(H){1|H<1>,4|B<6>} N[5](P[5]C[3x3,4,3x5,14x6]C[5])(N[5]C[5])(H){2|Si<4>,1|H<1>,4|B<6>} 84.6735 0.000 1 84.6735 0.000 1 84.6735 0.000 1 84.6735 0.000 1 84.6735 0.000 1 84.6735 0.000 1 246 474 643 0:SP3_SP2_SP3 P[5,6] C[5,5,6] C[6a] 4:4:3: 3:4:4:1: 3:3:3: C[5,5,6]-4:C[5,6]-4:C[6a]-3: P[5,6]-3:C[5,5]-4:C[5,6]-4:H-1: P[5,6]-3:C[6a]-3:C[6a]-3: P[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]HH)(C[6a]C[6a]2) C[5,5,6](P[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]N[5,6]HH)(H) C[6a](P[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]H)2 P[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]HH)(C[6a]C[6a]2){1|N<3>,2|C<3>,7|H<1>} C[5,5,6](P[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]N[5,6]HH)(H){1|S<4>,2|C<3>,3|H<1>} C[6a](P[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]H)2{1|C<3>,3|C<4>,5|H<1>} 99.9699 0.000 1 99.9699 0.000 1 99.9699 0.000 1 99.9699 0.000 1 99.9699 0.000 1 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5,6] C[5,6] C[6a] 4:4:3: 4:3:1:1: 3:3:3: C[5,5,6]-4:C[5,6]-4:C[6a]-3: C[5,5,6]-4:P[5,6]-3:H-1:H-1: P[5,6]-3:C[6a]-3:C[6a]-3: P[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]HH)(C[6a]C[6a]2) C[5,6](C[5,5,6]C[5,5]N[5,6]H)(P[5,6]C[5,5,6]C[6a])(H)2 C[6a](P[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]H)2 P[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]HH)(C[6a]C[6a]2){1|N<3>,2|C<3>,7|H<1>} C[5,6](C[5,5,6]C[5,5]N[5,6]H)(P[5,6]C[5,5,6]C[6a])(H)2{1|C<4>,1|S<4>,2|C<3>,3|H<1>} C[6a](P[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]H)2{1|C<3>,3|C<4>,5|H<1>} 104.8090 0.000 1 104.8090 0.000 1 104.8090 0.000 1 104.8090 0.000 1 104.8090 0.000 1 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:3:4: 3:4:1:1: 3:3:3: P[5]-3:C[6a]-3:C[5]-4: P[5]-3:C[5]-4:H-1:H-1: P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH) C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|N<2>,4|C<3>,4|H<1>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{4|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<4>,1|P<3>,2|C<3>,4|H<1>} 103.2350 0.460 2 103.2350 0.211 2 103.2350 0.211 2 103.2350 0.211 2 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:3:4: 4:3:1:1: 3:3:3: P[5]-3:C[6a]-3:C[5]-4: P[5]-4:P[5]-3:H-1:H-1: P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH) C[5](P[5]C[6a]P[5]Os)(P[5]C[6a]P[5])(H)2 C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]P[5]HH){1|Os<4>,2|H<1>,6|C<3>} C[5](P[5]C[6a]P[5]Os)(P[5]C[6a]P[5])(H)2{6|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|P<3>,1|P<4>,2|C<3>,4|H<1>} 101.7975 2.403 2 101.7975 5.777 2 101.7975 5.777 2 101.7975 5.777 2 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:3: 3:3:1:1: 3:3:3: C[5,6a]-3:C[5]-4:C[6a]-3: C[5,6a]-3:P[5]-3:H-1:H-1: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2) C[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(H)2 C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]P[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2){1|P<3>,2|H<1>,5|C<3>} C[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(H)2{1|H<1>,5|C<3>} C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]P[5])(C[6a]C[6a]H){1|C<4>,4|H<1>,5|C<3>} 100.5085 1.584 4 100.5085 2.509 4 100.5085 2.509 4 100.5085 2.509 4 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:3: 3:4:1:1: 3:3:3: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:C[5]-4:H-1:H-1: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2) C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2){1|Fe<5>,1|P<3>,1|P<4>,3|C<3>,4|H<1>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{1|Fe<5>,1|P<3>,3|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<3>,1|C<4>,1|P<3>,1|P<4>,4|H<1>} 100.0450 0.000 1 101.6667 1.992 3 102.2566 1.716 5 102.2566 1.716 5 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:3: 3:4:1:1: 3:3:3: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:C[5]-4:H-1:H-1: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2) C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]2){2|P<3>,3|C<3>,4|H<1>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{1|P<3>,3|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<3>,1|C<4>,2|P<3>,4|H<1>} 102.4775 0.200 2 101.6667 1.992 3 102.2566 1.716 5 102.2566 1.716 5 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:3: 3:4:1:1: 3:3:3: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:C[5]-4:H-1:H-1: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P) C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2 C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]P[5]P){3|C<3>,4|H<1>} C[5](P[5]C[6a]P[5])(C[5]P[5]HH)(H)2{1|P<3>,3|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|C<3>,1|C<4>,2|P<3>,4|H<1>} 103.1415 0.520 2 103.1415 0.270 2 102.2566 1.716 5 102.2566 1.716 5 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:3: 4:3:3:1: 3:3:3: C[6a]-3:C[5]-4:C[5]-3: C[5]-4:P[5]-3:C[6a]-3:H-1: C[6,6a]-3:C[6a]-3:P[5]-3: P[5](C[6a]C[6,6a]C[6a])(C[5]C[6a]C[5]H)(C[5]C[6a]C[5]) C[5](C[5]C[5]P[5]H)(P[5]C[6a]C[5])(C[6a]C[6a]2)(H) C[6a](C[6,6a]C[6,6a]O[6])(C[6a]C[6a]H)(P[5]C[5]2) P[5](C[6a]C[6,6a]C[6a])(C[5]C[6a]C[5]H)(C[5]C[6a]C[5]){1|O<2>,1|P<4>,3|H<1>,6|C<3>} C[5](C[5]C[5]P[5]H)(P[5]C[6a]C[5])(C[6a]C[6a]2)(H){3|H<1>,8|C<3>} C[6a](C[6,6a]C[6,6a]O[6])(C[6a]C[6a]H)(P[5]C[5]2){2|C<4>,2|H<1>,5|C<3>} 104.7850 0.000 1 104.7850 0.000 1 104.7850 0.000 1 104.7850 0.000 1 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:4: 3:3:1:1: 3:3:3: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-3:H-1:H-1: C[6a]-3:C[6a]-3:P[5]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2 C[6a](C[6a]C[6a]2)2(P[5]C[5]2) P[5](C[6a]C[6a]2)(C[5]C[5]HH)2{2|H<1>,4|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2{2|C<3>,3|H<1>} C[6a](C[6a]C[6a]2)2(P[5]C[5]2){6|H<1>,7|C<3>} 107.2920 0.192 2 107.2920 0.037 2 104.0945 13.664 4 104.0945 13.664 4 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:4: 3:3:1:1: 3:3:3: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-3:H-1:H-1: C[6a]-3:C[6a]-3:P[5]-3: P[5](C[6a]C[6a]2)(C[5]C[5]HH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2 C[6a](C[6a]C[6a]C)2(P[5]C[5]2) P[5](C[6a]C[6a]2)(C[5]C[5]HH)2{2|C<3>,2|C<4>,2|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]H)(H)2{2|C<3>,3|H<1>} C[6a](C[6a]C[6a]C)2(P[5]C[5]2){3|C<3>,6|H<1>} 100.8970 0.243 2 100.8970 0.059 2 104.0945 13.664 4 104.0945 13.664 4 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:4: 3:4:4:1: 3:3:3: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-4:C-4:H-1: C[6a]-3:C[6a]-3:P[5]-3: P[5](C[6a]C[6a]2)(C[5]C[5]CH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H) C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(P[5]C[5]2) P[5](C[6a]C[6a]2)(C[5]C[5]CH)2{3|C<3>,5|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(P[5]C[5]2){3|H<1>,4|C<3>,4|C<4>} 103.1525 1.858 2 103.1525 3.451 2 103.1657 2.756 6 103.1657 2.756 6 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 3:4:4: 3:4:4:1: 3:3:3: C[6a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-4:C-4:H-1: C[6a]-3:C[6a]-3:P[5]-3: P[5](C[6a]C[6a]2)(C[5]C[5]CH)2 C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H) C[6a](C[6a]C[6a]P[5])(C[6a]C[6a]H)(P[5]C[5]2) P[5](C[6a]C[6a]2)(C[5]C[5]CH)2{1|P<4>,2|C<3>,5|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} C[6a](C[6a]C[6a]P[5])(C[6a]C[6a]H)(P[5]C[5]2){1|C<3>,1|O<1>,4|H<1>,6|C<4>} 103.1723 1.856 4 103.1723 3.444 4 103.1657 2.756 6 103.1657 2.756 6 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 4:3:4: 4:3:1:1: 3:3:3: P[5]-4:C[6a]-3:C[5]-4: P[5]-4:P[5]-3:H-1:H-1: P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]P[5]Os)(C[6a]C[6a]2)(C[5]P[5]HH) C[5](P[5]C[6a]P[5]Os)(P[5]C[6a]P[5])(H)2 C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 P[5](P[5]C[6a]P[5]Os)(C[6a]C[6a]2)(C[5]P[5]HH){1|Os<4>,2|H<1>,6|C<3>} C[5](P[5]C[6a]P[5]Os)(P[5]C[6a]P[5])(H)2{1|Os<4>,6|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|Os<4>,1|P<3>,1|P<4>,2|C<3>,4|H<1>} 102.3840 0.000 1 102.3840 0.000 1 102.3840 0.000 1 102.3840 0.000 1 102.4688 4.665 27 102.4633 4.751 29 246 474 643 0:SP3_SP2_SP3 P[5] C[5] C[6a] 4:4:3: 3:3:3:1: 3:3:3: C[5]-4:C[5]-4:C[6a]-3: N[5,6a]-3:P[5]-3:C[6a]-3:H-1: C[6a]-3:C[6a]-3:P[5]-3: P[5](C[5]N[5,6a]C[6a]H)2(C[6a]C[6a]2) C[5](N[5,6a]N[5,6a]C[6a])(P[5]C[6a]C[5])(C[6a]C[6a]2)(H) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) P[5](C[5]N[5,6a]C[6a]H)2(C[6a]C[6a]2){2|H<1>,8|C<3>} C[5](N[5,6a]N[5,6a]C[6a])(P[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|O<1>,2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|N<3>,3|C<3>,4|H<1>} 100.3671 0.882 2 100.3671 0.779 2 100.3671 0.779 2 100.3671 0.779 2 102.4688 4.665 27 102.4633 4.751 29 246 474 727 0:SP3_SP2_SP3 P[5] C[5] C[5a] 3:4:4: 3:4:4:1: 3:3:3: C[5a]-3:C[5]-4:C[5]-4: P[5]-3:C[5]-4:C-4:H-1: C[5a,6a]-3:C[5a]-3:P[5]-3: P[5](C[5a]C[5a,6a]C[5a])(C[5]C[5]CH)2 C[5](P[5]C[5a]C[5])(C[5]C[5]HH)(CH3)(H) C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]S[5a]P[5])(P[5]C[5]2) P[5](C[5a]C[5a,6a]C[5a])(C[5]C[5]CH)2{1|P<4>,1|S<2>,2|C<3>,4|H<1>} C[5](P[5]C[5a]C[5])(C[5]C[5]HH)(CH3)(H){1|C<4>,2|C<3>,3|H<1>} C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]S[5a]P[5])(P[5]C[5]2){1|O<1>,2|C<3>,3|H<1>,6|C<4>} 105.9840 0.403 2 105.9840 0.162 2 105.9840 0.162 2 105.9840 0.162 2 105.9840 0.162 2 105.9840 0.162 2 246 474 727 5:SP3_SP2_SP3 P[5] C[5] C[5,6a] 3:4:3: 3:3:1:1: 3:3:3: C[5,6a]-3:C[5]-4:C[6a]-3: C[5,6a]-3:P[5]-3:H-1:H-1: C[5,6a,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2) C[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(H)2 C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(P[5]C[6a]C[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2){1|P<3>,2|H<1>,5|C<3>} C[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(H)2{1|H<1>,5|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(P[5]C[6a]C[5])(C[6a]C[6a]H){3|H<1>,5|C<3>} 90.9764 0.171 4 90.9764 0.029 4 90.9764 0.029 4 90.9764 0.029 4 90.2810 2.440 5 90.2810 2.440 5 246 474 727 5:SP3_SP2_SP3 P[5] C[5] C[5,6a] 3:4:4: 4:3:2:1: 3:3:3: C[5,6a]-3:C[5]-4:C-4: C[5]-4:P[5]-3:O[5]-2:H-1: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]O[5]H)(CC3) C[5](C[5]O[5]P[5]H)(P[5]C[5,6a]C)(O[5]C[5,6a])(H) C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]O)(P[5]C[5]C) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]O[5]H)(CC3){1|H<1>,1|P<3>,2|C<3>,2|O<2>} C[5](C[5]O[5]P[5]H)(P[5]C[5,6a]C)(O[5]C[5,6a])(H){1|C<4>,4|C<3>} C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]O)(P[5]C[5]C){1|C<3>,1|C<4>,3|H<1>} 87.4993 0.000 1 87.4993 0.000 1 87.4993 0.000 1 87.4993 0.000 1 90.2810 2.440 5 90.2810 2.440 5 246 474 762 6:SP3_SP2_SP3 P[5,6,6] C[5,3x6] C[6] 4:3:3: 3:3:4:3: 3:3:4: C[5,3x6]-4:P[3,5,6]-3:C[6]-3: C[6,6,6a]-3:P[5,6,6]-3:C[5,6]-4:C[6]-3: P[5,6,6]-3:C[6]-3:Si-4: P[5,6,6](C[5,3x6]C[6,6,6a]C[5,6]C[6])(P[3,5,6]C[3,6,6]P[3,5,6])(C[6]C[6]Si) C[5,3x6](C[6,6,6a]C[6,6,6a]C[6a])(P[5,6,6]P[3,5,6]C[6])(C[5,6]P[3,5,6]SiH)(C[6]C[6]H) C[6](P[5,6,6]C[5,3x6]P[3,5,6])(C[6]C[6]H)(SiC3) P[5,6,6](C[5,3x6]C[6,6,6a]C[5,6]C[6])(P[3,5,6]C[3,6,6]P[3,5,6])(C[6]C[6]Si){2|Si<4>,3|C<3>,3|H<1>} C[5,3x6](C[6,6,6a]C[6,6,6a]C[6a])(P[5,6,6]P[3,5,6]C[6])(C[5,6]P[3,5,6]SiH)(C[6]C[6]H){1|Si<4>,1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>} C[6](P[5,6,6]C[5,3x6]P[3,5,6])(C[6]C[6]H)(SiC3){1|H<1>,1|P<3>,2|C<3>,2|C<4>} 101.7530 0.000 1 101.7530 0.000 1 101.7530 0.000 1 101.7530 0.000 1 101.7530 0.000 1 101.7530 0.000 1 246 474 778 0:SP3_SP3_SPD5 P[5] C[5] C[3x3,4,3x5,14x6] 5:4:3: 3:3:4:1: 6:6:6:6:3: C[3x3,4,3x5,14x6]-5:C[5]-4:N[5]-3: P[5]-3:C[5]-3:Si-4:H-1: B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P[5]-3: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[5]C[5]SiH)(N[5]N[5]H) C[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]N[5]Si)(SiC3)(H) C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]C[5]N[5]) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[5]C[5]SiH)(N[5]N[5]H){1|Si<4>,1|C<5>,4|H<1>,5|B<6>} C[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]N[5]Si)(SiC3)(H){1|H<1>,4|B<6>} C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]C[5]N[5]){1|Si<4>,1|B<6>,1|N<2>,2|C<3>,7|H<1>} 103.0040 0.000 1 103.0040 0.000 1 103.0040 0.000 1 103.0040 0.000 1 103.0040 0.000 1 103.0040 0.000 1 246 474 790 0:SP3_SP-NON_SP3 P[5,5] C[5,5,6] Cl 4:4:1: 3:3:3:1: 3: C[5,5,6]-4:C[5,5,6]-4:Cl-1: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: P[5,5]-3: P[5,5](C[5,5,6]C[5,6,6a]2H)2(Cl) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]Cl)(H) Cl(P[5,5]C[5,5,6]2) P[5,5](C[5,5,6]C[5,6,6a]2H)2(Cl){4|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]Cl)(H){3|H<1>,4|C<3>} Cl(P[5,5]C[5,5,6]2) 104.2900 0.283 2 104.2900 0.080 2 104.2900 0.080 2 104.2900 0.080 2 104.2900 0.080 2 104.2395 1.566 4 246 474 790 0:SP3_SP-NON_SP3 P[5] C[5] Cl 4:4:1: 4:3:4:4: 3: C[5]-4:C[5]-4:Cl-1: C[5]-4:P[5]-3:Si-4:Si-4: P[5]-3: P[5](C[5]C[5]Si2)2(Cl) C[5](C[5]C[5]HH)(P[5]C[5]Cl)(SiC3)2 Cl(P[5]C[5]2) P[5](C[5]C[5]Si2)2(Cl){4|H<1>} C[5](C[5]C[5]HH)(P[5]C[5]Cl)(SiC3)2{2|Si<4>,2|H<1>} Cl(P[5]C[5]2) 104.1890 2.147 2 104.1890 4.609 2 104.1890 4.609 2 104.1890 4.609 2 104.1890 4.609 2 104.2395 1.566 4 246 474 818 0:SP3_SP2_SP3 P[5] C[5,5] C[5] 4:3:3: 3:4:3:1: 3:4:3: C[5,5]-4:P[5]-3:C[5]-3: C[5,6]-3:C[5,5]-4:P[5]-3:H-1: P[5]-3:C[5]-4:C[5]-3: P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2) C[5,5](C[5,6]C[5,6]C[6])(C[5,5]C[5]P[5]H)(P[5]C[5]P[5])(H) C[5](P[5]C[5,5]P[5])(C[5]C[5,6a]HH)(C[5]C[5,6a]H) P[5](C[5,5]C[5,5]C[5,6]H)(P[5]C[5]P[5])(C[5]C[5]2){1|C<4>,5|H<1>,6|C<3>} C[5,5](C[5,6]C[5,6]C[6])(C[5,5]C[5]P[5]H)(P[5]C[5]P[5])(H){1|C<2>,1|C<4>,3|C<3>,3|H<1>} C[5](P[5]C[5,5]P[5])(C[5]C[5,6a]HH)(C[5]C[5,6a]H){1|C<4>,1|H<1>,1|P<3>,4|C<3>} 104.1640 0.000 1 104.1640 0.000 1 104.1640 0.000 1 104.1640 0.000 1 104.1640 0.000 1 105.6330 9.428 3 246 474 818 0:SP3_SP2_SP3 P[5] C[5] C[5] 4:3:3: 3:3:3:4: 3:3:3: C[5]-4:C[5]-3:C[5]-3: C[5]-3:C[5]-3:P[5]-3:C-4: C[5]-3:P[5]-3:C-3: P[5](C[5]C[5]2C)(C[5]C[5]C)2 C[5](C[5]C[5]C)2(P[5]C[5]2)(CH3) C[5](C[5]C[5]C)(P[5]C[5]2)(COO) P[5](C[5]C[5]2C)(C[5]C[5]C)2{2|C<3>,4|C<4>} C[5](C[5]C[5]C)2(P[5]C[5]2)(CH3){2|C<4>,4|C<3>} C[5](C[5]C[5]C)(P[5]C[5]2)(COO){2|C<4>,3|C<3>} 106.3675 3.952 2 106.3675 15.618 2 106.3675 15.618 2 106.3675 15.618 2 106.3675 15.618 2 105.6330 9.428 3 246 474 818 5:SP3_SP2_SP3 P[3x5,6] C[4x5] C[5,6] 4:4:3: 4:3:3:4: 3:2:4: C[3,5,5,6]-4:C[4x5]-4:C[5,6]-3: C[3x5,6]-4:P[3x5,6]-3:P[5,5]-3:C-4: P[3x5,6]-3:P[5,6]-2:C-4: P[3x5,6](C[3,5,5,6]P[3,5,5,6]P[3,5,5]C)(C[4x5]C[3x5,6]P[5,5]C)(C[5,6]P[5,6]C) C[4x5](C[3x5,6]P[3,5,5,6]P[5,6]C)(P[3x5,6]C[3,5,5,6]C[5,6])(P[5,5]P[3,5,5]O)(CC3) C[5,6](P[3x5,6]C[3,5,5,6]C[4x5])(P[5,6]C[3x5,6])(CC3) P[3x5,6](C[3,5,5,6]P[3,5,5,6]P[3,5,5]C)(C[4x5]C[3x5,6]P[5,5]C)(C[5,6]P[5,6]C){1|Cr<6>,1|C<4>,1|O<1>} C[4x5](C[3x5,6]P[3,5,5,6]P[5,6]C)(P[3x5,6]C[3,5,5,6]C[5,6])(P[5,5]P[3,5,5]O)(CC3){1|Cr<6>,2|C<4>} C[5,6](P[3x5,6]C[3,5,5,6]C[4x5])(P[5,6]C[3x5,6])(CC3){1|P<4>,2|P<3>,3|C<4>} 94.3245 0.000 1 94.3245 0.000 1 94.3245 0.000 1 94.3245 0.000 1 94.3245 0.000 1 92.3668 43.107 11 246 474 818 5:SP3_SP2_SP3 P[5,5,6] C[5,5] C[5,6] 3:4:3: 4:3:1:1: 3:3:3: C[5,6]-3:C[5,5]-4:C[5,6]-3: C[5,5,6]-4:P[5,5,6]-3:H-1:H-1: P[5,5,6]-3:C[5,6]-3:C[6a]-3: P[5,5,6](C[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]C[5,6]C) C[5,5](C[5,5,6]C[5,6]2C)(P[5,5,6]C[5,6]2)(H)2 C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C)(C[6a]C[6a]2) P[5,5,6](C[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]C[5,6]C){2|C<4>,3|C<3>} C[5,5](C[5,5,6]C[5,6]2C)(P[5,5,6]C[5,6]2)(H)2{2|C<3>,2|C<4>} C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C)(C[6a]C[6a]2){2|C<4>,3|C<3>,4|H<1>} 86.2113 0.511 2 86.2113 0.261 2 86.2113 0.261 2 86.2113 0.261 2 86.1122 0.104 4 92.3668 43.107 11 246 474 818 5:SP3_SP2_SP3 P[5,5,6] C[5,5] C[5,6] 3:4:3: 4:3:1:1: 3:3:4: C[5,6]-3:C[5,5]-4:C[5,6]-3: C[5,5,6]-4:P[5,5,6]-3:H-1:H-1: P[5,5,6]-3:C[5,6]-3:C-4: P[5,5,6](C[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]C[5,6]C) C[5,5](C[5,5,6]C[5,6]2C)(P[5,5,6]C[5,6]2)(H)2 C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C[6a])(CCHO) P[5,5,6](C[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]C[5,6]C){2|C<4>,3|C<3>} C[5,5](C[5,5,6]C[5,6]2C)(P[5,5,6]C[5,6]2)(H)2{2|C<3>,2|C<4>} C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C[6a])(CCHO){1|C<4>,2|H<1>,4|C<3>} 86.0131 0.113 2 86.0131 0.013 2 86.0131 0.013 2 86.0131 0.013 2 86.1122 0.104 4 92.3668 43.107 11 246 474 818 5:SP3_SP2_SP3 P[5,5] C[5] C[5] 3:4:3: 3:3:4:1: 3:3:2: P[5,5]-3:C[5]-4:C[5]-3: P[5,5]-3:C[5]-3:C-4:H-1: P[5,5]-3:C[5]-3:O-2: P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O) C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(CC3)(H) C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(OSi) P[5,5](P[5,5]C[5]2)(C[5]C[5]CH)(C[5]C[5]O){1|H<1>,1|O<2>,3|C<4>} C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(CC3)(H){1|C<3>,1|C<4>,2|O<2>} C[5](P[5,5]P[5,5]C[5])(C[5]C[5]C)(OSi){2|C<3>,2|C<4>,2|H<1>} 101.5380 0.000 2 101.5380 0.000 2 101.5380 0.000 2 101.5380 0.000 2 101.5380 0.000 2 92.3668 43.107 11 246 474 818 5:SP3_SP2_SP3 P[5,6] C[5,6] C[5] 3:4:3: 3:4:1:1: 3:3:3: P[5,6]-3:C[5,6]-4:C[5]-3: P[5,6]-3:C[5,6]-4:H-1:H-1: P[5,6]-3:C[5]-3:C[6a]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]) C[5,6](P[5,6]P[5,6]C[5])(C[5,6]C[5]C[6]C)(H)2 C[5](P[5,6]C[5,6]P[5,6])(C[5]C[5,6]C)(C[6a]C[6a]2) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5,6]HH)(C[5]C[6a]C[5]){3|C<4>,5|C<3>} C[5,6](P[5,6]P[5,6]C[5])(C[5,6]C[5]C[6]C)(H)2{1|C<4>,1|H<1>,4|C<3>} C[5](P[5,6]C[5,6]P[5,6])(C[5]C[5,6]C)(C[6a]C[6a]2){2|C<4>,4|C<3>,4|H<1>} 88.7537 0.000 1 88.7537 0.000 1 88.7537 0.000 1 88.7537 0.000 1 90.3341 4.996 2 92.3668 43.107 11 246 474 818 5:SP3_SP2_SP3 P[5,6] C[5,6] C[5] 4:4:3: 3:3:4:3: 3:3:3: C[5,6]-4:C[6]-4:C[5]-3: P[5,6]-3:C[6a]-3:C[6]-4:C[5]-3: P[5,6]-3:C[5]-3:C-3: P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(C[5]C[5]C) C[5,6](P[5,6]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]HH)(C[5]C[5]C) C[5](P[5,6]C[5,6]C[6])(C[5]C[5]C)(CC[6a]H) P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(C[5]C[5]C){2|H<1>,3|C<3>,3|C<4>} C[5,6](P[5,6]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]HH)(C[5]C[5]C){2|C<4>,4|C<3>,4|H<1>} C[5](P[5,6]C[5,6]C[6])(C[5]C[5]C)(CC[6a]H){2|C<3>,2|C<4>,2|H<1>} 91.9146 0.000 1 91.9146 0.000 1 91.9146 0.000 1 91.9146 0.000 1 90.3341 4.996 2 92.3668 43.107 11 246 474 818 5:SP3_SP2_SP3 P[5,6] C[5] C[5,6] 3:3:4: 3:4:4:1: 3:3:3: P[5,6]-3:C[5,6]-3:C[5]-4: P[5,6]-3:Ge[5]-4:C-4:H-1: P[5,6]-3:P[5,6]-3:C-3: P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH) C[5](P[5,6]C[5,6]P[5,6])(Ge[5]P[5,6]CC)(CH3)(H) C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH) P[5,6](P[5,6]C[5,6]Ge[5])(C[5,6]P[5,6]C)(C[5]Ge[5]CH){1|C<3>,1|P<3>,5|C<4>} C[5](P[5,6]C[5,6]P[5,6])(Ge[5]P[5,6]CC)(CH3)(H){1|Ge<4>,1|P<3>,2|C<3>} C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH){1|Ge<4>,1|C<3>,1|H<1>,4|C<4>} 101.7780 0.000 1 101.7780 0.000 1 101.7780 0.000 1 101.7780 0.000 1 101.7780 0.000 1 92.3668 43.107 11 246 474 818 5:SP3_SP2_SP3 P[5] C[5] C[5] 3:4:3: 4:3:3:1: 3:3:3: C[6a]-3:C[5]-4:C[5]-3: C[5]-4:P[5]-3:C[6a]-3:H-1: P[5]-3:C[6a]-3:C[5]-3: P[5](C[6a]C[6,6a]C[6a])(C[5]C[6a]C[5]H)(C[5]C[6a]C[5]) C[5](C[5]C[5]P[5]H)(P[5]C[6a]C[5])(C[6a]C[6a]2)(H) C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](C[6a]C[6,6a]C[6a])(C[5]C[6a]C[5]H)(C[5]C[6a]C[5]){1|O<2>,1|P<4>,3|H<1>,6|C<3>} C[5](C[5]C[5]P[5]H)(P[5]C[6a]C[5])(C[6a]C[6a]2)(H){3|H<1>,8|C<3>} C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){1|P<4>,4|H<1>,5|C<3>} 91.7392 0.000 1 91.7392 0.000 1 91.7392 0.000 1 91.7392 0.000 1 91.7392 0.000 1 92.3668 43.107 11 246 474 852 5:SP3_SP3_SP3 P[5,6,6] C[5,3x6] P[3,5,6] 4:3:3: 3:3:4:3: 4:3:3: C[5,3x6]-4:P[3,5,6]-3:C[6]-3: C[6,6,6a]-3:P[5,6,6]-3:C[5,6]-4:C[6]-3: C[3,6,6]-4:P[3,5,6]-3:P[5,6,6]-3: P[5,6,6](C[5,3x6]C[6,6,6a]C[5,6]C[6])(P[3,5,6]C[3,6,6]P[3,5,6])(C[6]C[6]Si) C[5,3x6](C[6,6,6a]C[6,6,6a]C[6a])(P[5,6,6]P[3,5,6]C[6])(C[5,6]P[3,5,6]SiH)(C[6]C[6]H) P[3,5,6](C[3,6,6]C[6,6,6a]P[3,5,6]Si)(P[3,5,6]C[3,6,6]C[5,6])(P[5,6,6]C[5,3x6]C[6]) P[5,6,6](C[5,3x6]C[6,6,6a]C[5,6]C[6])(P[3,5,6]C[3,6,6]P[3,5,6])(C[6]C[6]Si){2|Si<4>,3|C<3>,3|H<1>} C[5,3x6](C[6,6,6a]C[6,6,6a]C[6a])(P[5,6,6]P[3,5,6]C[6])(C[5,6]P[3,5,6]SiH)(C[6]C[6]H){1|Si<4>,1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>} P[3,5,6](C[3,6,6]C[6,6,6a]P[3,5,6]Si)(P[3,5,6]C[3,6,6]C[5,6])(P[5,6,6]C[5,3x6]C[6]){2|Si<4>,1|H<1>,4|C<3>} 97.4362 0.000 1 97.4362 0.000 1 97.4362 0.000 1 97.4362 0.000 1 97.4362 0.000 1 97.4362 0.000 1 246 474 863 0:SP3_SP2_SP3 P[5,5] C[4x5] O 4:4:1: 4:3:3:4: 3: P[3,5,5]-4:C[4x5]-4:O-1: C[3x5,6]-4:P[3x5,6]-3:P[5,5]-3:C-4: P[5,5]-3: P[5,5](P[3,5,5]C[3,5,5,6]P[3,5,5,6]Cr)(C[4x5]C[3x5,6]P[3x5,6]C)(O) C[4x5](C[3x5,6]P[3,5,5,6]P[5,6]C)(P[3x5,6]C[3,5,5,6]C[5,6])(P[5,5]P[3,5,5]O)(CC3) O(P[5,5]P[3,5,5]C[4x5]) P[5,5](P[3,5,5]C[3,5,5,6]P[3,5,5,6]Cr)(C[4x5]C[3x5,6]P[3x5,6]C)(O){1|C<3>,1|P<2>,2|C<4>} C[4x5](C[3x5,6]P[3,5,5,6]P[5,6]C)(P[3x5,6]C[3,5,5,6]C[5,6])(P[5,5]P[3,5,5]O)(CC3){1|Cr<6>,2|C<4>} O(P[5,5]P[3,5,5]C[4x5]) 123.2280 0.000 1 123.2280 0.000 1 123.2280 0.000 1 123.2280 0.000 1 123.2280 0.000 1 123.2280 0.000 1 246 474 882 5:SP3_SP3_SP3 P[3x5,6] C[5,5] P[4,5,5,6] 4:3:4: 3:3:4:1: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:C[5,5]-4: P[3x5,6]-3:P[3x5,6]-3:Si-4:H-1: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH) C[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(SiC3)(H) P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]C[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH){1|P<3>,3|C<4>} C[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(SiC3)(H){2|P<3>,4|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]C[5,5])(C[4,4,5]P[4,4,5]2C){1|Si<4>,1|H<1>,1|P<3>,2|C<4>} 93.2236 2.464 2 93.2236 6.074 2 93.2236 6.074 2 93.2236 6.074 2 93.2236 6.074 2 93.2236 6.074 2 246 474 951 0:SP3_SP-NON_SP3 P[5] C[5,5] H 4:3:1: 4:3:3:1: 3: C[5,5]-4:P[5]-3:H-1: C[5,5]-4:C[5]-3:P[5]-3:H-1: P[5]-3: P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H) C[5,5](C[5,5]C[5,6]P[5]H)(C[5]C[5,6]H)(P[5]P[5]H)(H) H(P[5]C[5,5]P[5]) P[5](C[5,5]C[5,5]C[5]H)(P[5]C[5]P[5])(H){1|C<4>,2|H<1>,4|C<3>} C[5,5](C[5,5]C[5,6]P[5]H)(C[5]C[5,6]H)(P[5]P[5]H)(H){4|C<3>} H(P[5]C[5,5]P[5]) 102.7350 0.000 1 102.7350 0.000 1 102.7350 0.000 1 102.7350 0.000 1 102.7350 0.000 1 102.7350 0.000 1 246 474 956 0:SP3_SP2_SP3 P[5,5] C[5,5,6] N 4:4:3: 3:3:3:1: 3:4:4: C[5,5,6]-4:C[5,5,6]-4:N-3: C[5,6,6a]-3:C[5,6,6a]-3:P[5,5]-3:H-1: P[5,5]-3:Si-4:Si-4: P[5,5](C[5,5,6]C[5,6,6a]2H)2(NSi2) C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N)(H) N(P[5,5]C[5,5,6]2)(SiC3)2 P[5,5](C[5,5,6]C[5,6,6a]2H)2(NSi2){4|C<3>} C[5,5,6](C[5,6,6a]C[5,6,6a]C[6a])2(P[5,5]C[5,5,6]N)(H){3|H<1>,4|C<3>} N(P[5,5]C[5,5,6]2)(SiC3)2 110.1315 3.699 2 110.1315 13.682 2 110.1315 13.682 2 110.1315 13.682 2 110.1315 13.682 2 110.1315 13.682 2 246 474 976 0:SP3_SP3_SP3 P[5] C[5] O[5] 4:2:2: 4:4:3:1: 3:4: C[5]-4:O[5]-2:O[5]-2: C[5]-4:C[5]-4:P[5]-3:H-1: P[5]-3:C[5]-4: P[5](C[5]C[5]2H)(O[5]C[5])2 C[5](C[5]C[5]P[5]H)(C[5]C[5]HH)(P[5]O[5]2)(H) O[5](P[5]C[5]O[5])(C[5]C[5]CH) P[5](C[5]C[5]2H)(O[5]C[5])2{1|P<3>,2|C<3>,2|C<4>,5|H<1>} C[5](C[5]C[5]P[5]H)(C[5]C[5]HH)(P[5]O[5]2)(H){2|C<4>,2|O<2>,4|H<1>} O[5](P[5]C[5]O[5])(C[5]C[5]CH){1|C<3>,2|C<4>,2|H<1>} 102.5605 0.238 4 102.5605 0.056 4 102.5605 0.056 4 102.5605 0.056 4 102.5605 0.056 4 102.5605 0.056 4 246 474 997 5:SP3_SP3_SP3 P[5,5,6,6] C[3x5,6,6] Se[5] 4:4:2: 3:3:2:4: 3:2: C[3x5,6,6]-4:C[4,5,6,6]-4:Se[5]-2: P[5,5,6,6]-3:P[5,5,6,6]-3:Se[5,5]-2:C-4: P[5,5,6,6]-3:Se[5]-2: P[5,5,6,6](C[3x5,6,6]P[5,5,6,6]Se[5,5]C)(C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(Se[5]Se[5]) C[3x5,6,6](P[5,5,6,6]C[4,5,6,6]Se[5])2(Se[5,5]P[4,5,5,6])(CC3) Se[5](P[5,5,6,6]C[3x5,6,6]C[4,5,6,6])(Se[5]P[5,5,6,6]) P[5,5,6,6](C[3x5,6,6]P[5,5,6,6]Se[5,5]C)(C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(Se[5]Se[5]){1|C<4>} C[3x5,6,6](P[5,5,6,6]C[4,5,6,6]Se[5])2(Se[5,5]P[4,5,5,6])(CC3){1|Se<2>,2|C<4>} Se[5](P[5,5,6,6]C[3x5,6,6]C[4,5,6,6])(Se[5]P[5,5,6,6]){2|Se<2>,1|P<3>,3|C<4>} 102.3070 0.088 2 102.3070 0.008 2 102.3070 0.008 2 102.3070 0.008 2 102.3070 0.008 2 102.3070 0.008 2 246 478 606 5:SP3_SP3_SP3 P[3x5,6] C[4,5,5,6] Ge[5,5] 4:3:4: 3:3:3:4: 3:3:1:1: C[4,5,5,6]-4:P[4,5,5,6]-3:Ge[5,5]-4: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: P[3x5,6]-3:P[3x5,6]-3:I-1:I-1: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]II) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3) Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(I)2 P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]II){1|P<3>,3|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|P<3>,2|I<1>,3|C<4>} Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(I)2{2|P<3>,4|C<4>} 97.8616 0.367 2 97.8616 0.135 2 97.8616 0.135 2 97.8616 0.135 2 99.9953 1.884 8 99.9953 1.884 8 246 478 606 5:SP3_SP3_SP3 P[3x5,6] C[4,5,5,6] Ge[5,5] 4:3:4: 3:3:3:4: 3:3:3:3: C[4,5,5,6]-4:P[4,5,5,6]-3:Ge[5,5]-4: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: P[3x5,6]-3:P[3x5,6]-3:N-3:N-3: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3) Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(NSi2)2 P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN){1|P<3>,3|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|P<3>,2|N<3>,3|C<4>} Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(NSi2)2{2|P<3>,4|C<4>} 100.7065 0.428 6 100.7065 0.183 6 100.7065 0.183 6 100.7065 0.183 6 99.9953 1.884 8 99.9953 1.884 8 246 478 882 5:SP3_SP3_SP3 P[3x5,6] C[4,5,5,6] P[4,5,5,6] 4:3:4: 3:3:3:4: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:C[5,5]-4: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]C[5,5])(P[4,4,5]C[4,4,5]2)(CC3) P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]C[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH){1|P<3>,3|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]C[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|Si<4>,1|H<1>,1|P<3>,3|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]C[5,5])(C[4,4,5]P[4,4,5]2C){1|Si<4>,1|H<1>,1|P<3>,2|C<4>} 100.3880 0.000 1 100.3880 0.000 1 100.3880 0.000 1 99.4601 0.330 5 99.4601 0.330 5 99.4601 0.330 5 246 478 882 5:SP3_SP3_SP3 P[3x5,6] C[4,5,5,6] P[4,5,5,6] 4:3:4: 3:3:3:4: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:Ge[5,5]-4: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]II) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3) P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]II){1|P<3>,3|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|P<3>,2|I<1>,3|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C){1|P<3>,2|C<4>,2|I<1>} 99.2617 0.000 1 99.2617 0.000 1 99.2281 0.082 4 99.4601 0.330 5 99.4601 0.330 5 99.4601 0.330 5 246 478 882 5:SP3_SP3_SP3 P[3x5,6] C[4,5,5,6] P[4,5,5,6] 4:3:4: 3:3:3:4: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:Ge[5,5]-4: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3) P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN){1|P<3>,3|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|P<3>,2|N<3>,3|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C){1|P<3>,2|C<4>,2|N<3>} 99.2169 0.349 3 99.2169 0.122 3 99.2281 0.082 4 99.4601 0.330 5 99.4601 0.330 5 99.4601 0.330 5 246 478 882 6:SP3_SP3_SP3 P[3x5,6] C[4,5,5,6] P[4,5,5,6] 4:3:4: 3:3:3:4: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:C[5,5]-4: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]C[5,5])(P[4,4,5]C[4,4,5]2)(CC3) P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]C[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(C[5,5]P[3x5,6]SiH){1|P<3>,3|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]C[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|Si<4>,1|H<1>,1|P<3>,3|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]C[5,5])(C[4,4,5]P[4,4,5]2C){1|Si<4>,1|H<1>,1|P<3>,2|C<4>} 99.0244 0.000 1 99.0244 0.000 1 99.0244 0.000 1 99.1991 0.014 4 99.1991 0.014 4 99.1991 0.014 4 246 478 882 6:SP3_SP3_SP3 P[3x5,6] C[4,5,5,6] P[4,5,5,6] 4:3:4: 3:3:3:4: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:Ge[5,5]-4: P[4,5,5,6]-3:P[3x5,6]-3:P[4,4,5]-3:C-4: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN) C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3) P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN){1|P<3>,3|C<4>} C[4,5,5,6](P[4,5,5,6]C[4,4,5]P[3x5,6])(P[3x5,6]P[4,5,5,6]Ge[5,5])(P[4,4,5]C[4,4,5]2)(CC3){1|P<3>,2|N<3>,3|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C){1|P<3>,2|C<4>,2|N<3>} 99.2573 0.033 3 99.2573 0.001 3 99.2573 0.001 3 99.1991 0.014 4 99.1991 0.014 4 99.1991 0.014 4 246 478 997 0:SP3_SP3_SP3 P[5,5,6,6] C[4,5,6,6] Se[5] 4:4:2: 3:3:2:4: 3:2: C[3x5,6,6]-4:C[4,5,6,6]-4:Se[5]-2: P[4,5,5,6]-3:P[5,5,6,6]-3:Se[4,6]-2:C-4: P[5,5,6,6]-3:Se[5]-2: P[5,5,6,6](C[3x5,6,6]P[5,5,6,6]Se[5,5]C)(C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(Se[5]Se[5]) C[4,5,6,6](P[4,5,5,6]C[4,5,6,6]Se[5,5])(P[5,5,6,6]C[3x5,6,6]Se[5])(Se[4,6]C[4,5,6,6])(CC3) Se[5](P[5,5,6,6]C[3x5,6,6]C[4,5,6,6])(Se[5]P[5,5,6,6]) P[5,5,6,6](C[3x5,6,6]P[5,5,6,6]Se[5,5]C)(C[4,5,6,6]P[4,5,5,6]Se[4,6]C)(Se[5]Se[5]){1|C<4>} C[4,5,6,6](P[4,5,5,6]C[4,5,6,6]Se[5,5])(P[5,5,6,6]C[3x5,6,6]Se[5])(Se[4,6]C[4,5,6,6])(CC3){1|Se<2>,1|P<3>,2|C<4>} Se[5](P[5,5,6,6]C[3x5,6,6]C[4,5,6,6])(Se[5]P[5,5,6,6]){2|Se<2>,1|P<3>,3|C<4>} 105.1405 0.141 2 105.1405 0.020 2 105.1405 0.020 2 105.1405 0.020 2 105.1405 0.020 2 105.1405 0.020 2 246 486 818 6:SP3_SP2_SP3 P[3x5,6] C[3,5,5,6] C[5,6] 4:4:3: 4:3:3:4: 3:2:4: C[3,5,5,6]-4:C[4x5]-4:C[5,6]-3: P[3,5,5]-4:P[3,5,5,6]-3:P[3x5,6]-3:C-4: P[3x5,6]-3:P[5,6]-2:C-4: P[3x5,6](C[3,5,5,6]P[3,5,5,6]P[3,5,5]C)(C[4x5]C[3x5,6]P[5,5]C)(C[5,6]P[5,6]C) C[3,5,5,6](P[3,5,5]P[3,5,5,6]P[5,5]Cr)(P[3,5,5,6]C[3x5,6]P[3,5,5])(P[3x5,6]C[4x5]C[5,6])(CC3) C[5,6](P[3x5,6]C[3,5,5,6]C[4x5])(P[5,6]C[3x5,6])(CC3) P[3x5,6](C[3,5,5,6]P[3,5,5,6]P[3,5,5]C)(C[4x5]C[3x5,6]P[5,5]C)(C[5,6]P[5,6]C){1|Cr<6>,1|C<4>,1|O<1>} C[3,5,5,6](P[3,5,5]P[3,5,5,6]P[5,5]Cr)(P[3,5,5,6]C[3x5,6]P[3,5,5])(P[3x5,6]C[4x5]C[5,6])(CC3){1|O<1>,1|P<2>,3|C<4>} C[5,6](P[3x5,6]C[3,5,5,6]C[4x5])(P[5,6]C[3x5,6])(CC3){1|P<4>,2|P<3>,3|C<4>} 100.0410 0.000 1 100.0410 0.000 1 100.0410 0.000 1 100.0410 0.000 1 100.0410 0.000 1 100.0410 0.000 1 246 490 562 0:SP3_SP3_SP3 P[5] C Si[5] 3:4:4: 3:1:1:1: 3:3:4:4: C[5]-3:Si[5]-4:C-4: P[5]-3:H-1:H-1:H-1: N[5]-3:P[5]-3:C-4:C-4: P[5](C[5]Si[4,5]C[3x6])(Si[5]N[5]CC)(CH3) C(P[5]Si[5]C[5])(H)3 Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2 P[5](C[5]Si[4,5]C[3x6])(Si[5]N[5]CC)(CH3){1|Si<4>,2|N<3>,3|C<4>} C(P[5]Si[5]C[5])(H)3 Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2{1|C<4>,2|N<3>} 100.5420 0.281 2 100.5420 0.079 2 100.5420 0.079 2 100.5420 0.079 2 100.5420 0.079 2 100.5420 0.079 2 246 490 606 0:SP3_SP3_SP3 P[5] C Ge[5,6] 4:3:4: 3:4:4:4: 3:2:2:2: Ge[5,6]-4:C[5]-3:C-4: P[5]-3:C-4:C-4:C-4: P[5]-3:N[6]-2:O[5]-2:O[6]-2: P[5](Ge[5,6]N[6]O[5]O[6])(C[5]C[5]H)(CC3) C(P[5]Ge[5,6]C[5])(CH3)3 Ge[5,6](P[5]C[5]C)(N[6]P[6])(O[5]C[5])(O[6]C[6]) P[5](Ge[5,6]N[6]O[5]O[6])(C[5]C[5]H)(CC3){1|P<4>,3|C<4>} C(P[5]Ge[5,6]C[5])(CH3)3 Ge[5,6](P[5]C[5]C)(N[6]P[6])(O[5]C[5])(O[6]C[6]){1|H<1>,7|C<4>} 104.0000 0.000 1 104.0000 0.000 1 104.0000 0.000 1 104.0000 0.000 1 104.0000 0.000 1 104.0000 0.000 1 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:3:4: 3:1:1:1: 3:3:3: C[5,6a]-3:C[5,6a]-3:C-4: P[5]-3:H-1:H-1:H-1: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(CH3) C(P[5]C[5,6a]2)(H)3 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]2) P[5](C[5,6a]C[5,6a]C[6a])2(CH3){1|C<4>,5|C<3>} C(P[5]C[5,6a]2)(H)3 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]2){2|H<1>,5|C<3>} 101.0605 0.562 2 101.0605 0.316 2 101.7795 0.804 4 101.7795 0.804 4 102.7311 7.411 18 102.7311 7.411 18 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:3:4: 3:1:1:1: 3:3:3: C[5,6a]-3:C[5,6a]-3:C-4: P[5]-3:H-1:H-1:H-1: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(CH3) C(P[5]C[5,6a]2)(H)3 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]C) P[5](C[5,6a]C[5,6a]C[6a])2(CH3){1|C<4>,5|C<3>} C(P[5]C[5,6a]2)(H)3 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]C){2|H<1>,3|C<3>} 102.4985 0.172 2 102.4985 0.030 2 101.7795 0.804 4 101.7795 0.804 4 102.7311 7.411 18 102.7311 7.411 18 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:3:4: 3:3:1:1: 3:3:3: C[5,6a]-3:C[5,6a]-3:C-4: P[5]-3:P-3:H-1:H-1: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(CHHP) C(P[5]C[5,6a]2)(PC[6a]2)(H)2 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(CHHP){2|H<1>,4|C<3>} C(P[5]C[5,6a]2)(PC[6a]2)(H)2 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H){2|H<1>,3|C<3>} 100.1617 1.789 4 100.1617 3.202 4 100.1617 3.202 4 100.1617 3.202 4 102.7311 7.411 18 102.7311 7.411 18 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:3:4: 3:4:1:1: 3:3:3: C[5,6a]-3:C[5,6a]-3:C-4: P[5]-3:P-4:H-1:H-1: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(CHHP) C(P[5]C[5,6a]2)(PC[6a]2B)(H)2 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(CHHP){2|H<1>,4|C<3>} C(P[5]C[5,6a]2)(PC[6a]2B)(H)2 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H){2|H<1>,3|C<3>} 101.8520 0.144 4 101.8520 0.021 4 101.8520 0.021 4 101.8520 0.021 4 102.7311 7.411 18 102.7311 7.411 18 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:3:4: 3:4:4:1: 3:3:3: C[5,6a]-3:As[5]-3:C-4: P[5]-3:C-4:C-4:H-1: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(As[5]C[5,6a]C[6a])(CCCH) C(P[5]C[5,6a]As[5])(CH3)2(H) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]As[5]C) P[5](C[5,6a]C[5,6a,6a]C[6a])(As[5]C[5,6a]C[6a])(CCCH){1|H<1>,5|C<3>} C(P[5]C[5,6a]As[5])(CH3)2(H) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]As[5]C){1|H<1>,4|C<3>} 105.7745 0.278 2 105.7745 0.077 2 105.7745 0.077 2 104.5733 4.367 3 102.7311 7.411 18 102.7311 7.411 18 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:3:4: 3:4:4:1: 3:3:3: C[5,6a]-3:P[5]-3:C-4: P[5]-3:C-4:C-4:H-1: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH) C(P[5]C[5,6a]P[5])(CH3)2(H) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]C) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[5])(CCCH){1|Fe<10>,1|H<1>,2|C<4>,3|C<3>} C(P[5]C[5,6a]P[5])(CH3)2(H) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]C){1|C<4>,1|H<1>,3|C<3>} 102.1710 0.000 1 102.1710 0.000 1 102.1710 0.000 1 104.5733 4.367 3 102.7311 7.411 18 102.7311 7.411 18 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:4:4: 3:4:4:4: 3:3:3: C[5,6a]-3:C[5]-4:C-4: P[5]-3:C-4:C-4:C-4: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]O[5]H)(CC3) C(P[5]C[5,6a]C[5])(CH3)3 C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]O)(P[5]C[5]C) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]O[5]H)(CC3){1|H<1>,1|P<3>,2|C<3>,2|O<2>} C(P[5]C[5,6a]C[5])(CH3)3 C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]O)(P[5]C[5]C){1|C<3>,1|C<4>,3|H<1>} 105.1490 0.000 1 105.1490 0.000 1 105.1490 0.000 1 106.7557 6.636 3 102.7311 7.411 18 102.7311 7.411 18 246 490 727 0:SP3_SP2_SP3 P[5] C C[5,6a] 3:4:4: 3:4:4:4: 3:3:3: C[5,6a]-3:P[5]-4:C-4: P[5]-3:C-4:C-4:C-4: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]2P[5])(CC3) C(P[5]C[5,6a]P[5])(CH3)3 C[5,6a](C[5,6a]C[6a]P[5])(C[6a]C[6a]H)(P[5]P[5]C) P[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]2P[5])(CC3){1|C<4>,1|H<1>,6|C<3>} C(P[5]C[5,6a]P[5])(CH3)3 C[5,6a](C[5,6a]C[6a]P[5])(C[6a]C[6a]H)(P[5]P[5]C){1|C<4>,2|H<1>,3|C<3>} 107.5590 3.066 2 107.5590 9.400 2 107.5590 9.400 2 106.7557 6.636 3 102.7311 7.411 18 102.7311 7.411 18 246 490 818 0:SP3_SP2_SP3 P[5] C C[5] 3:3:4: 3:3:1:1: 3:3:1: P[5]-3:C[5]-3:C-4: P[5]-3:C-3:H-1:H-1: C[5]-3:P[5]-3:H-1: P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH) C(P[5]C[5]P[5])(CCN)(H)2 C[5](C[5]N[5]C)(P[5]P[5]C)(H) P[5](P[5]N[5]Cl)(C[5]C[5]H)(CCHH){1|C<3>,1|C<4>} C(P[5]C[5]P[5])(CCN)(H)2 C[5](C[5]N[5]C)(P[5]P[5]C)(H){1|Cl<1>,1|C<3>} 101.3380 0.000 1 101.3380 0.000 1 101.3380 0.000 1 101.3380 0.000 1 105.4976 7.291 9 105.4976 7.291 9 246 490 818 0:SP3_SP2_SP3 P[5] C C[5] 3:3:4: 3:4:1:1: 3:3:4: C[5]-3:C[5]-3:C-4: P[5]-3:P-4:H-1:H-1: C[5]-3:P[5]-3:C-4: P[5](C[5]C[5]C)2(CHHP) C(P[5]C[5]2)(PC[6a]2B)(H)2 C[5](C[5]C[5]C)(P[5]C[5]C)(CH3) P[5](C[5]C[5]C)2(CHHP){2|C<4>} C(P[5]C[5]2)(PC[6a]2B)(H)2 C[5](C[5]C[5]C)(P[5]C[5]C)(CH3){2|C<4>} 104.9460 0.966 2 104.9460 0.933 2 104.9460 0.933 2 104.9460 0.933 2 105.4976 7.291 9 105.4976 7.291 9 246 490 818 0:SP3_SP2_SP3 P[5] C C[5] 3:3:4: 3:4:4:1: 3:3:3: P[3,5]-3:C[5]-3:C-4: P[5]-3:C-4:C-4:H-1: C[5]-3:C[6a]-3:P[5]-3: P[5](P[3,5]C[3,5]C[3])(C[5]C[6a]C[5])(CCCH) C(P[5]P[3,5]C[5])(CH3)2(H) C[5](C[5]C[3,5]C[6a])(C[6a]C[6a]2)(P[5]P[3,5]C) P[5](P[3,5]C[3,5]C[3])(C[5]C[6a]C[5])(CCCH){6|C<3>} C(P[5]P[3,5]C[5])(CH3)2(H) C[5](C[5]C[3,5]C[6a])(C[6a]C[6a]2)(P[5]P[3,5]C){1|C<4>,2|H<1>,5|C<3>} 103.8790 0.000 1 103.8790 0.000 1 103.8790 0.000 1 103.8790 0.000 1 105.4976 7.291 9 105.4976 7.291 9 246 490 818 0:SP3_SP2_SP3 P[5] C C[5] 3:4:3: 3:4:3:1: 3:3:3: C[5]-3:C-4:C[5]-3: C[6a]-3:C[5]-4:P[5]-3:H-1: C[6a]-3:C[5]-3:P[5]-3: P[5](C[5]C[6a]C[5])(CC[6a]C[5]H)(C[5]C[5]C) C(C[6a]C[6a]N[6a])(C[5]C[5]P[5]Mn)(P[5]C[5]2)(H) C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]C) P[5](C[5]C[6a]C[5])(CC[6a]C[5]H)(C[5]C[5]C){2|C<3>,2|C<4>} C(C[6a]C[6a]N[6a])(C[5]C[5]P[5]Mn)(P[5]C[5]2)(H) C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]C){2|C<3>,2|C<4>,2|H<1>} 109.4360 0.000 1 109.4360 0.000 1 109.4360 0.000 1 109.4360 0.000 1 105.4976 7.291 9 105.4976 7.291 9 246 490 818 0:SP3_SP2_SP3 P[5] C C[5] 3:4:3: 3:4:3:1: 3:3:4: C[5]-3:C-4:C[5]-3: C[6a]-3:C[5]-4:P[5]-3:H-1: C[5]-3:P[5]-3:C-4: P[5](C[5]C[6a]C[5])(CC[6a]C[5]H)(C[5]C[5]C) C(C[6a]C[6a]N[6a])(C[5]C[5]P[5]Mn)(P[5]C[5]2)(H) C[5](C[5]C[5]C)(P[5]C[5]C)(CC[6a]CH) P[5](C[5]C[6a]C[5])(CC[6a]C[5]H)(C[5]C[5]C){2|C<3>,2|C<4>} C(C[6a]C[6a]N[6a])(C[5]C[5]P[5]Mn)(P[5]C[5]2)(H) C[5](C[5]C[5]C)(P[5]C[5]C)(CC[6a]CH){1|C<3>,1|C<4>} 105.6110 0.000 1 105.6110 0.000 1 105.6110 0.000 1 105.6110 0.000 1 105.4976 7.291 9 105.4976 7.291 9 246 490 818 0:SP3_SP2_SP3 P[5] C C[5] 3:4:4: 3:1:1:1: 4:4:3: C[5]-3:Si[5]-4:C-4: P[5]-3:H-1:H-1:H-1: Si[4,5]-4:C[3x6]-4:P[5]-3: P[5](C[5]Si[4,5]C[3x6])(Si[5]N[5]CC)(CH3) C(P[5]Si[5]C[5])(H)3 C[5](Si[4,5]N[4]2N[5])(C[3x6]C[6,6]3)(P[5]Si[5]C) P[5](C[5]Si[4,5]C[3x6])(Si[5]N[5]CC)(CH3){1|Si<4>,2|N<3>,3|C<4>} C(P[5]Si[5]C[5])(H)3 C[5](Si[4,5]N[4]2N[5])(C[3x6]C[6,6]3)(P[5]Si[5]C){1|Si<4>,1|C<3>,6|H<1>,7|C<4>} 108.1950 0.454 2 108.1950 0.206 2 108.1950 0.206 2 108.1950 0.206 2 105.4976 7.291 9 105.4976 7.291 9 246 490 818 0:SP3_SP2_SP3 P[5] C C[5] 4:3:4: 3:4:4:4: 3:4:1: Ge[5,6]-4:C[5]-3:C-4: P[5]-3:C-4:C-4:C-4: P[5]-3:C[5]-4:H-1: P[5](Ge[5,6]N[6]O[5]O[6])(C[5]C[5]H)(CC3) C(P[5]Ge[5,6]C[5])(CH3)3 C[5](P[5]Ge[5,6]C)(C[5]O[5]CC)(H) P[5](Ge[5,6]N[6]O[5]O[6])(C[5]C[5]H)(CC3){1|P<4>,3|C<4>} C(P[5]Ge[5,6]C[5])(CH3)3 C[5](P[5]Ge[5,6]C)(C[5]O[5]CC)(H){1|N<2>,1|O<2>} 102.9320 0.000 1 102.9320 0.000 1 102.9320 0.000 1 102.9320 0.000 1 105.4976 7.291 9 105.4976 7.291 9 246 490 852 0:SP3_SP3_SP3 P[5,5] C P[3,5,5] 3:3:4: 3:1:1:1: 3:3:3: P[3x5]-3:P[3,5,5]-3:C-4: P[5,5]-3:H-1:H-1:H-1: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3) C(P[5,5]P[3,5,5]P[3x5])(H)3 P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]C) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(CH3){1|Ga<4>,2|N<3>} C(P[5,5]P[3,5,5]P[3x5])(H)3 P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]C){1|Ga<4>,2|N<3>} 103.5855 0.064 2 103.5855 0.004 2 103.5855 0.004 2 103.5855 0.004 2 103.5855 0.004 2 102.3263 4.759 3 246 490 852 0:SP3_SP3_SP3 P[5] C P[3,5] 3:3:4: 3:4:4:1: 4:4:3: P[3,5]-3:C[5]-3:C-4: P[5]-3:C-4:C-4:H-1: C[3,5]-4:C[3]-4:P[5]-3: P[5](P[3,5]C[3,5]C[3])(C[5]C[6a]C[5])(CCCH) C(P[5]P[3,5]C[5])(CH3)2(H) P[3,5](C[3,5]C[6a]C[3]C[5])(C[3]C[3,5]C[6a]2)(P[5]C[5]C) P[5](P[3,5]C[3,5]C[3])(C[5]C[6a]C[5])(CCCH){6|C<3>} C(P[5]P[3,5]C[5])(CH3)2(H) P[3,5](C[3,5]C[6a]C[3]C[5])(C[3]C[3,5]C[6a]2)(P[5]C[5]C){8|C<3>} 99.8080 0.000 1 99.8080 0.000 1 99.8080 0.000 1 99.8080 0.000 1 99.8080 0.000 1 102.3263 4.759 3 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 3:4:4: 3:4:4:4: 3:3:3:3: C[5,6a]-3:P[5]-4:C-4: P[5]-3:C-4:C-4:C-4: P[5]-3:P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]2P[5])(CC3) C(P[5]C[5,6a]P[5])(CH3)3 P[5](P[5]C[5,6a]C)2(C[6a]C[6a]2)2 P[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]2P[5])(CC3){1|C<4>,1|H<1>,6|C<3>} C(P[5]C[5,6a]P[5])(CH3)3 P[5](P[5]C[5,6a]C)2(C[6a]C[6a]2)2{4|H<1>,6|C<3>} 107.4795 0.979 2 107.4795 0.959 2 107.4795 0.959 2 107.4795 0.959 2 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:3:4: 3:1:1:1: 3:3:3:3: P[5]-4:P[5]-3:C-4: P[5]-3:H-1:H-1:H-1: C[6a]-3:C[6a]-3:P[5]-3:P[5]-3: P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3) C(P[5]P[5]2)(H)3 P[5](C[6a]C[6a]2)2(P[5]P[5]C)2 P[5](P[5]C[6a]2P[5])(P[5]P[5]C)(CH3){3|C<4>,4|C<3>} C(P[5]P[5]2)(H)3 P[5](C[6a]C[6a]2)2(P[5]P[5]C)2{3|C<4>,4|C<3>,4|H<1>} 100.6620 0.000 1 100.6620 0.000 1 100.6620 0.000 1 100.6620 0.000 1 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:3:4: 3:1:1:1: 3:3:4:4: P[5]-4:P[5]-3:C-4: P[5]-3:H-1:H-1:H-1: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3) C(P[5]P[5]2)(H)3 P[5](P[5]P[5]C)2(CH3)2 P[5](P[5]P[5]CC)(P[5]P[5]C)(CH3){1|C<4>,2|C<3>} C(P[5]P[5]2)(H)3 P[5](P[5]P[5]C)2(CH3)2{1|C<4>,2|C<3>} 99.4014 0.000 1 99.4014 0.000 1 99.4014 0.000 1 99.4014 0.000 1 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:3:4: 3:4:1:1: 3:3:4:3: P[5]-4:P[5]-3:C-4: P[5]-3:C-4:H-1:H-1: C[6a]-3:C[6a]-3:C[5]-4:P[5]-3: P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH) C(P[5]P[5]2)(CH3)(H)2 P[5](C[6a]C[6a]2)2(C[5]P[5]HH)(P[5]P[5]C) P[5](P[5]C[6a]2C[5])(P[5]P[5]C)(CCHH){2|H<1>,6|C<3>} C(P[5]P[5]2)(CH3)(H)2 P[5](C[6a]C[6a]2)2(C[5]P[5]HH)(P[5]P[5]C){1|C<4>,4|H<1>,6|C<3>} 101.6346 4.696 2 101.6346 22.049 2 101.6346 22.049 2 101.6346 22.049 2 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:3:4: 3:4:4:4: 3:3:4:4: P[5]-4:P[5]-3:C-4: P[5]-3:C-4:C-4:C-4: C[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3) C(P[5]P[5]2)(CH3)3 P[5](C[5]N[5]C)(P[5]P[5]C)(CC3)(CH3) P[5](P[5]C[5]CC)(P[5]N[5]C)(CC3){1|C<4>} C(P[5]P[5]2)(CH3)3 P[5](C[5]N[5]C)(P[5]P[5]C)(CC3)(CH3){1|C<4>} 109.8290 0.000 1 109.8290 0.000 1 109.8290 0.000 1 109.8290 0.000 1 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:4:4: 3:1:1:1: 3:3:3:3: P[5]-4:P[5]-4:C-4: P[5]-3:H-1:H-1:H-1: C[6a]-3:C[6a]-3:P[5]-3:P[5]-3: P[5](P[5]C[6a]2P[5])(P[5]P[5]CC)(CH3) C(P[5]P[5]2)(H)3 P[5](C[6a]C[6a]2)2(P[5]P[5]C)2 P[5](P[5]C[6a]2P[5])(P[5]P[5]CC)(CH3){2|C<4>,4|C<3>} C(P[5]P[5]2)(H)3 P[5](C[6a]C[6a]2)2(P[5]P[5]C)2{3|C<4>,4|C<3>,4|H<1>} 97.0987 0.000 1 97.0987 0.000 1 97.0987 0.000 1 97.0987 0.000 1 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:4:4: 3:1:1:1: 3:3:4:4: P[5]-4:P[5]-4:C-4: P[5]-3:H-1:H-1:H-1: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6a]2P[5])(P[5]P[5]CC)(CH3) C(P[5]P[5]2)(H)3 P[5](P[5]P[5]C)2(CH3)2 P[5](P[5]C[6a]2P[5])(P[5]P[5]CC)(CH3){2|C<4>,4|C<3>} C(P[5]P[5]2)(H)3 P[5](P[5]P[5]C)2(CH3)2{1|C<4>,2|C<3>} 100.3820 0.000 1 100.3820 0.000 1 100.3820 0.000 1 100.3820 0.000 1 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:4:4: 3:4:1:1: 3:3:4:3: P[5]-4:P[5]-4:C-4: P[5]-3:C-4:H-1:H-1: C[6a]-3:C[6a]-3:C[5]-4:P[5]-3: P[5](P[5]C[6a]2C[5])2(CCHH) C(P[5]P[5]2)(CH3)(H)2 P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(P[5]P[5]C) P[5](P[5]C[6a]2C[5])2(CCHH){4|H<1>,8|C<3>} C(P[5]P[5]2)(CH3)(H)2 P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(P[5]P[5]C){6|C<3>,6|H<1>} 100.4559 1.561 4 100.4559 2.436 4 100.4559 2.436 4 100.4559 2.436 4 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:4:4: 3:4:1:1: 4:3:4:4: P[5]-4:P[5]-4:C-4: P[5]-3:C-4:H-1:H-1: C[5]-4:P[5]-3:C-4:C-4: P[5](P[5]C[5]CC)2(CCHH) C(P[5]P[5]2)(CCHH)(H)2 P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2 P[5](P[5]C[5]CC)2(CCHH){4|H<1>} C(P[5]P[5]2)(CCHH)(H)2 P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2{2|C<4>,2|H<1>} 100.9385 0.363 2 100.9385 0.132 2 101.4040 0.334 4 101.4040 0.334 4 101.9436 12.439 17 101.9436 12.439 17 246 490 955 0:SP3_SP3_SP3 P[5] C P[5] 4:4:4: 3:4:1:1: 4:3:4:4: P[5]-4:P[5]-4:C-4: P[5]-3:C-4:H-1:H-1: C[5]-4:P[5]-3:C-4:C-4: P[5](P[5]C[5]CC)2(CCHH) C(P[5]P[5]2)(CH3)(H)2 P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2 P[5](P[5]C[5]CC)2(CCHH){4|H<1>} C(P[5]P[5]2)(CH3)(H)2 P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2{2|C<4>,2|H<1>} 101.8695 0.059 2 101.8695 0.003 2 101.4040 0.334 4 101.4040 0.334 4 101.9436 12.439 17 101.9436 12.439 17 246 490 960 0:SP3_SP2_SP3 P[5] C N[5] 3:2:4: 3:4:4:4: 3:3: P[5]-3:N[5]-2:C-4: P[5]-3:C-4:C-4:C-4: C[5]-3:P[5]-3: P[5](P[5]P[5]C)(N[5]C[5])(CC3) C(P[5]N[5]P[5])(CH3)3 N[5](C[5]P[5]C)(P[5]P[5]C) P[5](P[5]P[5]C)(N[5]C[5])(CC3){3|C<4>} C(P[5]N[5]P[5])(CH3)3 N[5](C[5]P[5]C)(P[5]P[5]C){3|C<4>} 100.3800 0.000 1 100.3800 0.000 1 100.3800 0.000 1 100.3800 0.000 1 100.3800 0.000 1 100.3800 0.000 1 246 542 542 0:SP3_SP2_SP2 P[5,5] N[5] N[5] 3:3:3: 3:3:4: 3:3:4: N[5,5]-3:N[5]-3:N[5]-3: C[5,6a]-3:P[5,5]-3:C-4: C[5,6a]-3:P[5,5]-3:C-4: P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2 N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(CH3) N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(CH3) P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2{4|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(CH3){1|C<4>,1|H<1>,4|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(CH3){1|C<4>,1|H<1>,4|C<3>} 115.2220 0.000 1 115.2220 0.000 1 115.2220 0.000 1 115.2220 0.000 1 115.2220 0.000 1 115.2220 0.000 1 246 542 542 0:SP3_SP2_SP3 P[5,5] N[5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:N[5,5]-3: C[5,6a]-3:P[5,5]-3:C[6a]-3: C[5,6a]-3:P[5,5]-3:C[6a]-3: P[5,5](N[5]C[5,6a]C[6a])2(N[5,5]C[5,6a]2) N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]) N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]) P[5,5](N[5]C[5,6a]C[6a])2(N[5,5]C[5,6a]2){2|N<2>,6|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]){2|H<1>,7|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]){2|H<1>,7|C<3>} 108.6750 0.000 1 108.6750 0.000 1 108.6750 0.000 1 109.9050 3.026 2 109.9050 3.026 2 109.9050 3.026 2 246 542 542 0:SP3_SP2_SP3 P[5,5] N[5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:P[5,5]-3: P[5,5]-3:C[6a]-3:C[5]-3: P[5,5]-3:C[6a]-3:C[5]-3: P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2) N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C) N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C) P[5,5](N[5]C[6a]C[5])2(P[5,5]C[5]2){2|C<4>,2|H<1>,4|C<3>} N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|H<1>,2|C<4>,5|C<3>} N[5](P[5,5]P[5,5]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|H<1>,2|C<4>,5|C<3>} 111.1350 0.000 1 111.1350 0.000 1 111.1350 0.000 1 109.9050 3.026 2 109.9050 3.026 2 109.9050 3.026 2 246 542 542 5:SP3_SP2_SP2 P[5,5] N[5] N[5,5,6] 3:3:3: 3:3:3: 3:3:3: N[5,5,6]-3:N[5]-3:N[5]-3: P[5,5]-3:C[5]-3:C[6a]-3: C[5,6]-3:C[5,6]-3:P[5,5]-3: P[5,5](N[5,5,6]C[5,6]2)(N[5]C[6a]C[5])2 N[5](P[5,5]N[5,5,6]N[5])(C[5]C[5,6]C[6a])(C[6a]C[6a]2) N[5,5,6](C[5,6]C[5]C[6])2(P[5,5]N[5]2) P[5,5](N[5,5,6]C[5,6]2)(N[5]C[6a]C[5])2{8|C<3>} N[5](P[5,5]N[5,5,6]N[5])(C[5]C[5,6]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>} N[5,5,6](C[5,6]C[5]C[6])2(P[5,5]N[5]2){2|H<1>,5|C<3>} 81.5430 0.221 2 81.5430 0.049 2 81.5430 0.049 2 81.5430 0.049 2 81.5430 0.049 2 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5,5] N[5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5,5,6]-3:N[5]-3:N[5]-3: P[5,5]-3:C[5]-3:C[6a]-3: P[5,5]-3:C[5]-3:C[6a]-3: P[5,5](N[5,5,6]C[5,6]2)(N[5]C[6a]C[5])2 N[5](P[5,5]N[5,5,6]N[5])(C[5]C[5,6]C[6a])(C[6a]C[6a]2) N[5](P[5,5]N[5,5,6]N[5])(C[5]C[5,6]C[6a])(C[6a]C[6a]2) P[5,5](N[5,5,6]C[5,6]2)(N[5]C[6a]C[5])2{8|C<3>} N[5](P[5,5]N[5,5,6]N[5])(C[5]C[5,6]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>} N[5](P[5,5]N[5,5,6]N[5])(C[5]C[5,6]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>} 163.0855 0.442 2 163.0855 0.195 2 163.0855 0.195 2 163.0855 0.195 2 163.0855 0.195 2 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5,6] N[5,6] 3:3:3: 3:3:4: 3:3:4: N[5,6]-3:N[5,6]-3:N-3: C[5,5,6]-3:P[5]-3:C[6]-4: C[5,5,6]-3:P[5]-3:C[6]-4: P[5](N[5,6]C[5,5,6]C[6])2(NCC) N[5,6](C[5,5,6]C[5,5,6]N[5,6])(P[5]N[5,6]N)(C[6]C[6]HH) N[5,6](C[5,5,6]C[5,5,6]N[5,6])(P[5]N[5,6]N)(C[6]C[6]HH) P[5](N[5,6]C[5,5,6]C[6])2(NCC){2|C<4>,2|N<3>,4|H<1>} N[5,6](C[5,5,6]C[5,5,6]N[5,6])(P[5]N[5,6]N)(C[6]C[6]HH){1|As<3>,1|N<3>,2|C<4>,2|H<1>} N[5,6](C[5,5,6]C[5,5,6]N[5,6])(P[5]N[5,6]N)(C[6]C[6]HH){1|As<3>,1|N<3>,2|C<4>,2|H<1>} 86.0539 0.000 1 86.0539 0.000 1 86.0539 0.000 1 86.1966 0.041 2 86.1966 0.041 2 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5,6] N[5,6] 3:3:3: 3:3:4: 3:3:4: N[5,6]-3:N[5,6]-3:N-3: C[5,6]-3:P[5]-3:C[6]-4: C[5,6]-3:P[5]-3:C[6]-4: P[5](N[5,6]C[5,6]C[6])2(NCC) N[5,6](C[5,6]C[5,6]N[6])(P[5]N[5,6]N)(C[6]C[6]HH) N[5,6](C[5,6]C[5,6]N[6])(P[5]N[5,6]N)(C[6]C[6]HH) P[5](N[5,6]C[5,6]C[6])2(NCC){2|C<4>,2|N<3>,4|H<1>} N[5,6](C[5,6]C[5,6]N[6])(P[5]N[5,6]N)(C[6]C[6]HH){1|Sb<5>,1|N<3>,2|C<4>,2|H<1>} N[5,6](C[5,6]C[5,6]N[6])(P[5]N[5,6]N)(C[6]C[6]HH){1|Sb<5>,1|N<3>,2|C<4>,2|H<1>} 86.3393 0.000 1 86.3393 0.000 1 86.3393 0.000 1 86.1966 0.041 2 86.1966 0.041 2 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:1: 3:3:2: 3:3:3: N[5]-3:N[5]-3:Br-1: C[6a]-3:P[5]-3:N[5]-2: C[6a]-3:P[5]-3:C[5]-3: P[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(Br) N[5](C[6a]C[6a]2)(P[5]N[5]Br)(N[5]C[5]) N[5](C[6a]C[6a]2)(P[5]N[5]Br)(C[5]N[5]C) P[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(Br){1|C<4>,4|C<3>} N[5](C[6a]C[6a]2)(P[5]N[5]Br)(N[5]C[5]){1|C<4>,2|H<1>,3|C<3>} N[5](C[6a]C[6a]2)(P[5]N[5]Br)(C[5]N[5]C){2|C<4>,3|C<3>} 87.8110 0.123 2 87.8110 0.015 2 87.8110 0.015 2 87.8110 0.015 2 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:1: 3:3:3: 3:3:3: N[5]-3:N[5]-3:Cl-1: C[5,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](N[5]C[5,6a]C[6a])2(Cl) N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5]Cl) N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5]Cl) P[5](N[5]C[5,6a]C[6a])2(Cl){6|C<3>} N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5]Cl){2|H<1>,6|C<3>} N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5]Cl){2|H<1>,6|C<3>} 89.7873 0.000 1 89.7873 0.000 1 89.7873 0.000 1 89.7873 0.000 1 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:1: 3:4:3: 3:4:3: N[5]-3:N[5]-3:Cl-1: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) P[5](N[5]C[6a]C[5])2(Cl){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){1|P<3>,3|C<3>,3|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){2|C<4>,2|H<1>,3|C<3>} 91.4403 0.000 1 91.4965 0.006 2 91.4965 0.006 2 91.4965 0.006 2 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:1: 3:4:3: 3:4:3: N[5]-3:N[5]-3:Cl-1: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) P[5](N[5]C[6a]C[5])2(Cl){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){2|C<4>,2|H<1>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){2|C<4>,2|H<1>,3|C<3>} 91.5527 0.000 1 91.4965 0.006 2 91.4965 0.006 2 91.4965 0.006 2 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:2: 3:3:3: 3:3:3: N[5]-3:N[5]-3:N-2: C[6a]-3:C[5]-3:P[5]-3: C[6a]-3:C[5]-3:P[5]-3: P[5](N[5]C[6a]C[5])2(NN) N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]N) N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]N) P[5](N[5]C[6a]C[5])2(NN){2|H<1>,4|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]N){1|H<1>,2|C<4>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]N){1|H<1>,2|C<4>,3|C<3>} 89.4358 0.000 1 89.4358 0.000 1 89.4358 0.000 1 89.4358 0.000 1 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:2: 3:4:3: 3:4:3: N[5]-3:N[5]-3:N-2: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(NN) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]N) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]N) P[5](N[5]C[6a]C[5])2(NN){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]N){2|C<4>,2|H<1>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]N){2|C<4>,2|H<1>,3|C<3>} 91.1431 0.000 1 91.1431 0.000 1 91.1431 0.000 1 90.5380 0.353 4 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:2: 3:4:3: 3:4:3: N[5]-3:N[5]-3:O-2: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(OC) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O) P[5](N[5]C[6a]C[5])2(OC){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O){2|C<4>,2|H<1>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O){2|C<4>,2|H<1>,3|C<3>} 90.5567 0.000 1 90.1416 0.345 2 90.1416 0.345 2 90.5380 0.353 4 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:2: 3:4:3: 3:4:3: N[5]-3:N[5]-3:O-2: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(OC) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O) P[5](N[5]C[6a]C[5])2(OC){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O){3|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O){3|C<3>,4|H<1>} 89.7266 0.000 1 90.1416 0.345 2 90.1416 0.345 2 90.5380 0.353 4 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:2: 3:4:3: 3:4:3: N[5]-3:N[5]-3:S-2: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(SC) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]S) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]S) P[5](N[5]C[6a]C[5])2(SC){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]S){2|C<4>,2|H<1>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]S){2|C<4>,2|H<1>,3|C<3>} 90.7257 0.000 1 90.7257 0.000 1 90.7257 0.000 1 90.5380 0.353 4 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:B[5a]-3: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(B[5a]N[5a]2) N[5](P[5]B[5a]N[5])(C[6a]C[6a]2)(C[5]C[5]H) N[5](P[5]B[5a]N[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(B[5a]N[5a]2){2|H<1>,8|C<3>} N[5](P[5]B[5a]N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,2|N<3>,3|C<3>} N[5](P[5]B[5a]N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,2|N<3>,3|C<3>} 92.3685 0.000 1 92.3685 0.000 1 92.3685 0.000 1 91.0671 3.387 2 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:P[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(P[5]N[5]2) N[5](P[5]N[5]P[5])(C[6a]C[6a]2)(C[5]C[5]H) N[5](P[5]N[5]P[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(P[5]N[5]2){2|H<1>,8|C<3>} N[5](P[5]N[5]P[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,2|N<3>,3|C<3>} N[5](P[5]N[5]P[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,2|N<3>,3|C<3>} 89.7657 0.000 1 89.7657 0.000 1 89.7657 0.000 1 91.0671 3.387 2 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:3: 3:3:3: 3:3:4: N[5]-3:N[5]-3:N-3: C[5,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:C-4: P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C)(NCH) N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(P[5]N[5]N) N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]N)(CH3) P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C)(NCH){4|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(P[5]N[5]N){1|C<4>,1|N<3>,2|H<1>,4|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]N)(CH3){1|H<1>,3|C<3>} 87.5681 0.000 1 87.5681 0.000 1 87.5681 0.000 1 87.5681 0.000 1 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:3: 3:3:4: 3:3:4: B[5a]-3:N[5]-3:N[5]-3: P[5]-3:C[5]-3:C-4: P[5]-3:C[5]-3:C-4: P[5](B[5a]N[5a]2)(N[5]C[5]C)2 N[5](P[5]B[5a]N[5])(C[5]C[5]H)(CC3) N[5](P[5]B[5a]N[5])(C[5]C[5]H)(CC3) P[5](B[5a]N[5a]2)(N[5]C[5]C)2{2|H<1>,4|C<3>} N[5](P[5]B[5a]N[5])(C[5]C[5]H)(CC3){1|C<4>,1|H<1>,2|N<3>} N[5](P[5]B[5a]N[5])(C[5]C[5]H)(CC3){1|C<4>,1|H<1>,2|N<3>} 95.1749 0.000 1 95.1749 0.000 1 95.1749 0.000 1 95.1749 0.000 1 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:3: 3:4:3: 3:4:3: N[5]-3:N[5]-3:C-3: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(CNO) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C) P[5](N[5]C[6a]C[5])2(CNO){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C){2|C<4>,2|H<1>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C){2|C<4>,2|H<1>,3|C<3>} 90.8954 0.000 1 90.8954 0.000 1 91.1786 0.160 2 91.1786 0.160 2 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:3: 3:4:3: 3:4:3: N[5]-3:N[5]-3:C-3: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(CSS) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C) P[5](N[5]C[6a]C[5])2(CSS){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C){2|C<4>,2|H<1>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C){2|C<4>,2|H<1>,3|C<3>} 91.4617 0.000 1 91.4617 0.000 1 91.1786 0.160 2 91.1786 0.160 2 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:4: 3:3:3: 3:3:3: N[5]-3:N[5]-3:C[5]-4: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(C[5]C[5]2C) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(C[5]C[5]2C){2|C<4>,2|H<1>,6|C<3>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,3|C<4>,5|C<3>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,3|C<4>,5|C<3>} 90.1835 0.000 1 90.1835 0.000 1 88.8539 1.638 3 88.8539 1.638 3 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:4: 3:3:3: 3:3:3: N[5]-3:N[5]-3:C[5]-4: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(C[5]C[5]2H) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(C[5]C[5]2H){4|H<1>,6|C<3>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){2|C<4>,2|H<1>,5|C<3>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){2|C<4>,2|H<1>,5|C<3>} 88.7481 0.000 1 88.7481 0.000 1 88.8539 1.638 3 88.8539 1.638 3 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP2 P[5] N[5] N[5] 3:3:4: 3:3:3: 3:3:3: N[5]-3:N[5]-3:C[5]-4: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](N[5]C[6a]C[5])2(C[5]C[5]2Li) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](N[5]C[6a]C[5])2(C[5]C[5]2Li){2|C<4>,4|C<3>,4|H<1>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|Li<7>,1|H<1>,3|C<3>,4|C<4>} N[5](P[5]C[5]N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|Li<7>,1|H<1>,3|C<3>,4|C<4>} 87.6300 0.000 1 87.6300 0.000 1 88.8539 1.638 3 88.8539 1.638 3 90.1993 3.579 19 95.0174 428.794 25 246 542 542 5:SP3_SP2_SP3 P[5,5] N[5,5] N[5] 4:3:3: 3:3:4: 3:3:4: P[5]-4:N[5,5]-3:N[5]-3: C[5,6a]-3:P[5,5]-3:C[5]-4: P[5,5]-3:C[6a]-3:C[5]-4: P[5,5](P[5]C[5,6a]C[6a]2)(N[5,5]C[5,6a]C[5])(N[5]C[6a]C[5]) N[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5]P[5])(C[5]C[5]HH) N[5](P[5,5]N[5,5]P[5])(C[6a]C[6a]2)(C[5]C[5]HH) P[5,5](P[5]C[5,6a]C[6a]2)(N[5,5]C[5,6a]C[5])(N[5]C[6a]C[5]){4|H<1>,8|C<3>} N[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5]P[5])(C[5]C[5]HH){3|H<1>,5|C<3>} N[5](P[5,5]N[5,5]P[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|P<3>,3|H<1>,6|C<3>} 91.3659 0.000 1 91.3659 0.000 1 91.3659 0.000 1 91.3659 0.000 1 91.3659 0.000 1 90.0877 6.814 9 246 542 542 5:SP3_SP2_SP3 P[5,5] N[5] N[5,5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:N[5,5]-3: C[5,6a]-3:P[5,5]-3:C[6a]-3: C[5,6a]-3:C[5,6a]-3:P[5,5]-3: P[5,5](N[5]C[5,6a]C[6a])2(N[5,5]C[5,6a]2) N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]) N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2) P[5,5](N[5]C[5,6a]C[6a])2(N[5,5]C[5,6a]2){2|N<2>,6|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]){2|H<1>,7|C<3>} N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2){2|H<1>,6|C<3>} 90.5649 0.000 1 90.5649 0.000 1 90.5649 0.000 1 90.5649 0.000 1 90.3864 0.066 3 90.0877 6.814 9 246 542 542 5:SP3_SP2_SP3 P[5,5] N[5] N[5,5] 3:3:3: 3:3:4: 3:3:3: N[5,5]-3:N[5]-3:N[5]-3: C[5,6a]-3:P[5,5]-3:C-4: C[5,6a]-3:C[5,6a]-3:P[5,5]-3: P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2 N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(CH3) N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2) P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2{4|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(CH3){1|C<4>,1|H<1>,4|C<3>} N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2){2|C<4>,2|H<1>,4|C<3>} 90.2972 0.290 2 90.2972 0.084 2 90.2972 0.084 2 90.2972 0.084 2 90.3864 0.066 3 90.0877 6.814 9 246 542 542 5:SP3_SP2_SP3 P[5] N[5,6] N[5] 3:3:3: 3:3:3: 3:3:3: N[5,6]-3:N[5]-3:N-3: C[5,6]-3:C[6]-3:P[5]-3: C[5]-3:C[6a]-3:P[5]-3: P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(NSi2) N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]N) N[5](C[5]C[5,6]H)(C[6a]C[6a]2)(P[5]N[5,6]N) P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(NSi2){2|H<1>,4|C<3>} N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]N){2|C<3>,3|H<1>} N[5](C[5]C[5,6]H)(C[6a]C[6a]2)(P[5]N[5,6]N){2|C<4>,4|C<3>} 86.9890 0.000 1 86.9890 0.000 1 86.9890 0.000 1 86.9890 0.000 1 86.9890 0.000 1 90.0877 6.814 9 246 542 542 5:SP3_SP2_SP3 P[5] N[5] N[5] 3:3:1: 3:4:3: 3:4:3: N[5]-3:N[5]-3:Cl-1: C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) P[5](N[5]C[6a]C[5])2(Cl){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){3|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){3|C<3>,4|H<1>} 91.4855 0.000 1 91.4855 0.000 1 91.4855 0.000 1 91.4855 0.000 1 90.3187 14.220 4 90.0877 6.814 9 246 542 542 5:SP3_SP2_SP3 P[5] N[5] N[5] 3:3:2: 3:3:3: 3:3:3: N[5]-3:N[5]-3:O-2: C[6a]-3:C[5]-3:P[5]-3: C[6a]-3:C[5]-3:P[5]-3: P[5](N[5]C[6a]C[5])2(OC[3,5,5]) N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O) N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O) P[5](N[5]C[6a]C[5])2(OC[3,5,5]){2|H<1>,4|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O){1|H<1>,2|C<4>,3|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O){1|H<1>,2|C<4>,3|C<3>} 89.8280 0.000 1 89.8280 0.000 1 89.8280 0.000 1 89.8280 0.000 1 90.3187 14.220 4 90.0877 6.814 9 246 542 542 5:SP3_SP2_SP3 P[5] N[5] N[5] 3:3:3: 4:3:4: 4:3:4: N[5]-3:N[5]-3:N-3: C[5,6]-4:P[5]-3:S-4: C[5,6]-4:P[5]-3:S-4: P[5](N[5]C[5,6]S)2(NCC) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO) P[5](N[5]C[5,6]S)2(NCC){2|C<4>,2|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO){1|S<4>,2|C<4>,3|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO){1|S<4>,2|C<4>,3|H<1>} 85.4625 0.000 1 85.4625 0.000 1 85.4625 0.000 1 85.4625 0.000 1 90.3187 14.220 4 90.0877 6.814 9 246 542 542 5:SP3_SP2_SP3 P[5] N[5] N[5] 5:3:3: 3:4:4: 3:4:4: C[3x3,4,3x5,14x6]-5:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: P[5]-3:C[5]-4:C-4: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2 N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3) N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2{1|C<5>,5|B<6>,8|H<1>} N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|H<1>,4|B<6>} N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|H<1>,4|B<6>} 94.4990 0.000 1 94.4990 0.000 1 94.4990 0.000 1 94.4990 0.000 1 90.3187 14.220 4 90.0877 6.814 9 246 542 542 5:SP3_SP3_SP3 P[5,5] N[5] N[5,5] 3:3:3: 3:3:3: 3:3:3: N[5]-3:N[5]-3:N[5,5]-3: C[5,6a]-3:P[5,5]-3:C[6a]-3: C[5,6a]-3:C[5,6a]-3:P[5,5]-3: P[5,5](N[5]C[5,6a]C[6a])2(N[5,5]C[5,6a]2) N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]) N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2) P[5,5](N[5]C[5,6a]C[6a])2(N[5,5]C[5,6a]2){2|N<2>,6|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]N[6a]){2|H<1>,7|C<3>} N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2){2|H<1>,6|C<3>} 89.4448 0.000 1 89.4448 0.000 1 89.4448 0.000 1 89.4448 0.000 1 89.4448 0.000 1 92.2490 8.830 9 246 542 542 5:SP3_SP3_SP3 P[5] N[5] N[5] 3:3:1: 4:3:4: 4:3:4: N[5]-3:N[5]-3:Cl-1: C[5,6]-4:P[5]-3:C-4: C[5,6]-4:P[5]-3:C-4: P[5](N[5]C[5,6]C)2(Cl) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]Cl)(CC[6a]HH) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]Cl)(CC[6a]HH) P[5](N[5]C[5,6]C)2(Cl){2|C<4>,2|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]Cl)(CC[6a]HH){3|C<4>,3|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]Cl)(CC[6a]HH){3|C<4>,3|H<1>} 92.6087 0.000 1 92.6087 0.000 1 92.6087 0.000 1 92.6087 0.000 1 92.5995 8.828 8 92.2490 8.830 9 246 542 542 5:SP3_SP3_SP3 P[5] N[5] N[5] 3:3:3: 3:3:4: 3:3:4: N[5]-3:N[5]-3:P[5]-3: P[5]-3:C[5]-3:C-4: P[5]-3:C[5]-3:C-4: P[5](N[5]C[5]C)2(P[5]N[5]2) N[5](P[5]N[5]P[5])(C[5]C[5]H)(CC3) N[5](P[5]N[5]P[5])(C[5]C[5]H)(CC3) P[5](N[5]C[5]C)2(P[5]N[5]2){2|C<3>,2|C<4>,2|H<1>} N[5](P[5]N[5]P[5])(C[5]C[5]H)(CC3){1|C<4>,1|H<1>,2|N<3>} N[5](P[5]N[5]P[5])(C[5]C[5]H)(CC3){1|C<4>,1|H<1>,2|N<3>} 94.2767 0.000 1 94.2767 0.000 1 94.2767 0.000 1 94.2767 0.000 1 92.5995 8.828 8 92.2490 8.830 9 246 542 542 5:SP3_SP3_SP3 P[5] N[5] N[5] 3:3:3: 3:4:4: 3:4:4: C[6a]-3:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: P[5]-3:C[5]-4:C-4: P[5](C[6a]C[6a]2)(N[5]C[5]C)2 N[5](P[5]C[6a]N[5])(C[5]C[5]HH)(CCCH) N[5](P[5]C[6a]N[5])(C[5]C[5]HH)(CCCH) P[5](C[6a]C[6a]2)(N[5]C[5]C)2{3|C<3>,5|H<1>} N[5](P[5]C[6a]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,2|C<3>,2|H<1>} N[5](P[5]C[6a]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,2|C<3>,2|H<1>} 93.6176 0.000 1 93.6176 0.000 1 93.6176 0.000 1 93.6176 0.000 1 92.5995 8.828 8 92.2490 8.830 9 246 542 542 5:SP3_SP3_SP3 P[5] N[5] N[5] 3:3:3: 4:3:4: 4:3:4: N[5]-3:N[5]-3:N-3: C[5,6]-4:P[5]-3:S-4: C[5,6]-4:P[5]-3:S-4: P[5](N[5]C[5,6]S)2(NCC) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO) P[5](N[5]C[5,6]S)2(NCC){2|C<4>,2|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO){1|S<4>,2|C<4>,3|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO){1|S<4>,2|C<4>,3|H<1>} 86.0521 0.000 1 86.0521 0.000 1 86.0521 0.000 1 86.0521 0.000 1 92.5995 8.828 8 92.2490 8.830 9 246 542 542 5:SP3_SP3_SP3 P[5] N[5] N[5] 3:3:4: 4:3:3: 4:3:3: N[5]-3:N[5]-3:C[5]-4: C[5,6]-4:P[5]-3:C[6a]-3: C[5,6]-4:P[5]-3:C[6a]-3: P[5](N[5]C[5,6]C[6a])2(C[5]C[5]2Fe) N[5](C[5,6]C[5,6]C[6]H)(P[5]C[5]N[5])(C[6a]C[6a]2) N[5](C[5,6]C[5,6]C[6]H)(P[5]C[5]N[5])(C[6a]C[6a]2) P[5](N[5]C[5,6]C[6a])2(C[5]C[5]2Fe){4|C<3>,4|C<4>,4|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]C[5]N[5])(C[6a]C[6a]2){1|Fe<10>,3|C<3>,4|C<4>,5|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]C[5]N[5])(C[6a]C[6a]2){1|Fe<10>,3|C<3>,4|C<4>,5|H<1>} 91.4003 0.000 1 91.4003 0.000 1 91.4003 0.000 1 91.4003 0.000 1 92.5995 8.828 8 92.2490 8.830 9 246 542 542 5:SP3_SP3_SP3 P[5] N[5] N[5] 5:3:3: 3:4:4: 3:4:4: C[3x3,4,3x5,14x6]-5:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: P[5]-3:C[5]-4:C-4: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2 N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3) N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2{1|C<5>,5|B<6>,8|H<1>} N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|H<1>,4|B<6>} N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|H<1>,4|B<6>} 95.3014 0.000 1 95.3014 0.000 1 95.3014 0.000 1 95.3014 0.000 1 92.5995 8.828 8 92.2490 8.830 9 246 542 542 5:SP3_SP3_SP3 P[5] N[5] N[5] 6:3:3: 3:4:4: 3:4:4: C[5x3,5x5,20x6]-6:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: P[5]-3:C[5]-4:C-4: P[5](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[5]C[5]C)2 N[5](P[5]C[5x3,5x5,20x6]N[5])(C[5]C[5]HH)(CCCH) N[5](P[5]C[5x3,5x5,20x6]N[5])(C[5]C[5]HH)(CCCH) P[5](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[5]C[5]C)2{1|P<3>,5|B<6>,8|H<1>} N[5](P[5]C[5x3,5x5,20x6]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,1|C<6>,2|H<1>,4|B<6>} N[5](P[5]C[5x3,5x5,20x6]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,1|C<6>,2|H<1>,4|B<6>} 93.7695 1.898 2 93.7695 3.601 2 93.7695 3.601 2 93.7695 3.601 2 92.5995 8.828 8 92.2490 8.830 9 246 542 643 0:SP3_SP2_SP2 P[5] N[5] C[6a] 3:3:3: 3:3:3: 3:3:3: N[5]-3:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) N[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]C) C[6a](P[5]N[5]P[5])(C[6a]C[6a]H)2 P[5](N[5]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>} N[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(C[5]C[5]C){2|C<4>,6|C<3>} C[6a](P[5]N[5]P[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>} 102.2730 0.000 1 102.2730 0.000 1 102.2730 0.000 1 102.2730 0.000 1 104.4730 3.705 3 104.4730 3.705 3 246 542 643 0:SP3_SP2_SP2 P[5] N[5] C[6a] 3:3:3: 3:4:3: 3:3:3: C[5,6a]-3:N[5]-3:C[6a]-3: P[5]-3:C[5]-4:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2) N[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2) C[6a](P[5]C[5,6a]N[5])(C[6a]C[6a]H)2 P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){5|H<1>,6|C<3>} N[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2){2|C<4>,6|C<3>} C[6a](P[5]C[5,6a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>} 105.8460 0.000 1 105.8460 0.000 1 105.8460 0.000 1 105.8460 0.000 1 104.4730 3.705 3 104.4730 3.705 3 246 542 643 0:SP3_SP2_SP2 P[5] N[5] C[6a] 6:3:3: 3:3:4: 3:3:3: C[5x3,6x5,20x6]-6:C[6a]-3:N[5]-3: P[5]-3:C[5]-3:C-4: P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[6a]C[6a]2)(N[5]C[5]C) N[5](P[5]C[5x3,6x5,20x6]C[6a])(C[5]C[5x3,6x5,20x6]N)(CCCH) C[6a](P[5]C[5x3,6x5,20x6]N[5])(C[6a]C[6a]H)2 P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[6a]C[6a]2)(N[5]C[5]C){1|N<2>,2|C<3>,5|B<6>,6|H<1>} N[5](P[5]C[5x3,6x5,20x6]C[6a])(C[5]C[5x3,6x5,20x6]N)(CCCH){2|C<3>,6|B<6>} C[6a](P[5]C[5x3,6x5,20x6]N[5])(C[6a]C[6a]H)2{1|C<4>,1|C<6>,2|C<3>,2|H<1>,4|B<6>} 105.3000 0.000 1 105.3000 0.000 1 105.3000 0.000 1 105.3000 0.000 1 104.4730 3.705 3 104.4730 3.705 3 246 542 643 0:SP3_SP2_SP3 P[5] N[5] C[6a] 3:3:3: 3:4:4: 3:3:3: C[6a]-3:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: C[6a]-3:C[6a]-3:P[5]-3: P[5](C[6a]C[6a]2)(N[5]C[5]C)2 N[5](P[5]C[6a]N[5])(C[5]C[5]HH)(CCCH) C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(P[5]N[5]2) P[5](C[6a]C[6a]2)(N[5]C[5]C)2{3|C<3>,5|H<1>} N[5](P[5]C[6a]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,2|C<3>,2|H<1>} C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(P[5]N[5]2){2|H<1>,3|C<3>,4|C<4>} 101.7290 1.614 2 101.7290 2.604 2 101.7290 2.604 2 101.7290 2.604 2 101.7290 2.604 2 101.7290 2.604 2 246 542 727 5:SP3_SP2_SP2 P[5] N[5] C[5,6a] 3:3:1: 4:3:3: 3:3:3: C[5,6a]-3:N[5]-3:Cl-1: C[5]-4:P[5]-3:C[6a]-3: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl) N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]Cl)(C[6a]C[6a]2) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]Cl) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl){3|H<1>,4|C<3>} N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]Cl)(C[6a]C[6a]2){2|C<4>,4|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]Cl){2|C<3>,4|H<1>} 89.7341 0.000 1 89.7341 0.000 1 89.7341 0.000 1 89.7341 0.000 1 89.5070 0.043 4 89.5070 0.043 4 246 542 727 5:SP3_SP2_SP2 P[5] N[5] C[5,6a] 3:3:2: 4:3:3: 3:3:3: C[5,6a]-3:N[5]-3:C-2: C[5]-4:P[5]-3:C[6a]-3: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC) N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]C)(C[6a]C[6a]2) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]C) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC){3|H<1>,4|C<3>} N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]C)(C[6a]C[6a]2){2|C<4>,4|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]C){2|C<3>,4|H<1>} 89.6309 0.000 1 89.6309 0.000 1 89.6309 0.000 1 89.4677 0.053 2 89.5070 0.043 4 89.5070 0.043 4 246 542 727 5:SP3_SP2_SP2 P[5] N[5] C[5,6a] 3:3:2: 4:3:3: 3:3:3: C[5,6a]-3:N[5]-3:O-2: C[5]-4:P[5]-3:C[6a]-3: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(OC) N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]O)(C[6a]C[6a]2) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(P[5]N[5]O) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(OC){2|H<1>,5|C<3>} N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]O)(C[6a]C[6a]2){2|C<4>,4|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(P[5]N[5]O){2|C<3>,4|H<1>} 89.3045 0.000 1 89.3045 0.000 1 89.3045 0.000 1 89.4677 0.053 2 89.5070 0.043 4 89.5070 0.043 4 246 542 727 5:SP3_SP2_SP2 P[5] N[5] C[5,6a] 3:3:3: 3:4:3: 3:3:3: C[5,6a]-3:N[5]-3:C[6a]-3: P[5]-3:C[5]-4:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2) N[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2) C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]N[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){5|H<1>,6|C<3>} N[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2){2|C<4>,6|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]N[5])(C[6a]C[6a]H){4|C<3>,4|H<1>} 89.3587 0.000 1 89.3587 0.000 1 89.3587 0.000 1 89.3587 0.000 1 89.5070 0.043 4 89.5070 0.043 4 246 542 778 0:SP3_SP2_SPD5 P[5] N[5] C[3x3,4,3x5,14x6] 5:3:3: 3:4:4: 6:6:6:6:3: C[3x3,4,3x5,14x6]-5:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P[5]-3: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2 N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3) C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]N[5]2) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2{1|C<5>,5|B<6>,8|H<1>} N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|H<1>,4|B<6>} C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]N[5]2){1|Si<4>,1|B<6>,4|C<4>,5|H<1>} 100.0340 0.000 1 100.0340 0.000 1 100.0340 0.000 1 100.0340 0.000 1 102.1785 9.198 2 102.1785 9.198 2 246 542 778 0:SP3_SP2_SPD5 P[5] N[5] C[3x3,4,3x5,14x6] 5:4:3: 3:2:1: 6:6:6:6:3: C[3x3,4,3x5,14x6]-5:C[5]-4:N[5]-3: P[5]-3:N[5]-2:H-1: B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P[5]-3: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[5]C[5]SiH)(N[5]N[5]H) N[5](P[5]C[3x3,4,3x5,14x6]C[5])(N[5]C[5])(H) C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]C[5]N[5]) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[5]C[5]SiH)(N[5]N[5]H){1|Si<4>,1|C<5>,4|H<1>,5|B<6>} N[5](P[5]C[3x3,4,3x5,14x6]C[5])(N[5]C[5])(H){2|Si<4>,1|H<1>,4|B<6>} C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]C[5]N[5]){1|Si<4>,1|B<6>,1|N<2>,2|C<3>,7|H<1>} 104.3230 0.000 1 104.3230 0.000 1 104.3230 0.000 1 104.3230 0.000 1 102.1785 9.198 2 102.1785 9.198 2 246 542 778 0:SP3_SP3_SPD5 P[5] N[5] C[3x3,4,3x5,14x6] 5:3:3: 3:4:4: 6:6:6:6:3: C[3x3,4,3x5,14x6]-5:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P[5]-3: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2 N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3) C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]N[5]2) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2{1|C<5>,5|B<6>,8|H<1>} N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|H<1>,4|B<6>} C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]N[5]2){1|Si<4>,1|B<6>,4|C<4>,5|H<1>} 98.8993 0.000 1 99.6562 1.880 3 99.6562 1.880 3 99.6562 1.880 3 99.6562 1.880 3 99.6562 1.880 3 246 542 778 0:SP3_SP3_SPD5 P[5] N[5] C[3x3,4,3x5,14x6] 5:3:3: 3:4:4: 6:6:6:6:3: C[3x3,4,3x5,14x6]-5:N[5]-3:N[5]-3: P[5]-3:C[5]-4:C-4: B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P[5]-3: P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2 N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3) C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]N[5]2) P[5](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[5]C[5]C)2{1|C<5>,5|B<6>,8|H<1>} N[5](P[5]C[3x3,4,3x5,14x6]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|H<1>,4|B<6>} C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(P[5]N[5]2){1|Si<5>,1|B<6>,4|C<4>,5|H<1>} 100.0346 1.703 2 99.6562 1.880 3 99.6562 1.880 3 99.6562 1.880 3 99.6562 1.880 3 99.6562 1.880 3 246 542 790 0:SP3_SP-NON_SP2 P[5] N[5] Cl 3:3:1: 3:3:3: 3: N[5]-3:N[5]-3:Cl-1: C[5,6a]-3:C[6a]-3:P[5]-3: P[5]-3: P[5](N[5]C[5,6a]C[6a])2(Cl) N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5]Cl) Cl(P[5]N[5]2) P[5](N[5]C[5,6a]C[6a])2(Cl){6|C<3>} N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5]Cl){2|H<1>,6|C<3>} Cl(P[5]N[5]2) 101.5990 1.706 2 101.5990 2.909 2 101.5990 2.909 2 102.2690 2.801 3 103.2540 3.166 11 103.2540 3.166 11 246 542 790 0:SP3_SP-NON_SP2 P[5] N[5] Cl 3:3:1: 3:3:3: 3: N[5]-3:P[5]-3:Cl-1: C[6a]-3:P[5]-3:C[5]-3: P[5]-3: P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl) N[5](C[6a]C[6a]2)(P[5]P[5]Cl)(C[5]C[5]C) Cl(P[5]N[5]P[5]) P[5](N[5]C[6a]C[5])(P[5]C[5]C)(Cl){1|C<4>,1|H<1>,2|C<3>} N[5](C[6a]C[6a]2)(P[5]P[5]Cl)(C[5]C[5]C){1|H<1>,2|C<3>,3|C<4>} Cl(P[5]N[5]P[5]) 103.6090 0.000 1 103.6090 0.000 1 103.6090 0.000 1 102.2690 2.801 3 103.2540 3.166 11 103.2540 3.166 11 246 542 790 0:SP3_SP-NON_SP2 P[5] N[5] Cl 3:3:1: 3:4:3: 3: N[5]-3:N[5]-3:Cl-1: C[6a]-3:C[5]-4:P[5]-3: P[5]-3: P[5](N[5]C[6a]C[5])2(Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) Cl(P[5]N[5]2) P[5](N[5]C[6a]C[5])2(Cl){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){1|P<3>,3|C<3>,3|H<1>} Cl(P[5]N[5]2) 100.1860 0.000 1 102.6334 2.037 5 102.6334 2.037 5 102.6334 2.037 5 103.2540 3.166 11 103.2540 3.166 11 246 542 790 0:SP3_SP-NON_SP2 P[5] N[5] Cl 3:3:1: 3:4:3: 3: N[5]-3:N[5]-3:Cl-1: C[6a]-3:C[5]-4:P[5]-3: P[5]-3: P[5](N[5]C[6a]C[5])2(Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) Cl(P[5]N[5]2) P[5](N[5]C[6a]C[5])2(Cl){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){2|C<4>,2|H<1>,3|C<3>} Cl(P[5]N[5]2) 103.2993 0.560 3 102.6334 2.037 5 102.6334 2.037 5 102.6334 2.037 5 103.2540 3.166 11 103.2540 3.166 11 246 542 790 0:SP3_SP-NON_SP2 P[5] N[5] Cl 3:3:1: 3:4:3: 3: N[5]-3:N[5]-3:Cl-1: C[6a]-3:C[5]-4:P[5]-3: P[5]-3: P[5](N[5]C[6a]C[5])2(Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) Cl(P[5]N[5]2) P[5](N[5]C[6a]C[5])2(Cl){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){3|C<3>,4|H<1>} Cl(P[5]N[5]2) 103.0830 0.000 1 102.6334 2.037 5 102.6334 2.037 5 102.6334 2.037 5 103.2540 3.166 11 103.2540 3.166 11 246 542 790 0:SP3_SP-NON_SP2 P[5] N[5] Cl 3:3:1: 4:3:3: 3: C[5,6a]-3:N[5]-3:Cl-1: C[5]-4:P[5]-3:C[6a]-3: P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl) N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]Cl)(C[6a]C[6a]2) Cl(P[5]C[5,6a]N[5]) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl){3|H<1>,4|C<3>} N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]Cl)(C[6a]C[6a]2){2|C<4>,4|C<3>} Cl(P[5]C[5,6a]N[5]) 106.0220 0.000 1 106.0220 0.000 1 106.0220 0.000 1 106.0220 0.000 1 103.2540 3.166 11 103.2540 3.166 11 246 542 790 0:SP3_SP-NON_SP2 P[5] N[5] Cl 3:3:1: 4:3:4: 3: C[5,5]-3:N[5]-3:Cl-1: Si[5]-4:P[5]-3:C-4: P[5]-3: P[5](C[5,5]C[5,5]C[5])(N[5]Si[5]C)(Cl) N[5](Si[5]C[5,5]CC)(P[5]C[5,5]Cl)(CC3) Cl(P[5]C[5,5]N[5]) P[5](C[5,5]C[5,5]C[5])(N[5]Si[5]C)(Cl){2|C<3>,4|C<4>} N[5](Si[5]C[5,5]CC)(P[5]C[5,5]Cl)(CC3){1|C<4>,2|C<3>} Cl(P[5]C[5,5]N[5]) 104.8990 0.000 2 104.8990 0.000 2 104.8990 0.000 2 104.8990 0.000 2 103.2540 3.166 11 103.2540 3.166 11 246 542 790 0:SP3_SP-NON_SP3 P[5] N[5] Cl 3:3:1: 3:4:3: 3: N[5]-3:N[5]-3:Cl-1: C[6a]-3:C[5]-4:P[5]-3: P[5]-3: P[5](N[5]C[6a]C[5])2(Cl) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl) Cl(P[5]N[5]2) P[5](N[5]C[6a]C[5])2(Cl){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]Cl){3|C<3>,4|H<1>} Cl(P[5]N[5]2) 101.6330 0.000 1 101.6330 0.000 1 101.6330 0.000 1 101.6330 0.000 1 101.3053 2.104 3 101.3053 2.104 3 246 542 790 0:SP3_SP-NON_SP3 P[5] N[5] Cl 3:3:1: 4:3:4: 3: N[5]-3:N[5]-3:Cl-1: C[5,6]-4:P[5]-3:C-4: P[5]-3: P[5](N[5]C[5,6]C)2(Cl) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]Cl)(CC[6a]HH) Cl(P[5]N[5]2) P[5](N[5]C[5,6]C)2(Cl){2|C<4>,2|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]Cl)(CC[6a]HH){3|C<4>,3|H<1>} Cl(P[5]N[5]2) 101.1414 2.012 2 101.1414 4.047 2 101.1414 4.047 2 101.1414 4.047 2 101.3053 2.104 3 101.3053 2.104 3 246 542 818 5:SP3_SP2_SP2 P[5] N[5] C[5,5] 3:3:1: 4:3:4: 4:3:3: C[5,5]-3:N[5]-3:Cl-1: Si[5]-4:P[5]-3:C-4: C[5,5]-4:P[5]-3:C[5]-3: P[5](C[5,5]C[5,5]C[5])(N[5]Si[5]C)(Cl) N[5](Si[5]C[5,5]CC)(P[5]C[5,5]Cl)(CC3) C[5,5](C[5,5]Si[5]C[5]C)(P[5]N[5]Cl)(C[5]C[5]C) P[5](C[5,5]C[5,5]C[5])(N[5]Si[5]C)(Cl){2|C<3>,4|C<4>} N[5](Si[5]C[5,5]CC)(P[5]C[5,5]Cl)(CC3){1|C<4>,2|C<3>} C[5,5](C[5,5]Si[5]C[5]C)(P[5]N[5]Cl)(C[5]C[5]C){5|C<4>} 93.6095 0.000 2 93.6095 0.000 2 93.6095 0.000 2 93.6095 0.000 2 93.6095 0.000 2 92.4403 4.101 3 246 542 818 5:SP3_SP2_SP2 P[5] N[5] C[5] 3:3:2: 3:3:3: 3:3:4: N[5]-3:C[5]-3:O-2: C[5,5]-3:C[6a]-3:P[5]-3: C[5,5]-3:P[5]-3:C-4: P[5](N[5]C[5,5]C[6a])(C[5]C[5,5]C)(OGa) N[5](C[5,5]C[5,5]C[5])(C[6a]C[6a]2)(P[5]C[5]O) C[5](C[5,5]C[5,5]N[5])(P[5]N[5]O)(CC3) P[5](N[5]C[5,5]C[6a])(C[5]C[5,5]C)(OGa){1|C<4>,1|N<3>,2|C<3>} N[5](C[5,5]C[5,5]C[5])(C[6a]C[6a]2)(P[5]C[5]O){1|N<3>,3|C<3>,5|C<4>} C[5](C[5,5]C[5,5]N[5])(P[5]N[5]O)(CC3){1|C<4>,3|C<3>} 90.1020 0.000 1 90.1020 0.000 1 90.1020 0.000 1 90.1020 0.000 1 90.1020 0.000 1 92.4403 4.101 3 246 542 893 0:SP3_SP2_SP2 P[5] N[5] O 3:3:2: 3:4:3: 3:3: N[5]-3:N[5]-3:O-2: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:C-3: P[5](N[5]C[6a]C[5])2(OC) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O) O(P[5]N[5]2)(CP[5]N) P[5](N[5]C[6a]C[5])2(OC){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O){2|C<4>,2|H<1>,3|C<3>} O(P[5]N[5]2)(CP[5]N) 100.0075 1.251 2 100.0075 1.565 2 100.0075 1.565 2 100.0075 1.565 2 101.1120 4.442 3 101.1120 4.442 3 246 542 893 0:SP3_SP2_SP2 P[5] N[5] O 3:3:2: 4:3:3: 3:3: C[5,6a]-3:N[5]-3:O-2: C[5]-4:P[5]-3:C[6a]-3: P[5]-3:C-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(OC) N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]O)(C[6a]C[6a]2) O(P[5]C[5,6a]N[5])(CHO) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(OC){2|H<1>,5|C<3>} N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]O)(C[6a]C[6a]2){2|C<4>,4|C<3>} O(P[5]C[5,6a]N[5])(CHO) 103.3210 0.000 1 103.3210 0.000 1 103.3210 0.000 1 103.3210 0.000 1 101.1120 4.442 3 101.1120 4.442 3 246 542 893 0:SP3_SP2_SP3 P[5] N[5] O 3:3:2: 3:3:3: 3:4: N[5]-3:C[5]-3:O-2: C[5,5]-3:C[6a]-3:P[5]-3: P[5]-3:Ga-4: P[5](N[5]C[5,5]C[6a])(C[5]C[5,5]C)(OGa) N[5](C[5,5]C[5,5]C[5])(C[6a]C[6a]2)(P[5]C[5]O) O(P[5]C[5]N[5])(GaCl3) P[5](N[5]C[5,5]C[6a])(C[5]C[5,5]C)(OGa){1|C<4>,1|N<3>,2|C<3>} N[5](C[5,5]C[5,5]C[5])(C[6a]C[6a]2)(P[5]C[5]O){1|N<3>,3|C<3>,5|C<4>} O(P[5]C[5]N[5])(GaCl3) 105.6850 0.000 1 105.6850 0.000 1 105.6850 0.000 1 105.6850 0.000 1 104.2018 3.380 4 104.2018 3.380 4 246 542 893 0:SP3_SP2_SP3 P[5] N[5] O 3:3:2: 3:3:3: 4:3: N[5]-3:N[5]-3:O-2: C[6a]-3:C[5]-3:P[5]-3: C[3,5,5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(OC[3,5,5]) N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O) O(C[3,5,5]P[3,3,5]2C[5,5])(P[5]N[5]2) P[5](N[5]C[6a]C[5])2(OC[3,5,5]){2|H<1>,4|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O){1|H<1>,2|C<4>,3|C<3>} O(C[3,5,5]P[3,3,5]2C[5,5])(P[5]N[5]2) 101.7370 0.000 1 101.7370 0.000 1 101.7370 0.000 1 101.7370 0.000 1 104.2018 3.380 4 104.2018 3.380 4 246 542 893 0:SP3_SP2_SP3 P[5] N[5] O 3:3:2: 3:4:3: 3:4: N[5]-3:N[5]-3:O-2: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:C-4: P[5](N[5]C[6a]C[5])2(OC) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O) O(P[5]N[5]2)(CCHH) P[5](N[5]C[6a]C[5])2(OC){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]O){3|C<3>,4|H<1>} O(P[5]N[5]2)(CCHH) 104.6925 1.176 2 104.6925 1.383 2 104.6925 1.383 2 104.6925 1.383 2 104.2018 3.380 4 104.2018 3.380 4 246 542 893 0:SP3_SP3_SP3 P[5] N[5] O 3:3:2: 3:3:3: 4:3: N[5]-3:N[5]-3:O-2: C[6a]-3:C[5]-3:P[5]-3: C[3,5,5]-4:P[5]-3: P[5](N[5]C[6a]C[5])2(OC[3,5,5]) N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O) O(C[3,5,5]P[3,3,5]2C[5,5])(P[5]N[5]2) P[5](N[5]C[6a]C[5])2(OC[3,5,5]){2|H<1>,4|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]O){1|H<1>,2|C<4>,3|C<3>} O(C[3,5,5]P[3,3,5]2C[5,5])(P[5]N[5]2) 99.6417 0.000 1 99.6417 0.000 1 99.6417 0.000 1 99.6417 0.000 1 99.6417 0.000 1 99.6417 0.000 1 246 542 909 0:SP3_SP2_SP2 P[5] N[5] S 3:3:2: 3:4:3: 3:3: N[5]-3:N[5]-3:S-2: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:C-3: P[5](N[5]C[6a]C[5])2(SC) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]S) S(P[5]N[5]2)(CP[5]S) P[5](N[5]C[6a]C[5])2(SC){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]S){2|C<4>,2|H<1>,3|C<3>} S(P[5]N[5]2)(CP[5]S) 103.0725 1.372 2 103.0725 1.884 2 103.0725 1.884 2 103.0725 1.884 2 103.0725 1.884 2 103.0725 1.884 2 246 542 924 0:SP3_SP-NON_SP2 P[5] N[5] Br 3:3:1: 3:3:2: 3: N[5]-3:N[5]-3:Br-1: C[6a]-3:P[5]-3:N[5]-2: P[5]-3: P[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(Br) N[5](C[6a]C[6a]2)(P[5]N[5]Br)(N[5]C[5]) Br(P[5]N[5]2) P[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(Br){1|C<4>,4|C<3>} N[5](C[6a]C[6a]2)(P[5]N[5]Br)(N[5]C[5]){1|C<4>,2|H<1>,3|C<3>} Br(P[5]N[5]2) 98.7270 0.247 2 98.7270 0.061 2 98.7270 0.061 2 98.7270 0.061 2 101.6227 11.416 4 101.6227 11.416 4 246 542 924 0:SP3_SP-NON_SP2 P[5] N[5] Br 3:3:1: 3:3:3: 3: N[5]-3:N[5]-3:Br-1: C[6a]-3:P[5]-3:C[5]-3: P[5]-3: P[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(Br) N[5](C[6a]C[6a]2)(P[5]N[5]Br)(C[5]N[5]C) Br(P[5]N[5]2) P[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(Br){1|C<4>,4|C<3>} N[5](C[6a]C[6a]2)(P[5]N[5]Br)(C[5]N[5]C){2|C<4>,3|C<3>} Br(P[5]N[5]2) 104.5185 0.804 2 104.5185 0.646 2 104.5185 0.646 2 104.5185 0.646 2 101.6227 11.416 4 101.6227 11.416 4 246 542 930 0:SP3_SP2_SP2 P[5] N[5] C 3:3:3: 3:4:3: 3:2:1: N[5]-3:N[5]-3:C-3: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:S-2:S-1: P[5](N[5]C[6a]C[5])2(CSS) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C) C(P[5]N[5]2)(SP[5])(S) P[5](N[5]C[6a]C[5])2(CSS){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C){2|C<4>,2|H<1>,3|C<3>} C(P[5]N[5]2)(SP[5])(S) 102.8767 4.181 2 102.8767 17.479 2 102.8767 17.479 2 102.8767 17.479 2 102.9839 9.502 4 102.9839 9.502 4 246 542 930 0:SP3_SP2_SP2 P[5] N[5] C 3:3:3: 3:4:3: 3:2:2: N[5]-3:N[5]-3:C-3: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:N-2:O-2: P[5](N[5]C[6a]C[5])2(CNO) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C) C(P[5]N[5]2)(NC[6a])(OP[5]) P[5](N[5]C[6a]C[5])2(CNO){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]C){2|C<4>,2|H<1>,3|C<3>} C(P[5]N[5]2)(NC[6a])(OP[5]) 103.0910 3.314 2 103.0910 10.979 2 103.0910 10.979 2 103.0910 10.979 2 102.9839 9.502 4 102.9839 9.502 4 246 542 941 0:SP3_SP2_SP2 P[5] N[5] N 3:3:2: 3:3:3: 3:2: N[5]-3:N[5]-3:N-2: C[6a]-3:C[5]-3:P[5]-3: P[5]-3:N-2: P[5](N[5]C[6a]C[5])2(NN) N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]N) N(P[5]N[5]2)(NN) P[5](N[5]C[6a]C[5])2(NN){2|H<1>,4|C<3>} N[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]N[5]N){1|H<1>,2|C<4>,3|C<3>} N(P[5]N[5]2)(NN) 100.8758 3.068 2 100.8758 9.411 2 100.8758 9.411 2 100.8758 9.411 2 101.1879 3.537 4 101.1879 3.537 4 246 542 941 0:SP3_SP2_SP2 P[5] N[5] N 3:3:2: 3:4:3: 3:2: N[5]-3:N[5]-3:N-2: C[6a]-3:C[5]-4:P[5]-3: P[5]-3:N-2: P[5](N[5]C[6a]C[5])2(NN) N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]N) N(P[5]N[5]2)(NN) P[5](N[5]C[6a]C[5])2(NN){4|C<3>,4|H<1>} N[5](C[6a]C[6a]2)(C[5]C[5]HH)(P[5]N[5]N){2|C<4>,2|H<1>,3|C<3>} N(P[5]N[5]2)(NN) 101.5000 0.901 2 101.5000 0.812 2 101.5000 0.812 2 101.5000 0.812 2 101.1879 3.537 4 101.1879 3.537 4 246 542 955 0:SP3_SP2_SP3 P[5,5] N[5] P[5] 4:3:3: 3:3:4: 3:3:3:3: P[5]-4:N[5,5]-3:N[5]-3: P[5,5]-3:C[6a]-3:C[5]-4: C[5,6a]-3:P[5,5]-3:C[6a]-3:C[6a]-3: P[5,5](P[5]C[5,6a]C[6a]2)(N[5,5]C[5,6a]C[5])(N[5]C[6a]C[5]) N[5](P[5,5]N[5,5]P[5])(C[6a]C[6a]2)(C[5]C[5]HH) P[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]2)2 P[5,5](P[5]C[5,6a]C[6a]2)(N[5,5]C[5,6a]C[5])(N[5]C[6a]C[5]){4|H<1>,8|C<3>} N[5](P[5,5]N[5,5]P[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|P<3>,3|H<1>,6|C<3>} P[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]2)2{2|C<4>,5|H<1>,7|C<3>} 111.4690 0.000 1 111.4690 0.000 1 111.4690 0.000 1 111.4690 0.000 1 111.4690 0.000 1 111.4690 0.000 1 246 542 955 5:SP3_SP3_SP3 P[5,5] N[5,5] P[5] 4:3:3: 3:3:4: 3:3:3:3: P[5]-4:N[5,5]-3:N[5]-3: C[5,6a]-3:P[5,5]-3:C[5]-4: C[5,6a]-3:P[5,5]-3:C[6a]-3:C[6a]-3: P[5,5](P[5]C[5,6a]C[6a]2)(N[5,5]C[5,6a]C[5])(N[5]C[6a]C[5]) N[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5]P[5])(C[5]C[5]HH) P[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]2)2 P[5,5](P[5]C[5,6a]C[6a]2)(N[5,5]C[5,6a]C[5])(N[5]C[6a]C[5]){4|H<1>,8|C<3>} N[5,5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5]P[5])(C[5]C[5]HH){3|H<1>,5|C<3>} P[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5])(C[6a]C[6a]2)2{2|C<4>,5|H<1>,7|C<3>} 88.8275 0.000 1 88.8275 0.000 1 88.8275 0.000 1 88.8275 0.000 1 88.8275 0.000 1 88.8275 0.000 1 246 542 956 0:SP3_SP2_SP2 P[5] N[5,6] N 3:3:3: 3:3:3: 3:4:4: N[5,6]-3:N[5]-3:N-3: C[5,6]-3:C[6]-3:P[5]-3: P[5]-3:Si-4:Si-4: P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(NSi2) N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]N) N(P[5]N[5,6]N[5])(SiC3)2 P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(NSi2){2|H<1>,4|C<3>} N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]N){2|C<3>,3|H<1>} N(P[5]N[5,6]N[5])(SiC3)2 103.4730 0.000 1 103.4730 0.000 1 103.4730 0.000 1 103.4730 0.000 1 103.0656 2.063 5 103.8435 5.281 6 246 542 956 0:SP3_SP2_SP2 P[5] N[5,6] N 3:3:3: 3:3:4: 3:4:4: N[5,6]-3:N[5,6]-3:N-3: C[5,5,6]-3:P[5]-3:C[6]-4: P[5]-3:C-4:C-4: P[5](N[5,6]C[5,5,6]C[6])2(NCC) N[5,6](C[5,5,6]C[5,5,6]N[5,6])(P[5]N[5,6]N)(C[6]C[6]HH) N(P[5]N[5,6]2)(CH3)2 P[5](N[5,6]C[5,5,6]C[6])2(NCC){2|C<4>,2|N<3>,4|H<1>} N[5,6](C[5,5,6]C[5,5,6]N[5,6])(P[5]N[5,6]N)(C[6]C[6]HH){1|As<3>,1|N<3>,2|C<4>,2|H<1>} N(P[5]N[5,6]2)(CH3)2 102.6950 2.698 2 102.6950 7.281 2 102.6950 7.281 2 102.9638 2.682 4 103.0656 2.063 5 103.8435 5.281 6 246 542 956 0:SP3_SP2_SP2 P[5] N[5,6] N 3:3:3: 3:3:4: 3:4:4: N[5,6]-3:N[5,6]-3:N-3: C[5,6]-3:P[5]-3:C[6]-4: P[5]-3:C-4:C-4: P[5](N[5,6]C[5,6]C[6])2(NCC) N[5,6](C[5,6]C[5,6]N[6])(P[5]N[5,6]N)(C[6]C[6]HH) N(P[5]N[5,6]2)(CH3)2 P[5](N[5,6]C[5,6]C[6])2(NCC){2|C<4>,2|N<3>,4|H<1>} N[5,6](C[5,6]C[5,6]N[6])(P[5]N[5,6]N)(C[6]C[6]HH){1|Sb<5>,1|N<3>,2|C<4>,2|H<1>} N(P[5]N[5,6]2)(CH3)2 103.2325 0.689 2 103.2325 0.475 2 103.2325 0.475 2 102.9638 2.682 4 103.0656 2.063 5 103.8435 5.281 6 246 542 956 0:SP3_SP2_SP2 P[5] N[5] N 3:3:3: 4:3:4: 3:4:4: N[5]-3:N[5]-3:N-3: C[5,6]-4:P[5]-3:S-4: P[5]-3:C-4:C-4: P[5](N[5]C[5,6]S)2(NCC) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO) N(P[5]N[5]2)(CCHH)2 P[5](N[5]C[5,6]S)2(NCC){2|C<4>,2|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO){1|S<4>,2|C<4>,3|H<1>} N(P[5]N[5]2)(CCHH)2 107.7330 0.000 1 107.7330 0.000 1 107.7330 0.000 1 107.7330 0.000 1 107.7330 0.000 1 103.8435 5.281 6 246 542 956 0:SP3_SP2_SP3 P[5] N[5] N 3:3:3: 3:3:3: 3:4:1: N[5]-3:N[5]-3:N-3: C[5,6a]-3:C[6a]-3:P[5]-3: P[5]-3:C-4:H-1: P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C)(NCH) N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(P[5]N[5]N) N(P[5]N[5]2)(CC[6a]HH)(H) P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C)(NCH){4|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(P[5]N[5]N){1|C<4>,1|N<3>,2|H<1>,4|C<3>} N(P[5]N[5]2)(CC[6a]HH)(H) 105.3640 0.000 1 105.3640 0.000 1 105.3640 0.000 1 105.3640 0.000 1 105.4990 19.246 6 105.4990 19.246 6 246 542 956 0:SP3_SP2_SP3 P[5] N[5] N 3:3:3: 3:3:3: 3:4:4: N[5,6]-3:N[5]-3:N-3: C[5]-3:C[6a]-3:P[5]-3: P[5]-3:Si-4:Si-4: P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(NSi2) N[5](C[5]C[5,6]H)(C[6a]C[6a]2)(P[5]N[5,6]N) N(P[5]N[5,6]N[5])(SiC3)2 P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(NSi2){2|H<1>,4|C<3>} N[5](C[5]C[5,6]H)(C[6a]C[6a]2)(P[5]N[5,6]N){2|C<4>,4|C<3>} N(P[5]N[5,6]N[5])(SiC3)2 112.8720 0.000 1 112.8720 0.000 1 112.8720 0.000 1 112.8720 0.000 1 105.4990 19.246 6 105.4990 19.246 6 246 542 956 0:SP3_SP2_SP3 P[5] N[5] N 3:3:3: 3:3:4: 3:4:1: N[5]-3:N[5]-3:N-3: C[5,6a]-3:P[5]-3:C-4: P[5]-3:C-4:H-1: P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C)(NCH) N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]N)(CH3) N(P[5]N[5]2)(CC[6a]HH)(H) P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C)(NCH){4|C<3>} N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]N)(CH3){1|H<1>,3|C<3>} N(P[5]N[5]2)(CC[6a]HH)(H) 105.2450 0.000 1 105.2450 0.000 1 105.2450 0.000 1 105.2450 0.000 1 105.4990 19.246 6 105.4990 19.246 6 246 542 956 0:SP3_SP2_SP3 P[5] N[5] N 3:3:3: 4:3:4: 3:4:4: N[5]-3:N[5]-3:N-3: C[5,6]-4:P[5]-3:S-4: P[5]-3:C-4:C-4: P[5](N[5]C[5,6]S)2(NCC) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO) N(P[5]N[5]2)(CCHH)2 P[5](N[5]C[5,6]S)2(NCC){2|C<4>,2|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO){1|S<4>,2|C<4>,3|H<1>} N(P[5]N[5]2)(CCHH)2 101.4340 0.000 1 101.4340 0.000 1 103.1710 12.764 3 103.1710 12.764 3 105.4990 19.246 6 105.4990 19.246 6 246 542 956 0:SP3_SP2_SP3 P[5] N[5] N 3:3:3: 4:3:4: 3:4:4: N[5]-3:N[5]-3:N-3: C[5,6]-4:P[5]-3:S-4: P[5]-3:C-4:C-4: P[5](N[5]C[5,6]S)2(NCC) N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO) N(P[5]N[5]2)(CH3)2 P[5](N[5]C[5,6]S)2(NCC){2|C<4>,2|H<1>} N[5](C[5,6]C[5,6]C[6]H)(P[5]N[5]N)(SCOO){1|S<4>,2|C<4>,3|H<1>} N(P[5]N[5]2)(CH3)2 104.0395 4.583 2 104.0395 21.002 2 103.1710 12.764 3 103.1710 12.764 3 105.4990 19.246 6 105.4990 19.246 6 246 542 983 0:SP3_SP1_SP2 P[5] N[5] C 3:3:2: 4:3:3: 3:2: C[5,6a]-3:N[5]-3:C-2: C[5]-4:P[5]-3:C[6a]-3: P[5]-3:C-2: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC) N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]C)(C[6a]C[6a]2) C(P[5]C[5,6a]N[5])(CC[6a]) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC){3|H<1>,4|C<3>} N[5](C[5]C[5,6a]HH)(P[5]C[5,6a]C)(C[6a]C[6a]2){2|C<4>,4|C<3>} C(P[5]C[5,6a]N[5])(CC[6a]) 106.7000 0.000 1 106.7000 0.000 1 106.7000 0.000 1 106.7000 0.000 1 106.7000 0.000 1 106.7000 0.000 1 246 562 562 5:SP3_SP3_SP3 P[5] Si[5] Si[5] 4:4:4: 3:4:4:4: 3:4:4:4: Si[5]-4:Si[5]-4:Si-4: P[5]-3:C[5]-4:C-4:C-4: P[5]-3:C[5]-4:C-4:C-4: P[5](Si[5]C[5]CC)2(SiC3) Si[5](P[5]Si[5]Si)(C[5]C[5]HH)(CH3)2 Si[5](P[5]Si[5]Si)(C[5]C[5]HH)(CH3)2 P[5](Si[5]C[5]CC)2(SiC3){4|H<1>} Si[5](P[5]Si[5]Si)(C[5]C[5]HH)(CH3)2{2|C<4>,2|H<1>} Si[5](P[5]Si[5]Si)(C[5]C[5]HH)(CH3)2{2|C<4>,2|H<1>} 89.8195 0.111 2 89.8195 0.012 2 89.8195 0.012 2 89.8195 0.012 2 89.8195 0.012 2 89.8195 0.012 2 246 562 658 0:SP3_SP3_SP3 P[5,6] Si[5] Si[6] 3:4:4: 3:2:4:4: 3:3:4:4: P[5,6]-3:Si[6]-4:Si[5]-4: P[5,6]-3:O[5]-2:C-4:C-4: P[6,6]-3:P[5,6]-3:C-4:C-4: P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC) Si[5](P[5,6]P[5,6]Si[6])(O[5]Si[5])(CCCH)2 Si[6](P[6,6]Si[6,6]Si[6])(P[5,6]P[5,6]Si[5])(CCCH)2 P[5,6](P[5,6]P[6,6]Si[5])(Si[6]P[6,6]CC)(Si[5]O[5]CC){3|Si<4>,2|C<4>} Si[5](P[5,6]P[5,6]Si[6])(O[5]Si[5])(CCCH)2{2|P<3>,4|C<4>} Si[6](P[6,6]Si[6,6]Si[6])(P[5,6]P[5,6]Si[5])(CCCH)2{1|Si<4>,1|P<3>,2|O<2>,6|C<4>} 124.7740 0.000 1 124.7740 0.000 1 124.7740 0.000 1 124.7740 0.000 1 124.7740 0.000 1 124.7740 0.000 1 246 562 818 5:SP3_SP2_SP3 P[5,5,6] Si[3x5] C[5,6] 4:3:3: 4:3:3:3: 3:2:4: Si[3x5]-4:C[5,6]-3:C[5,6]-3: C[5,5,6]-4:P[5,5,6]-3:N[5]-3:N[5]-3: P[5,5,6]-3:P[5,6]-2:C-4: P[5,5,6](Si[3x5]C[5,5,6]N[5]2)(C[5,6]P[5,6]C)2 Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5,6a]C)2 C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3) P[5,5,6](Si[3x5]C[5,5,6]N[5]2)(C[5,6]P[5,6]C)2{2|C<3>,3|C<4>} Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5,6a]C)2{2|C<3>,2|C<4>} C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3){1|P<2>,2|C<4>,2|N<3>} 88.7940 0.492 2 88.7940 0.242 2 89.1486 0.451 4 89.1486 0.451 4 89.1486 0.451 4 90.9344 7.940 6 246 562 818 5:SP3_SP2_SP3 P[5,5,6] Si[3x5] C[5,6] 4:3:3: 4:3:3:3: 3:2:4: Si[3x5]-4:C[5,6]-3:C[5,6]-3: C[5,5,6]-4:P[5,5,6]-3:N[5]-3:N[5]-3: P[5,5,6]-3:P[5,6]-2:C-4: P[5,5,6](Si[3x5]C[5,5,6]N[5]2)(C[5,6]P[5,6]C)2 Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5]C)2 C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3) P[5,5,6](Si[3x5]C[5,5,6]N[5]2)(C[5,6]P[5,6]C)2{2|C<3>,3|C<4>} Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5]C)2{2|C<4>,2|H<1>} C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3){1|P<2>,2|C<4>,2|N<3>} 89.5032 0.779 2 89.5032 0.607 2 89.1486 0.451 4 89.1486 0.451 4 89.1486 0.451 4 90.9344 7.940 6 246 562 818 5:SP3_SP2_SP3 P[5] Si[5] C[5] 3:4:4: 3:3:4:4: 4:4:3: C[5]-3:Si[5]-4:C-4: N[5]-3:P[5]-3:C-4:C-4: Si[4,5]-4:C[3x6]-4:P[5]-3: P[5](C[5]Si[4,5]C[3x6])(Si[5]N[5]CC)(CH3) Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2 C[5](Si[4,5]N[4]2N[5])(C[3x6]C[6,6]3)(P[5]Si[5]C) P[5](C[5]Si[4,5]C[3x6])(Si[5]N[5]CC)(CH3){1|Si<4>,2|N<3>,3|C<4>} Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2{1|C<4>,2|N<3>} C[5](Si[4,5]N[4]2N[5])(C[3x6]C[6,6]3)(P[5]Si[5]C){1|Si<4>,1|C<3>,6|H<1>,7|C<4>} 94.5059 0.282 2 94.5059 0.080 2 94.5059 0.080 2 94.5059 0.080 2 94.5059 0.080 2 90.9344 7.940 6 246 562 880 0:SP3_SP3_SP3 P[5] Si[5] Si 4:4:4: 3:4:4:4: 3:4:4:4: Si[5]-4:Si[5]-4:Si-4: P[5]-3:C[5]-4:C-4:C-4: P[5]-3:C-4:C-4:C-4: P[5](Si[5]C[5]CC)2(SiC3) Si[5](P[5]Si[5]Si)(C[5]C[5]HH)(CH3)2 Si(P[5]Si[5]2)(CCHH)(CH3)2 P[5](Si[5]C[5]CC)2(SiC3){4|H<1>} Si[5](P[5]Si[5]Si)(C[5]C[5]HH)(CH3)2{2|C<4>,2|H<1>} Si(P[5]Si[5]2)(CCHH)(CH3)2 104.9350 1.469 4 104.9350 2.158 4 104.9350 2.158 4 104.9350 2.158 4 104.9350 2.158 4 104.9350 2.158 4 246 606 818 5:SP3_SP2_SP3 P[5,6] Ge[5] C[5,6] 3:3:4: 3:4:4:4: 3:3:3: P[5,6]-3:C[5,6]-3:Ge[5]-4: P[5,6]-3:C[5]-4:C-4:C-4: P[5,6]-3:P[5,6]-3:C-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC) Ge[5](P[5,6]C[5,6]P[5,6])(C[5]P[5,6]CH)(CSi2H)2 C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]P[5,6]C)(Ge[5]C[5]CC){1|Ge<4>,1|C<3>,1|P<3>,2|C<4>,2|H<1>} Ge[5](P[5,6]C[5,6]P[5,6])(C[5]P[5,6]CH)(CSi2H)2{1|C<4>,1|P<3>,2|C<3>} C[5,6](P[5,6]P[5,6]Ge[5])(P[5,6]P[5,6]C[5])(CHH){1|Ge<4>,1|C<3>,1|H<1>,4|C<4>} 91.2124 0.000 1 91.2124 0.000 1 91.2124 0.000 1 91.2124 0.000 1 91.2124 0.000 1 90.1398 2.301 2 246 606 818 5:SP3_SP2_SP3 P[5] Ge[5,6] C[5] 4:3:4: 3:2:2:2: 3:4:1: Ge[5,6]-4:C[5]-3:C-4: P[5]-3:N[6]-2:O[5]-2:O[6]-2: P[5]-3:C[5]-4:H-1: P[5](Ge[5,6]N[6]O[5]O[6])(C[5]C[5]H)(CC3) Ge[5,6](P[5]C[5]C)(N[6]P[6])(O[5]C[5])(O[6]C[6]) C[5](P[5]Ge[5,6]C)(C[5]O[5]CC)(H) P[5](Ge[5,6]N[6]O[5]O[6])(C[5]C[5]H)(CC3){1|P<4>,3|C<4>} Ge[5,6](P[5]C[5]C)(N[6]P[6])(O[5]C[5])(O[6]C[6]){1|H<1>,7|C<4>} C[5](P[5]Ge[5,6]C)(C[5]O[5]CC)(H){1|N<2>,1|O<2>} 89.0673 0.000 1 89.0673 0.000 1 89.0673 0.000 1 89.0673 0.000 1 89.0673 0.000 1 90.1398 2.301 2 246 606 882 5:SP3_SP3_SP3 P[3x5,6] Ge[5,5] P[4,5,5,6] 4:3:4: 3:3:1:1: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:Ge[5,5]-4: P[3x5,6]-3:P[3x5,6]-3:I-1:I-1: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]II) Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(I)2 P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]II){1|P<3>,3|C<4>} Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(I)2{2|P<3>,4|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C){1|P<3>,2|C<4>,2|I<1>} 89.2755 0.184 2 89.2755 0.034 2 89.2755 0.034 2 89.2755 0.034 2 91.2727 1.734 8 91.2727 1.734 8 246 606 882 5:SP3_SP3_SP3 P[3x5,6] Ge[5,5] P[4,5,5,6] 4:3:4: 3:3:3:3: 4:3:4: C[4,5,5,6]-4:P[4,5,5,6]-3:Ge[5,5]-4: P[3x5,6]-3:P[3x5,6]-3:N-3:N-3: C[4,5,5,6]-4:P[3x5,6]-3:C[4,4,5]-4: P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN) Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(NSi2)2 P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C) P[3x5,6](C[4,5,5,6]P[4,5,5,6]P[4,4,5]C)(P[4,5,5,6]C[4,5,5,6]C[4,4,5])(Ge[5,5]P[3x5,6]NN){1|P<3>,3|C<4>} Ge[5,5](P[3x5,6]C[4,5,5,6]P[4,5,5,6])2(NSi2)2{2|P<3>,4|C<4>} P[4,5,5,6](C[4,5,5,6]P[3x5,6]P[4,4,5]C)(P[3x5,6]C[4,5,5,6]Ge[5,5])(C[4,4,5]P[4,4,5]2C){1|P<3>,2|C<4>,2|N<3>} 91.9384 0.541 6 91.9384 0.293 6 91.9384 0.293 6 91.9384 0.293 6 91.2727 1.734 8 91.2727 1.734 8 246 610 727 0:SP3_SP2_SP3 P[5] B C[5,6a] 3:4:4: 3:3:3:3: 3:3:3: C[5,6a]-3:C[5]-4:B-4: P[5]-3:C[6a]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:C[6a]-3:P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6]N[5]Yb)(BC[6a]3) B(P[5]C[5,6a]C[5])(C[6a]C[6a]2)3 C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(P[5]C[5]B) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6]N[5]Yb)(BC[6a]3){1|C<4>,1|H<1>,3|C<3>} B(P[5]C[5,6a]C[5])(C[6a]C[6a]2)3 C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(P[5]C[5]B){1|Yb<15>,1|C<3>,1|C<4>,2|H<1>} 110.6020 0.000 1 110.6020 0.000 1 110.6020 0.000 1 110.6020 0.000 1 110.6020 0.000 1 110.6020 0.000 1 246 643 727 0:SP3_SP2_SP2 P[5,6] C[6,6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[6,6a]-3:C[5,6]-3: P[5,6]-3:C[6,6a]-3:C[6a]-3: P[5,6]-3:C[5,6a]-3:C[6a]-3: P[5,6](C[5,6a]C[5,6a]C[6a])(C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]) C[6,6a](P[5,6]C[5,6a]C[5,6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) C[5,6a](P[5,6]C[6,6a]C[5,6])(C[5,6a]C[6a]C[5])(C[6a]C[6a]H) P[5,6](C[5,6a]C[5,6a]C[6a])(C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]){4|H<1>,5|C<3>} C[6,6a](P[5,6]C[5,6a]C[5,6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){3|H<1>,5|C<3>} C[5,6a](P[5,6]C[6,6a]C[5,6])(C[5,6a]C[6a]C[5])(C[6a]C[6a]H){3|H<1>,4|C<3>} 115.9270 0.000 1 115.9270 0.000 1 115.9270 0.000 1 115.9270 0.000 1 115.9270 0.000 1 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,5a] 3:3:3: 3:3:3: 3:3:3: C[5,5a]-3:C[5,5a]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,5a]-3:P[5]-3:C[5a]-3: P[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2) C[6a](P[5]C[5,5a]2)(C[6a]C[6a]F)2 C[5,5a](C[5,5a]C[5,5a]S[5a])(P[5]C[5,5a]C[6a])(C[5a]C[5a]H) P[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2){2|F<1>,2|H<1>,2|S<2>,4|C<3>} C[6a](P[5]C[5,5a]2)(C[6a]C[6a]F)2{2|F<1>,5|C<3>} C[5,5a](C[5,5a]C[5,5a]S[5a])(P[5]C[5,5a]C[6a])(C[5a]C[5a]H){1|H<1>,1|S<2>,3|C<3>} 105.8920 3.254 2 105.8920 10.589 2 105.8920 10.589 2 105.8920 10.589 2 105.8920 10.589 2 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,5]-3:C[5,6a]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,5]C[5,6a]C[5,5])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2) C[6a](P[5]C[5,6a]C[5,5])(C[6a]C[6a]H)2 C[5,6a](C[5,6a]C[5,5]C[6a])(P[5]C[5,5]C[6a])(C[6a]C[6a]H) P[5](C[5,5]C[5,6a]C[5,5])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|S<4>,3|H<1>,6|C<3>} C[6a](P[5]C[5,6a]C[5,5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,5]C[6a])(P[5]C[5,5]C[6a])(C[6a]C[6a]H){1|S<4>,2|H<1>,4|C<3>} 105.0810 0.000 1 105.0810 0.000 1 105.0810 0.000 1 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[6a]-3: C[6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]Cl)(P[5]C[5,6a]2)(C[6a]C[6a]C) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]Cl) P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){2|Cl<1>,1|H<1>,7|C<3>} C[6a](C[6a]C[6a]Cl)(P[5]C[5,6a]2)(C[6a]C[6a]C){2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]Cl){2|H<1>,5|C<3>} 107.8350 0.000 1 107.8350 0.000 1 106.8175 2.071 2 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[6a]-3: C[6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]Cl)(P[5]C[5,6a]2)(C[6a]C[6a]C) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){2|Cl<1>,1|H<1>,7|C<3>} C[6a](C[6a]C[6a]Cl)(P[5]C[5,6a]2)(C[6a]C[6a]C){2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H){1|H<1>,6|C<3>} 105.8000 0.000 1 105.8000 0.000 1 106.8175 2.071 2 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2) C[6a](P[5]C[5,6a]2)(C[6a]C[6a]H)2 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){4|H<1>,6|C<3>} C[6a](P[5]C[5,6a]2)(C[6a]C[6a]H)2{2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>} 102.6315 1.193 2 102.6315 1.423 2 103.1345 0.911 4 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2) C[6a](P[5]C[5,6a]2)(C[6a]C[6a]H)2 C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]N[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){2|N<2>,4|C<3>,4|H<1>} C[6a](P[5]C[5,6a]2)(C[6a]C[6a]H)2{2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]N[6a]H){1|H<1>,5|C<3>} 103.6375 0.547 2 103.6375 0.299 2 103.1345 0.911 4 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]C)2 C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|H<1>,2|C<4>,7|C<3>} C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]C)2{2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H){2|H<1>,5|C<3>} 121.3970 0.000 1 121.3970 0.000 1 112.9635 142.248 2 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]H)2 C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|Br<1>,3|H<1>,6|C<3>} C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H){1|Br<1>,2|H<1>,4|C<3>} 104.5300 0.000 1 104.5300 0.000 1 112.9635 142.248 2 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:N[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](P[5]C[5,6a]N[5])(C[6a]C[6a]H)2 C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]N[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){5|H<1>,6|C<3>} C[6a](P[5]C[5,6a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]N[5])(C[6a]C[6a]H){4|C<3>,4|H<1>} 100.4390 0.000 1 100.4390 0.000 1 100.4390 0.000 1 105.7620 34.380 10 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:4:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-4:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2) C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]P[5])(C[6a]C[6a]H) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(P[5]C[6a]C[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a,6a]C[6a])(C[5]C[5,6a]HH)(C[6a]C[6a]2){1|P<3>,2|H<1>,5|C<3>} C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]P[5])(C[6a]C[6a]H){1|C<4>,4|H<1>,5|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(P[5]C[6a]C[5])(C[6a]C[6a]H){3|H<1>,5|C<3>} 101.4091 1.644 4 101.4091 2.702 4 101.4091 2.702 4 102.2154 5.278 5 104.5798 26.604 15 105.3560 29.671 18 246 643 727 0:SP3_SP2_SP2 P[5] C[6a] C[5,6a] 3:4:3: 3:3:3: 3:3:3: C[5,6a]-3:P[5]-4:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2) C[6a](P[5]C[5,6a]P[5])(C[6a]C[6a]H)2 C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(P[5]C[6a]P[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2){3|H<1>,5|C<3>} C[6a](P[5]C[5,6a]P[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,4|C<3>} C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(P[5]C[6a]P[5])(C[6a]C[6a]H){1|H<1>,2|C<4>,5|C<3>} 105.4410 0.000 1 105.4410 0.000 1 105.4410 0.000 1 102.2154 5.278 5 104.5798 26.604 15 105.3560 29.671 18 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5,5] 3:3:3: 3:3:3: 3:3:3: C[5,5]-3:C[5,6a]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:C[5,5]-3:P[5]-3: P[5](C[5,5]C[5,6a]C[5,5])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2) C[6a](P[5]C[5,6a]C[5,5])(C[6a]C[6a]H)2 C[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5,6a]S[5])(P[5]C[5,6a]C[6a]) P[5](C[5,5]C[5,6a]C[5,5])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|S<4>,3|H<1>,6|C<3>} C[6a](P[5]C[5,6a]C[5,5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>} C[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5,6a]S[5])(P[5]C[5,6a]C[6a]){1|H<1>,2|O<1>,6|C<3>} 103.7760 0.000 1 103.7760 0.000 1 103.7760 0.000 1 103.7760 0.000 1 105.5120 2.287 3 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5,5] 3:3:3: 3:3:3: 4:3:3: C[5,5]-3:C[5,5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5,5]-4:P[5]-3:C[5]-3: P[5](C[5,5]C[5,5]C[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5,5]2) C[5,5](C[5,5]C[5,5]C[5]C)(P[5]C[5,5]C[6a])(C[5]C[5]C) P[5](C[5,5]C[5,5]C[5])2(C[6a]C[6a]2){2|H<1>,4|C<4>,6|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5,5]2){2|C<4>,2|H<1>,3|C<3>} C[5,5](C[5,5]C[5,5]C[5]C)(P[5]C[5,5]C[6a])(C[5]C[5]C){3|C<4>,4|C<3>} 106.3800 0.229 2 106.3800 0.052 2 106.3800 0.052 2 106.3800 0.052 2 105.5120 2.287 3 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:2: 3:3:3: 3:3:1: C[6a]-3:C[5]-3:P[5]-2: P[5]-3:C[6a]-3:C[6a]-3: P[5]-3:C[5]-3:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]) C[6a](P[5]C[5]P[5])(C[6a]C[6a]C)2 C[5](P[5]C[6a]P[5])(C[5]C[5]H)(H) P[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]){2|C<3>,2|C<4>,2|H<1>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]C)2{3|C<3>,3|H<1>} C[5](P[5]C[6a]P[5])(C[5]C[5]H)(H){1|H<1>,2|C<3>} 120.3330 0.000 1 120.3330 0.000 1 120.3330 0.000 1 120.3330 0.000 1 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:1: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:O-1: P[5](C[5]C[5,6a]O)2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]C[5])(O) P[5](C[5]C[5,6a]O)2(C[6a]C[6a]2){2|H<1>,4|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|H<1>,2|O<1>,3|C<3>} C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]C[5])(O){1|H<1>,1|O<1>,4|C<3>} 101.5762 2.323 2 101.5762 5.397 2 101.5762 5.397 2 103.4738 5.822 7 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:1: C[5]-3:C[6a]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5]-3:P[5]-3:H-1: P[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5]C[6a]C[5])(P[5]C[6a]C[5])(H) P[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){3|H<1>,4|C<3>} C[5](C[5]C[6a]C[5])(P[5]C[6a]C[5])(H){1|H<1>,5|C<3>} 105.9130 0.000 1 105.9130 0.000 1 105.9130 0.000 1 103.4738 5.822 7 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:1: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[5]-3:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H){2|C<3>,2|C<4>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){3|H<1>,4|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,3|C<3>} 103.1105 3.130 2 103.1105 9.799 2 103.8127 5.308 4 103.4738 5.822 7 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:1: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[5]-3:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]H)2 C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H) P[5](C[6a]C[6a]2)(C[5]C[5]H)2{2|C<3>,2|C<4>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){3|C<3>,4|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,1|H<1>,2|C<3>} 104.5150 2.038 2 104.5150 4.153 2 103.8127 5.308 4 103.4738 5.822 7 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]C)2 C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]2) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|H<1>,2|C<4>,7|C<3>} C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]C)2{2|H<1>,5|C<3>} C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>} 110.3750 0.000 1 110.3750 0.000 1 110.3750 0.000 1 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5]-3:C[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]H)2 C[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]Br)(C[6a]C[6a]2) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|Br<1>,3|H<1>,6|C<3>} C[6a](P[5]C[5,6a]C[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>} C[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]Br)(C[6a]C[6a]2){1|Br<1>,1|H<1>,6|C<3>} 101.0140 0.000 1 101.0140 0.000 1 101.0140 0.000 1 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5,5]-3:P[5]-3:C-3: P[5](C[5]C[5,5]C)2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5]H) P[5](C[5]C[5,5]C)2(C[6a]C[6a]2){2|C<3>,2|C<4>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|H<1>,5|C<3>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5]H){2|C<4>,2|H<1>,3|C<3>} 101.2915 0.999 2 101.2915 0.998 2 101.7215 0.579 4 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5,5]-3:P[5]-3:C-3: P[5](C[5]C[5,5]C)2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(COO) P[5](C[5]C[5,5]C)2(C[6a]C[6a]2){2|C<3>,2|C<4>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|H<1>,5|C<3>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(COO){2|C<4>,2|H<1>,3|C<3>} 102.1515 0.019 2 102.1515 0.000 2 101.7215 0.579 4 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5,6]-3:C[6a]-3:P[5]-3: P[5](C[5]C[5,6]C[6a])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(P[5]C[6a]C[5]) P[5](C[5]C[5,6]C[6a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,2|N<2>,4|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|H<1>,5|C<3>} C[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(P[5]C[6a]C[5]){2|C<4>,3|H<1>,5|C<3>} 103.5530 2.569 4 103.5530 6.600 4 103.5530 6.600 4 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5]-3:P[5]-3:C[6a]-3: P[5](C[5]C[6,6]P[5])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) P[5](C[5]C[6,6]P[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){2|C<4>,2|H<1>,6|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){1|P<3>,2|H<1>,4|C<3>} C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} 102.2272 3.378 2 102.2272 11.413 2 100.2337 5.707 6 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5]-3:P[5]-3:C[6a]-3: P[5](C[5]C[6a]C[5])(C[5]C[6]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) P[5](C[5]C[6a]C[5])(C[5]C[6]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){1|P<3>,2|H<1>,4|C<3>} C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} 99.2370 1.317 4 99.2370 1.733 4 100.2337 5.707 6 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5a]-3:C[5,6]-3:P[5]-3: P[5](C[5]C[5,6]C[5a])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5a]C[5a,6]S[5a])(C[5,6]C[5,6]C[6])(P[5]C[6a]C[5]) P[5](C[5]C[5,6]C[5a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,2|S<2>,4|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|H<1>,5|C<3>} C[5](C[5a]C[5a,6]S[5a])(C[5,6]C[5,6]C[6])(P[5]C[6a]C[5]){1|O<2>,2|C<4>,2|H<1>,5|C<3>} 105.3415 2.200 2 105.3415 4.839 2 105.3415 4.839 2 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[6,6]-3:P[5]-3:P[5]-3: P[5](C[5]C[6,6]P[5])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[6,6]C[3x6]2)(P[5]C[6a]C[5])2 P[5](C[5]C[6,6]P[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){2|C<4>,2|H<1>,6|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){1|P<3>,2|H<1>,4|C<3>} C[5](C[6,6]C[3x6]2)(P[5]C[6a]C[5])2{2|H<1>,4|C<4>,6|C<3>} 104.8910 4.644 2 104.8910 21.569 2 104.8910 21.569 2 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](C[5]C[6a]C[5])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](C[5]C[6a]C[5])2(C[6a]C[6a]2){4|H<1>,6|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|H<1>,5|C<3>} C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} 105.0508 0.557 6 105.0508 0.310 6 105.0508 0.310 6 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:P[5]-3:C[6]-3: P[5](C[5]C[6a]C[5])(C[5]C[6]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])2(C[6]C[6,6a]2) P[5](C[5]C[6a]C[5])(C[5]C[6]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){1|P<3>,2|H<1>,4|C<3>} C[5](P[5]C[6a]C[5])2(C[6]C[6,6a]2){10|C<3>} 107.0000 0.254 4 107.0000 0.064 4 107.0000 0.064 4 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[6a]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){3|H<1>,4|C<3>} C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} 104.1630 0.000 1 104.1630 0.000 1 104.1630 0.000 1 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[5]-3:C-3: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(CHN) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H){2|C<3>,2|C<4>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){3|H<1>,4|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(CHN){1|C<4>,1|H<1>,2|C<3>} 102.4460 0.000 1 102.4460 0.000 1 102.8930 0.400 2 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[5]-3:C-3: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(COW) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H){2|C<3>,2|C<4>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){3|H<1>,4|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(COW){1|C<4>,1|H<1>,2|C<3>} 103.3400 0.000 1 103.3400 0.000 1 102.8930 0.400 2 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:3: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[6a]-3: P[5]-3:C[5]-3:C-3: P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C) C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 C[5](P[5]C[6a]P[5])(C[5]N[5]C)(CCN) P[5](P[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]C){1|C<4>,2|H<1>,5|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|N<3>,2|H<1>,4|C<3>} C[5](P[5]C[6a]P[5])(C[5]N[5]C)(CCN){4|C<3>} 102.0160 0.000 1 102.0160 0.000 1 102.0160 0.000 1 103.6654 8.645 34 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:4: C[5]-3:C[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: C[5,5]-3:P[5]-3:C-4: P[5](C[5]C[5,5]C)2(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5a]CC) P[5](C[5]C[5,5]C)2(C[6a]C[6a]2){2|C<3>,2|C<4>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){2|C<4>,2|H<1>,3|C<3>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5a]CC){2|C<3>,2|H<1>,3|C<4>} 105.4555 1.051 2 105.4555 1.106 2 105.4555 1.106 2 104.9640 1.017 4 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:4: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[5]-3:C-4: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C) C[6a](C[6a]C[6a]C)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C){1|Al<5>,2|C<4>,4|C<3>} C[6a](C[6a]C[6a]C)2(P[5]C[5]2){1|C<4>,1|P<5>,2|H<1>,3|C<3>} C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3){5|C<3>} 105.1720 0.000 1 105.1720 0.000 1 104.4725 0.979 2 104.9640 1.017 4 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 3:3:4: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[5]-3:C-4: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C){1|Al<5>,2|H<1>,4|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){1|C<4>,1|P<5>,2|H<1>,3|C<3>} C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3){5|C<3>} 103.7730 0.000 1 103.7730 0.000 1 104.4725 0.979 2 104.9640 1.017 4 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 5:3:3: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-5:P[5]-3:C-3: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C) C[6a](C[6a]C[6a]C)2(P[5]C[5]2) C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C){1|Al<5>,2|C<4>,4|C<3>} C[6a](C[6a]C[6a]C)2(P[5]C[5]2){1|C<4>,1|P<5>,2|H<1>,3|C<3>} C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH){1|C<4>,4|C<3>} 110.5560 0.000 1 110.5560 0.000 1 106.1045 39.632 2 106.1045 39.632 2 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:3:3: 3:3:3: 5:3:3: C[6a]-3:C[5]-3:C[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-5:P[5]-3:C-3: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C) C[6a](C[6a]C[6a]H)2(P[5]C[5]2) C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C){1|Al<5>,2|H<1>,4|C<3>} C[6a](C[6a]C[6a]H)2(P[5]C[5]2){1|C<4>,1|P<5>,2|H<1>,3|C<3>} C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH){1|C<4>,4|C<3>} 101.6530 0.000 1 101.6530 0.000 1 106.1045 39.632 2 106.1045 39.632 2 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 3:4:3: 3:3:3: 3:3:3: C[6a]-3:C[5]-4:C[5]-3: C[6,6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](C[6a]C[6,6a]C[6a])(C[5]C[6a]C[5]H)(C[5]C[6a]C[5]) C[6a](C[6,6a]C[6,6a]O[6])(C[6a]C[6a]H)(P[5]C[5]2) C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](C[6a]C[6,6a]C[6a])(C[5]C[6a]C[5]H)(C[5]C[6a]C[5]){1|O<2>,1|P<4>,3|H<1>,6|C<3>} C[6a](C[6,6a]C[6,6a]O[6])(C[6a]C[6a]H)(P[5]C[5]2){2|C<4>,2|H<1>,5|C<3>} C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){1|P<4>,4|H<1>,5|C<3>} 102.7890 0.000 1 102.7890 0.000 1 102.7890 0.000 1 102.7890 0.000 1 104.1682 13.392 51 104.2428 12.817 54 246 643 818 0:SP3_SP2_SP2 P[5] C[6a] C[5] 4:3:3: 3:3:3: 3:3:3: P[5]-4:C[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5]-3:P[5]-3:C[6a]-3: P[5](P[5]C[6a]P[5]Os)(C[5]C[6a]C[5])(C[6a]C[6a]2) C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2 C[5](C[5]C[6a]P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) P[5](P[5]C[6a]P[5]Os)(C[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]H)2{1|Os<4>,1|P<3>,2|H<1>,4|C<3>} C[5](C[5]C[6a]P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){1|Os<4>,2|H<1>,8|C<3>} 104.2245 4.635 2 104.2245 21.484 2 104.2245 21.484 2 104.2245 21.484 2 104.1682 13.392 51 104.2428 12.817 54 246 643 818 6:SP3_SP2_SP2 P[5,6] C[6,6a] C[5,6] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[6,6a]-3:C[5,6]-3: P[5,6]-3:C[6,6a]-3:C[6a]-3: P[5,6]-3:C[5]-3:C[6]-3: P[5,6](C[5,6a]C[5,6a]C[6a])(C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]) C[6,6a](P[5,6]C[5,6a]C[5,6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) C[5,6](P[5,6]C[5,6a]C[6,6a])(C[5]C[5,6a]H)(C[6]C[6]H) P[5,6](C[5,6a]C[5,6a]C[6a])(C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]){4|H<1>,5|C<3>} C[6,6a](P[5,6]C[5,6a]C[5,6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){3|H<1>,5|C<3>} C[5,6](P[5,6]C[5,6a]C[6,6a])(C[5]C[5,6a]H)(C[6]C[6]H){1|H<1>,4|C<3>} 99.9065 0.000 1 99.9065 0.000 1 99.9065 0.000 1 99.9065 0.000 1 99.9065 0.000 1 99.9065 0.000 1 246 643 885 0:SP3_SP-NON_SP2 P[5] C[6a] Ga[5,5] 4:3:3: 3:3:3: 3:3:3:3: Ga[5,5]-4:P[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: N[5]-3:N[5]-3:P[5]-3:P[5]-3: P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](P[5]Ga[5,5]P[5])(C[6a]C[6a]H)2 Ga[5,5](N[5]C[6a]C[5])2(P[5]C[6a]P[5])2 P[5](Ga[5,5]N[5]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} C[6a](P[5]Ga[5,5]P[5])(C[6a]C[6a]H)2{2|C<3>,2|H<1>,2|N<3>,2|P<3>} Ga[5,5](N[5]C[6a]C[5])2(P[5]C[6a]P[5])2{10|C<3>,2|H<1>} 108.0795 4.685 2 108.0795 21.945 2 108.0795 21.945 2 108.0795 21.945 2 108.0795 21.945 2 108.0795 21.945 2 246 643 891 0:SP3_SP2_SP3 P[5] C[6a] S[5] 4:3:2: 3:3:3: 4:3: P[5]-4:C[6a]-3:S[5]-2: P[5]-3:C[6a]-3:C[6a]-3: C[5,5]-4:P[5]-3: P[5](P[5]C[5,5]C[6a]S)(C[6a]C[6a]2)(S[5]C[5,5]) C[6a](P[5]P[5]S[5])(C[6a]C[6a]H)2 S[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]P[5]) P[5](P[5]C[5,5]C[6a]S)(C[6a]C[6a]2)(S[5]C[5,5]){1|C<4>,4|H<1>,5|C<3>} C[6a](P[5]P[5]S[5])(C[6a]C[6a]H)2{1|S<1>,2|C<3>,2|C<4>,2|H<1>} S[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]P[5]){1|C<4>,1|S<1>,2|H<1>,4|C<3>} 105.9550 0.000 1 105.9550 0.000 1 105.9550 0.000 1 105.9550 0.000 1 105.9550 0.000 1 105.9550 0.000 1 246 643 955 0:SP3_SP2_SP3 P[5] C[6a] P[5] 3:3:4: 3:3:3: 3:3:4:4: P[5]-3:C[6a]-3:P[5]-4: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(CH3)2 P[5](P[5]C[6a]P[5])(C[6a]C[6a]2)(P[5]P[5]CC){2|H<1>,6|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){2|C<3>,2|C<4>,2|H<1>,2|P<3>} P[5](P[5]C[6a]P[5])2(CH3)2{6|C<3>} 97.6545 1.164 2 97.6545 1.356 2 97.6545 1.356 2 97.6545 1.356 2 101.1550 16.733 12 101.1550 16.733 12 246 643 955 0:SP3_SP2_SP3 P[5] C[6a] P[5] 3:4:3: 3:3:3: 3:3:4:4: C[5,6a]-3:P[5]-4:C[6a]-3: P[5]-3:C[6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C-4:C-4: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2) C[6a](P[5]C[5,6a]P[5])(C[6a]C[6a]H)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(CCCH)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2){3|H<1>,5|C<3>} C[6a](P[5]C[5,6a]P[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,4|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(CCCH)2{1|H<1>,5|C<3>} 101.3150 0.000 1 101.3150 0.000 1 101.3150 0.000 1 101.3150 0.000 1 101.1550 16.733 12 101.1550 16.733 12 246 643 955 0:SP3_SP2_SP3 P[5] C[6a] P[5] 4:3:2: 3:3:3: 4:3:3:1: P[5]-4:C[6a]-3:S[5]-2: P[5]-3:C[6a]-3:C[6a]-3: C[5,5]-4:P[5]-3:C[6a]-3:S-1: P[5](P[5]C[5,5]C[6a]S)(C[6a]C[6a]2)(S[5]C[5,5]) C[6a](P[5]P[5]S[5])(C[6a]C[6a]H)2 P[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]S[5])(C[6a]C[6a]2)(S) P[5](P[5]C[5,5]C[6a]S)(C[6a]C[6a]2)(S[5]C[5,5]){1|C<4>,4|H<1>,5|C<3>} C[6a](P[5]P[5]S[5])(C[6a]C[6a]H)2{1|S<1>,2|C<3>,2|C<4>,2|H<1>} P[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]S[5])(C[6a]C[6a]2)(S){5|H<1>,6|C<3>} 101.2340 0.000 1 101.2340 0.000 1 101.2340 0.000 1 101.2340 0.000 1 101.1550 16.733 12 101.1550 16.733 12 246 643 955 0:SP3_SP2_SP3 P[5] C[6a] P[5] 4:3:3: 3:3:3: 3:3:3:3: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:P[5]-3:C[6a]-3:C[6a]-3: P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)2 P[5](P[5]C[6a]2P[5])(P[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|H<1>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){2|H<1>,2|P<3>,4|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)2{10|C<3>,4|H<1>} 100.1110 0.057 2 100.1110 0.003 2 100.1110 0.003 2 100.1110 0.003 2 101.1550 16.733 12 101.1550 16.733 12 246 643 955 0:SP3_SP2_SP3 P[5] C[6a] P[5] 4:3:3: 3:3:3: 3:3:3:4: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-3:P[5]-3:C[6a]-3:C-4: P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)(CC3) P[5](P[5]C[6a]P[5]C)(P[5]C[6a]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|C<4>,2|H<1>,2|P<3>,3|C<3>} P[5](P[5]C[6a]P[5])2(C[6a]C[6a]2)(CC3){2|H<1>,8|C<3>} 108.4870 5.552 2 108.4870 30.827 2 108.4870 30.827 2 108.4870 30.827 2 101.1550 16.733 12 101.1550 16.733 12 246 643 955 0:SP3_SP2_SP3 P[5] C[6a] P[5] 4:3:3: 3:3:3: 4:3:3:4: P[5]-4:P[5]-3:C[6a]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5]-4:P[5]-3:C[6a]-3:B-4: P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2) C[6a](C[6a]C[6a]H)2(P[5]P[5]2) P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2)(BH3) P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2){1|B<4>,2|H<1>,8|C<3>} C[6a](C[6a]C[6a]H)2(P[5]P[5]2){1|B<4>,1|P<3>,1|P<4>,2|H<1>,3|C<3>} P[5](P[5]C[6a]P[5]B)(P[5]C[6a]P[5])(C[6a]C[6a]2)(BH3){2|H<1>,8|C<3>} 99.7015 1.751 4 99.7015 3.066 4 99.7015 3.066 4 99.7015 3.066 4 101.1550 16.733 12 101.1550 16.733 12 246 643 976 0:SP3_SP2_SP3 P[5] C[6a] O[5] 3:2:2: 3:3:3: 3:4: C[6a]-3:O[5]-2:O[5]-2: C[5a,6a]-3:C[6a]-3:P[5]-3: P[5]-3:C[5]-4: P[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2 C[6a](C[5a,6a]C[5a,6a]N[5a])(C[6a]C[6a]H)(P[5]O[5]2) O[5](P[5]C[6a]O[5])(C[5]C[5]HH) P[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2{1|N<3>,2|C<3>,5|H<1>} C[6a](C[5a,6a]C[5a,6a]N[5a])(C[6a]C[6a]H)(P[5]O[5]2){1|H<1>,3|C<3>,3|C<4>} O[5](P[5]C[6a]O[5])(C[5]C[5]HH){2|C<3>,2|H<1>} 101.1012 0.606 4 101.1012 0.367 4 101.1012 0.367 4 101.1012 0.367 4 101.1012 0.367 4 101.1012 0.367 4 246 643 987 0:SP3_SP-NON_SP2 P[5] C[6a] P[5] 3:3:2: 3:3:3: 3:3: C[6a]-3:C[5]-3:P[5]-2: P[5]-3:C[6a]-3:C[6a]-3: P[5]-3:C[5]-3: P[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]) C[6a](P[5]C[5]P[5])(C[6a]C[6a]C)2 P[5](P[5]C[6a]C[5])(C[5]C[5]H) P[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]){2|C<3>,2|C<4>,2|H<1>} C[6a](P[5]C[5]P[5])(C[6a]C[6a]C)2{3|C<3>,3|H<1>} P[5](P[5]C[6a]C[5])(C[5]C[5]H){2|C<3>,2|H<1>} 130.1000 0.000 1 130.1000 0.000 1 130.1000 0.000 1 130.1000 0.000 1 130.1000 0.000 1 130.1000 0.000 1 246 727 727 5:SP3_SP2_SP2 P[5] C[5,5a] C[5,5a] 3:3:3: 3:3:3: 3:3:3: C[5,5a]-3:C[5,5a]-3:C[6a]-3: C[5,5a]-3:P[5]-3:C[5a]-3: C[5,5a]-3:P[5]-3:C[5a]-3: P[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2) C[5,5a](C[5,5a]C[5,5a]S[5a])(P[5]C[5,5a]C[6a])(C[5a]C[5a]H) C[5,5a](C[5,5a]C[5,5a]S[5a])(P[5]C[5,5a]C[6a])(C[5a]C[5a]H) P[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2){2|F<1>,2|H<1>,2|S<2>,4|C<3>} C[5,5a](C[5,5a]C[5,5a]S[5a])(P[5]C[5,5a]C[6a])(C[5a]C[5a]H){1|H<1>,1|S<2>,3|C<3>} C[5,5a](C[5,5a]C[5,5a]S[5a])(P[5]C[5,5a]C[6a])(C[5a]C[5a]H){1|H<1>,1|S<2>,3|C<3>} 90.2111 0.000 1 90.2111 0.000 1 90.2111 0.000 1 90.2111 0.000 1 90.2111 0.000 1 89.6265 0.125 12 246 727 727 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,6a] 3:3:1: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:I-1: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(I) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]I)(C[6a]C[6a]H) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]I)(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(I){2|H<1>,4|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]I)(C[6a]C[6a]H){2|H<1>,3|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]I)(C[6a]C[6a]H){2|H<1>,3|C<3>} 89.6985 0.000 1 89.6985 0.000 1 89.6985 0.000 1 89.6985 0.000 1 89.5734 0.100 11 89.6265 0.125 12 246 727 727 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]Cl) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){2|Cl<1>,1|H<1>,7|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]Cl){2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H){1|H<1>,6|C<3>} 89.2874 0.000 1 89.2874 0.000 1 89.1486 0.014 3 89.1486 0.014 3 89.5734 0.100 11 89.6265 0.125 12 246 727 727 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){4|H<1>,6|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>} 89.0754 0.000 1 89.0754 0.000 1 89.1486 0.014 3 89.1486 0.014 3 89.5734 0.100 11 89.6265 0.125 12 246 727 727 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,6a] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]N[6a]H) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]N[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){2|N<2>,4|C<3>,4|H<1>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]N[6a]H){1|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]N[6a]H){1|H<1>,5|C<3>} 89.0829 0.000 1 89.0829 0.000 1 89.1486 0.014 3 89.1486 0.014 3 89.5734 0.100 11 89.6265 0.125 12 246 727 727 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,6a] 3:3:4: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C-4: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(CH3) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]2) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]C) P[5](C[5,6a]C[5,6a]C[6a])2(CH3){1|C<4>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]2){2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]C){2|H<1>,3|C<3>} 89.9062 0.129 2 89.9062 0.017 2 89.7068 0.038 6 89.7375 0.038 7 89.5734 0.100 11 89.6265 0.125 12 246 727 727 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,6a] 3:3:4: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C-4: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(CHHP) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(CHHP){2|H<1>,4|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H){2|H<1>,3|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C)(C[6a]C[6a]H){2|H<1>,3|C<3>} 89.6070 0.132 4 89.6070 0.017 4 89.7068 0.038 6 89.7375 0.038 7 89.5734 0.100 11 89.6265 0.125 12 246 727 727 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,6a] 3:3:4: 3:3:3: 3:3:3: C[5,6a]-3:C[5,6a]-3:C[5]-4: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])2(C[5]C[5]2Fe) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[5])(C[6a]C[6a]H) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a]C[6a])2(C[5]C[5]2Fe){3|C<4>,3|H<1>,4|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[5])(C[6a]C[6a]H){1|Fe<10>,2|C<4>,2|H<1>,3|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]C[5])(C[6a]C[6a]H){1|Fe<10>,2|C<4>,2|H<1>,3|C<3>} 89.9222 0.000 1 89.9222 0.000 1 89.9222 0.000 1 89.7375 0.038 7 89.5734 0.100 11 89.6265 0.125 12 246 727 790 0:SP3_SP-NON_SP2 P[5] C[5,6a] Cl 3:3:1: 3:3:3: 3: C[5,6a]-3:N[5]-3:Cl-1: C[5,6a]-3:C[6a]-3:P[5]-3: P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]Cl) Cl(P[5]C[5,6a]N[5]) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl){3|H<1>,4|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]Cl){2|C<3>,4|H<1>} Cl(P[5]C[5,6a]N[5]) 96.7635 0.000 1 96.7635 0.000 1 96.7635 0.000 1 96.7635 0.000 1 94.5006 10.241 2 94.5006 10.241 2 246 727 790 0:SP3_SP-NON_SP2 P[5] C[5,6a] Cl 3:4:1: 3:3:3: 3: C[5,6a]-3:P[5]-4:Cl-1: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(Cl) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]Cl) Cl(P[5]C[5,6a]P[5]) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(Cl){1|H<1>,7|C<3>} C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]Cl){1|H<1>,5|C<3>} Cl(P[5]C[5,6a]P[5]) 92.2377 0.000 1 92.2377 0.000 1 92.2377 0.000 1 92.2377 0.000 1 94.5006 10.241 2 94.5006 10.241 2 246 727 818 5:SP3_SP2_SP2 P[5,6] C[5,6a] C[5,6] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[6,6a]-3:C[5,6]-3: P[5,6]-3:C[5,6a]-3:C[6a]-3: P[5,6]-3:C[5]-3:C[6]-3: P[5,6](C[5,6a]C[5,6a]C[6a])(C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]) C[5,6a](P[5,6]C[6,6a]C[5,6])(C[5,6a]C[6a]C[5])(C[6a]C[6a]H) C[5,6](P[5,6]C[5,6a]C[6,6a])(C[5]C[5,6a]H)(C[6]C[6]H) P[5,6](C[5,6a]C[5,6a]C[6a])(C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]){4|H<1>,5|C<3>} C[5,6a](P[5,6]C[6,6a]C[5,6])(C[5,6a]C[6a]C[5])(C[6a]C[6a]H){3|H<1>,4|C<3>} C[5,6](P[5,6]C[5,6a]C[6,6a])(C[5]C[5,6a]H)(C[6]C[6]H){1|H<1>,4|C<3>} 90.8212 0.000 1 90.8212 0.000 1 90.8212 0.000 1 90.8212 0.000 1 90.8212 0.000 1 90.5056 1.742 5 246 727 818 5:SP3_SP2_SP2 P[5] C[5,6a] C[5,5] 3:3:3: 3:3:3: 3:3:3: C[5,5]-3:C[5,6a]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:C[5,5]-3:P[5]-3: P[5](C[5,5]C[5,6a]C[5,5])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2) C[5,6a](C[5,6a]C[5,5]C[6a])(P[5]C[5,5]C[6a])(C[6a]C[6a]H) C[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5,6a]S[5])(P[5]C[5,6a]C[6a]) P[5](C[5,5]C[5,6a]C[5,5])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|S<4>,3|H<1>,6|C<3>} C[5,6a](C[5,6a]C[5,5]C[6a])(P[5]C[5,5]C[6a])(C[6a]C[6a]H){1|S<4>,2|H<1>,4|C<3>} C[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5,6a]S[5])(P[5]C[5,6a]C[6a]){1|H<1>,2|O<1>,6|C<3>} 88.8451 0.000 1 88.8451 0.000 1 88.8451 0.000 1 88.8451 0.000 1 88.8451 0.000 1 90.5056 1.742 5 246 727 818 5:SP3_SP2_SP2 P[5] C[5,6a] C[5] 3:3:1: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-3:H-1: C[5,6a]-3:C[6a]-3:P[5]-3: C[5]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(H) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]C[5]H) C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]H)(C[6a]C[6a]2) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(H){1|H<1>,5|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]C[5]H){2|H<1>,3|C<3>} C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]H)(C[6a]C[6a]2){2|H<1>,6|C<3>} 90.3581 0.000 1 90.3581 0.000 1 90.3581 0.000 1 90.3581 0.000 1 90.9540 1.754 3 90.5056 1.742 5 246 727 818 5:SP3_SP2_SP2 P[5] C[5,6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: C[5]-3:P[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H) C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]2) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|H<1>,2|C<4>,7|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H){2|H<1>,5|C<3>} C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>} 92.4717 0.000 1 92.4717 0.000 1 92.4717 0.000 1 91.2519 2.976 2 90.9540 1.754 3 90.5056 1.742 5 246 727 818 5:SP3_SP2_SP2 P[5] C[5,6a] C[5] 3:3:3: 3:3:3: 3:3:3: C[5,6a]-3:C[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C[6a]-3: P[5]-3:C[5]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H) C[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]Br)(C[6a]C[6a]2) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|Br<1>,3|H<1>,6|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(P[5]C[6a]C[5])(C[6a]C[6a]H){1|Br<1>,2|H<1>,4|C<3>} C[5](P[5]C[5,6a]C[6a])(C[5]C[5,6a]Br)(C[6a]C[6a]2){1|Br<1>,1|H<1>,6|C<3>} 90.0321 0.000 1 90.0321 0.000 1 90.0321 0.000 1 91.2519 2.976 2 90.9540 1.754 3 90.5056 1.742 5 246 727 893 0:SP3_SP2_SP2 P[5] C[5,6a] O 3:3:2: 3:3:3: 3:3: C[5,6a]-3:N[5]-3:O-2: C[5,6a]-3:C[6a]-3:P[5]-3: P[5]-3:C-3: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(OC) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(P[5]N[5]O) O(P[5]C[5,6a]N[5])(CHO) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(OC){2|H<1>,5|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(P[5]N[5]O){2|C<3>,4|H<1>} O(P[5]C[5,6a]N[5])(CHO) 95.3056 0.000 1 95.3056 0.000 1 95.3056 0.000 1 95.3056 0.000 1 95.3056 0.000 1 95.3056 0.000 1 246 727 944 0:SP3_SP-NON_SP2 P[5] C[5,6a] I 3:3:1: 3:3:3: 3: C[5,6a]-3:C[5,6a]-3:I-1: C[5,6a]-3:P[5]-3:C[6a]-3: P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])2(I) C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]I)(C[6a]C[6a]H) I(P[5]C[5,6a]2) P[5](C[5,6a]C[5,6a]C[6a])2(I){2|H<1>,4|C<3>} C[5,6a](C[5,6a]C[5,6a]C[6a])(P[5]C[5,6a]I)(C[6a]C[6a]H){2|H<1>,3|C<3>} I(P[5]C[5,6a]2) 99.3469 0.903 2 99.3469 0.815 2 99.3469 0.815 2 99.3469 0.815 2 101.5089 14.431 3 101.5089 14.431 3 246 727 944 0:SP3_SP-NON_SP2 P[5] C[5,6a] I 3:4:1: 3:3:3: 3: C[5,6a]-3:P[5]-4:I-1: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(I) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]I) I(P[5]C[5,6a]P[5]) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(I){1|H<1>,3|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]I){1|H<1>,2|N<3>,3|C<3>} I(P[5]C[5,6a]P[5]) 105.8330 0.000 1 105.8330 0.000 1 105.8330 0.000 1 105.8330 0.000 1 101.5089 14.431 3 101.5089 14.431 3 246 727 951 0:SP3_SP-NON_SP2 P[5] C[5,6a] H 3:3:1: 3:3:3: 3: C[5,6a]-3:C[5]-3:H-1: C[5,6a]-3:C[6a]-3:P[5]-3: P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(H) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]C[5]H) H(P[5]C[5,6a]C[5]) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(H){1|H<1>,5|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]C[5]H){2|H<1>,3|C<3>} H(P[5]C[5,6a]C[5]) 99.5636 0.000 1 99.5636 0.000 1 99.5636 0.000 1 99.5636 0.000 1 99.5636 0.000 1 99.5636 0.000 1 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:3:4: 3:3:3: 3:3:2:1: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:O-2:Se-1: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(OC)(Se) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]SeO){1|Se<1>,1|H<1>,1|O<2>,6|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2){1|Se<1>,1|H<1>,1|O<2>,1|P<4>,4|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(OC)(Se){1|H<1>,1|P<4>,4|C<3>} 90.1572 0.000 1 90.1572 0.000 1 90.1572 0.000 1 90.1572 0.000 1 89.7592 0.838 9 89.7592 0.838 9 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:3:4: 3:3:3: 3:3:3:1: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:N-3:O-1: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)(O) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NO){1|H<1>,1|N<3>,1|O<1>,6|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2){1|H<1>,1|N<3>,1|O<1>,1|P<4>,4|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)(O){1|H<1>,1|P<4>,4|C<3>} 90.2549 0.000 1 90.2549 0.000 1 90.2549 0.000 1 90.2549 0.000 1 89.7592 0.838 9 89.7592 0.838 9 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:3:4: 3:3:3: 3:3:3:3: C[5,6a]-3:P[5]-3:P[5]-4: C[5,6a,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:N-3:N-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(P[5]C[5,6a]NN){1|H<1>,2|N<3>,6|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]2){1|H<1>,1|P<4>,2|N<3>,4|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]P[5])(NCC)2{1|H<1>,1|P<4>,4|C<3>} 88.7086 0.000 1 88.7086 0.000 1 88.7086 0.000 1 88.7086 0.000 1 89.7592 0.838 9 89.7592 0.838 9 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:4:1: 3:3:3: 3:3:3:3: C[5,6a]-3:P[5]-4:Cl-1: C[5,6a,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(Cl) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]Cl) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]Cl)(C[6a]C[6a]2)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(Cl){1|H<1>,7|C<3>} C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]Cl){1|H<1>,5|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]Cl)(C[6a]C[6a]2)2{5|H<1>,7|C<3>} 89.2129 0.000 1 89.2129 0.000 1 89.2129 0.000 1 89.3978 0.068 2 89.7592 0.838 9 89.7592 0.838 9 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:4:1: 3:3:3: 3:3:3:3: C[5,6a]-3:P[5]-4:I-1: C[5,6a,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:N-3:N-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(I) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]I) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]I)(NCC)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(I){1|H<1>,3|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]I){1|H<1>,2|N<3>,3|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]I)(NCC)2{1|H<1>,3|C<3>} 89.5827 0.000 1 89.5827 0.000 1 89.5827 0.000 1 89.3978 0.068 2 89.7592 0.838 9 89.7592 0.838 9 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:4:3: 3:3:3: 3:3:3:3: C[5,6a]-3:P[5]-4:N-3: C[5,6a,6a]-3:C[6a]-3:P[5]-3: C[5,6a]-3:P[5]-3:N-3:N-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(NCC) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]N) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]N)(NCC)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(NCC){1|H<1>,3|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]N){1|H<1>,2|N<3>,3|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]N)(NCC)2{1|H<1>,3|C<3>} 88.1685 0.000 1 88.1685 0.000 1 88.1685 0.000 1 88.1685 0.000 1 89.7592 0.838 9 89.7592 0.838 9 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:4:3: 3:3:3: 3:3:4:4: C[5,6a]-3:P[5]-4:C[6a]-3: C[5,6a,6a]-3:P[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:C-4:C-4: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2) C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(P[5]C[6a]P[5])(C[6a]C[6a]H) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(CCCH)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2){3|H<1>,5|C<3>} C[5,6a](C[5,6a,6a]C[5,6a,6a]C[5,6a])(P[5]C[6a]P[5])(C[6a]C[6a]H){1|H<1>,2|C<4>,5|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a])(CCCH)2{1|H<1>,5|C<3>} 90.1573 0.000 1 90.1573 0.000 1 90.1573 0.000 1 90.1573 0.000 1 89.7592 0.838 9 89.7592 0.838 9 246 727 955 5:SP3_SP2_SP3 P[5] C[5,6a] P[5] 3:4:4: 3:3:3: 3:3:3:3: C[5,6a]-3:P[5]-4:C-4: C[5,6a]-3:C[6a]-3:P[5]-3: P[5]-3:P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]2P[5])(CC3) C[5,6a](C[5,6a]C[6a]P[5])(C[6a]C[6a]H)(P[5]P[5]C) P[5](P[5]C[5,6a]C)2(C[6a]C[6a]2)2 P[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]2P[5])(CC3){1|C<4>,1|H<1>,6|C<3>} C[5,6a](C[5,6a]C[6a]P[5])(C[6a]C[6a]H)(P[5]P[5]C){1|C<4>,2|H<1>,3|C<3>} P[5](P[5]C[5,6a]C)2(C[6a]C[6a]2)2{4|H<1>,6|C<3>} 90.7952 0.181 2 90.7952 0.033 2 90.7952 0.033 2 90.7952 0.033 2 89.7592 0.838 9 89.7592 0.838 9 246 727 956 0:SP3_SP2_SP2 P[5] C[5,6a] N 3:4:3: 3:3:3: 3:4:4: C[5,6a]-3:P[5]-4:N-3: C[5,6a,6a]-3:C[6a]-3:P[5]-3: P[5]-3:C-4:C-4: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(NCC) C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]N) N(P[5]C[5,6a]P[5])(CH3)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(NCC){1|H<1>,3|C<3>} C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(P[5]P[5]N){1|H<1>,2|N<3>,3|C<3>} N(P[5]C[5,6a]P[5])(CH3)2 103.6960 0.000 1 103.6960 0.000 1 103.6960 0.000 1 103.6960 0.000 1 103.6960 0.000 1 103.6960 0.000 1 246 727 983 0:SP3_SP1_SP2 P[5] C[5,6a] C 3:3:2: 3:3:3: 3:2: C[5,6a]-3:N[5]-3:C-2: C[5,6a]-3:C[6a]-3:P[5]-3: P[5]-3:C-2: P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC) C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]C) C(P[5]C[5,6a]N[5])(CC[6a]) P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC){3|H<1>,4|C<3>} C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(P[5]N[5]C){2|C<3>,4|H<1>} C(P[5]C[5,6a]N[5])(CC[6a]) 99.8921 0.000 1 99.8921 0.000 1 99.8921 0.000 1 99.8921 0.000 1 99.8921 0.000 1 99.8921 0.000 1 246 762 852 0:SP3_SP2_SP3 P[5,6,6] C[6] P[3,5,6] 4:3:3: 3:3:4: 4:3:3: C[5,3x6]-4:P[3,5,6]-3:C[6]-3: P[5,6,6]-3:C[6]-3:Si-4: C[3,6,6]-4:P[3,5,6]-3:P[5,6,6]-3: P[5,6,6](C[5,3x6]C[6,6,6a]C[5,6]C[6])(P[3,5,6]C[3,6,6]P[3,5,6])(C[6]C[6]Si) C[6](P[5,6,6]C[5,3x6]P[3,5,6])(C[6]C[6]H)(SiC3) P[3,5,6](C[3,6,6]C[6,6,6a]P[3,5,6]Si)(P[3,5,6]C[3,6,6]C[5,6])(P[5,6,6]C[5,3x6]C[6]) P[5,6,6](C[5,3x6]C[6,6,6a]C[5,6]C[6])(P[3,5,6]C[3,6,6]P[3,5,6])(C[6]C[6]Si){2|Si<4>,3|C<3>,3|H<1>} C[6](P[5,6,6]C[5,3x6]P[3,5,6])(C[6]C[6]H)(SiC3){1|H<1>,1|P<3>,2|C<3>,2|C<4>} P[3,5,6](C[3,6,6]C[6,6,6a]P[3,5,6]Si)(P[3,5,6]C[3,6,6]C[5,6])(P[5,6,6]C[5,3x6]C[6]){2|Si<4>,1|H<1>,4|C<3>} 103.6750 0.000 1 103.6750 0.000 1 103.6750 0.000 1 103.6750 0.000 1 103.6750 0.000 1 103.6750 0.000 1 246 790 818 0:SP3_SP-NON_SP2 P[5] Cl C[5,5] 3:3:1: 3: 4:3:3: C[5,5]-3:N[5]-3:Cl-1: P[5]-3: C[5,5]-4:P[5]-3:C[5]-3: P[5](C[5,5]C[5,5]C[5])(N[5]Si[5]C)(Cl) Cl(P[5]C[5,5]N[5]) C[5,5](C[5,5]Si[5]C[5]C)(P[5]N[5]Cl)(C[5]C[5]C) P[5](C[5,5]C[5,5]C[5])(N[5]Si[5]C)(Cl){2|C<3>,4|C<4>} Cl(P[5]C[5,5]N[5]) C[5,5](C[5,5]Si[5]C[5]C)(P[5]N[5]Cl)(C[5]C[5]C){5|C<4>} 100.7200 0.000 2 100.7200 0.000 2 100.7200 0.000 2 100.7200 0.000 2 100.7200 0.000 2 100.7200 0.000 2 246 790 891 0:SP3_SP-NON_SP2 P[5] Cl S[5] 2:2:1: 3: 3:3: S[5]-2:S[5]-2:Cl-1: P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(Cl) Cl(P[5]S[5]2) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Cl) P[5](S[5]C[5,6a])2(Cl){2|C<3>} Cl(P[5]S[5]2) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Cl){1|H<1>,2|C<3>} 101.7643 0.417 4 101.7643 0.174 4 101.7643 0.174 4 101.7643 0.174 4 101.7643 0.174 4 101.7643 0.174 4 246 790 955 0:SP3_SP-NON_SP3 P[5] Cl P[5] 3:4:1: 3: 3:3:3:3: C[5,6a]-3:P[5]-4:Cl-1: P[5]-3: C[5,6a]-3:P[5]-3:C[6a]-3:C[6a]-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(Cl) Cl(P[5]C[5,6a]P[5]) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]Cl)(C[6a]C[6a]2)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(Cl){1|H<1>,7|C<3>} Cl(P[5]C[5,6a]P[5]) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]Cl)(C[6a]C[6a]2)2{5|H<1>,7|C<3>} 93.4531 0.000 1 93.4531 0.000 1 93.4531 0.000 1 93.4531 0.000 1 93.4531 0.000 1 93.4531 0.000 1 246 790 976 0:SP3_SP-NON_SP3 P[5] Cl O[5] 2:2:1: 3: 4:3: O[5]-2:O[5]-2:Cl-1: P[5]-3: C[5]-4:P[5]-3: P[5](O[5]C[5])2(Cl) Cl(P[5]O[5]2) O[5](C[5]C[6a]2C[5])(P[5]O[5]Cl) P[5](O[5]C[5])2(Cl){4|C<3>} Cl(P[5]O[5]2) O[5](C[5]C[6a]2C[5])(P[5]O[5]Cl){6|C<3>} 102.9020 2.213 2 102.9020 4.898 2 102.9020 4.898 2 102.9020 4.898 2 102.9020 4.898 2 102.9020 4.898 2 246 818 818 0:SP3_SP2_SP2 P[5,5] C[5] C[5] 3:3:3: 3:3:1: 3:3:1: P[5,5]-3:C[5]-3:C[5]-3: P[5,5]-3:C[5]-3:H-1: P[5,5]-3:C[5]-3:H-1: P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2 C[5](P[5,5]P[5,5]C[5])(C[5]N[5]C)(H) C[5](P[5,5]P[5,5]C[5])(C[5]N[5]C)(H) P[5,5](P[5,5]N[5]2)(C[5]C[5]H)2{2|C<3>,2|C<4>} C[5](P[5,5]P[5,5]C[5])(C[5]N[5]C)(H){1|H<1>,1|N<3>,2|C<3>} C[5](P[5,5]P[5,5]C[5])(C[5]N[5]C)(H){1|H<1>,1|N<3>,2|C<3>} 104.7530 0.000 1 104.7530 0.000 1 104.7530 0.000 1 104.7530 0.000 1 104.7530 0.000 1 104.7530 0.000 1 246 818 818 5:SP3_SP2_SP2 P[5,6] C[5,6] C[5] 3:3:3: 3:4:3: 3:3:3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[6]-4:C[5]-3: P[5,6]-3:C[6a]-3:C[5]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) C[5,6](P[5,6]P[5,6]C[5])(C[6]C[6a]C[6]H)(C[5]C[5]C) C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){1|H<1>,3|C<4>,6|C<3>} C[5,6](P[5,6]P[5,6]C[5])(C[6]C[6a]C[6]H)(C[5]C[5]C){1|C<4>,1|H<1>,6|C<3>} C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C){2|C<4>,2|H<1>,4|C<3>} 91.0561 0.129 2 91.0561 0.017 2 91.0561 0.017 2 91.0561 0.017 2 91.0561 0.017 2 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5,6] C[5] C[5,6] 3:3:3: 3:3:3: 4:3:3: P[5,6]-3:C[5,6]-3:C[5]-3: P[5,6]-3:C[6a]-3:C[5]-3: C[6]-4:P[5,6]-3:C[5]-3: P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]) C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C) C[5,6](C[6]C[5,6]C[6a]H)(P[5,6]P[5,6]C[5])(C[5]C[5]C) P[5,6](P[5,6]C[5,6]C[5])(C[5,6]C[5]C[6])(C[5]C[6a]C[5]){3|C<4>,3|H<1>,5|C<3>} C[5](P[5,6]C[5,6]P[5,6])(C[6a]C[6a]2)(C[5]C[5]C){2|H<1>,3|C<3>,3|C<4>} C[5,6](C[6]C[5,6]C[6a]H)(P[5,6]P[5,6]C[5])(C[5]C[5]C){3|C<4>,5|C<3>} 91.0937 0.000 1 91.0937 0.000 1 91.0937 0.000 1 91.0937 0.000 1 91.0937 0.000 1 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5,5] C[5,5] 3:3:3: 4:3:3: 4:3:3: C[5,5]-3:C[5,5]-3:C[6a]-3: C[5,5]-4:P[5]-3:C[5]-3: C[5,5]-4:P[5]-3:C[5]-3: P[5](C[5,5]C[5,5]C[5])2(C[6a]C[6a]2) C[5,5](C[5,5]C[5,5]C[5]C)(P[5]C[5,5]C[6a])(C[5]C[5]C) C[5,5](C[5,5]C[5,5]C[5]C)(P[5]C[5,5]C[6a])(C[5]C[5]C) P[5](C[5,5]C[5,5]C[5])2(C[6a]C[6a]2){2|H<1>,4|C<4>,6|C<3>} C[5,5](C[5,5]C[5,5]C[5]C)(P[5]C[5,5]C[6a])(C[5]C[5]C){3|C<4>,4|C<3>} C[5,5](C[5,5]C[5,5]C[5]C)(P[5]C[5,5]C[6a])(C[5]C[5]C){3|C<4>,4|C<3>} 87.8278 0.000 1 87.8278 0.000 1 87.8278 0.000 1 87.8278 0.000 1 87.8278 0.000 1 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:2: 3:3:3: 3:3:3: C[5]-3:C[5]-3:O-2: C[5]-3:C[5]-3:P[5]-3: C[6a]-3:C[5]-3:P[5]-3: P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC) C[5](C[5]C[5]P[5])(C[5]C[5]C)(P[5]C[5]O) C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]O) P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC){1|P<3>,2|C<4>,3|C<3>} C[5](C[5]C[5]P[5])(C[5]C[5]C)(P[5]C[5]O){1|O<2>,2|C<4>,3|C<3>} C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} 90.7309 0.131 4 90.7309 0.017 4 90.7309 0.017 4 90.7309 0.017 4 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:1: 3:3:1: C[5]-3:C[5]-3:C[6a]-3: C[5,6a]-3:P[5]-3:O-1: C[5,6a]-3:P[5]-3:O-1: P[5](C[5]C[5,6a]O)2(C[6a]C[6a]2) C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]C[5])(O) C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]C[5])(O) P[5](C[5]C[5,6a]O)2(C[6a]C[6a]2){2|H<1>,4|C<3>} C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]C[5])(O){1|H<1>,1|O<1>,4|C<3>} C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]C[5])(O){1|H<1>,1|O<1>,4|C<3>} 88.5498 0.000 1 88.5498 0.000 1 88.5498 0.000 1 89.2776 1.059 2 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:1: 3:3:1: C[6a]-3:C[5]-3:C[5]-3: P[5]-3:C[5]-3:H-1: P[5]-3:C[5]-3:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]H)2 C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H) P[5](C[6a]C[6a]2)(C[5]C[5]H)2{2|C<3>,2|C<4>,2|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,1|H<1>,2|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,1|H<1>,2|C<3>} 90.0054 0.000 1 90.0054 0.000 1 90.0054 0.000 1 89.2776 1.059 2 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:1: C[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: C[5]-3:P[5]-3:H-1: P[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) C[5](C[5]C[6a]C[5])(P[5]C[6a]C[5])(H) P[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} C[5](C[5]C[6a]C[5])(P[5]C[6a]C[5])(H){1|H<1>,5|C<3>} 90.7197 0.000 1 90.7197 0.000 1 90.7197 0.000 1 90.0742 0.389 3 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:1: C[6a]-3:C[5]-3:C[5]-3: P[5]-3:C[5]-3:C-3: P[5]-3:C[5]-3:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(CHN) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H){2|C<3>,2|C<4>,2|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(CHN){1|C<4>,1|H<1>,2|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,3|C<3>} 89.4753 0.000 1 89.4753 0.000 1 89.7515 0.153 2 90.0742 0.389 3 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:1: C[6a]-3:C[5]-3:C[5]-3: P[5]-3:C[5]-3:C-3: P[5]-3:C[5]-3:H-1: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(COW) C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]C[5]H){2|C<3>,2|C<4>,2|H<1>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(COW){1|C<4>,1|H<1>,2|C<3>} C[5](P[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,3|C<3>} 90.0276 0.000 1 90.0276 0.000 1 89.7515 0.153 2 90.0742 0.389 3 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[5,5]-3:P[5]-3:C-3: C[5,5]-3:P[5]-3:C-3: P[5](C[5]C[5,5]C)2(C[6a]C[6a]2) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5]H) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5]H) P[5](C[5]C[5,5]C)2(C[6a]C[6a]2){2|C<3>,2|C<4>,2|H<1>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5]H){2|C<4>,2|H<1>,3|C<3>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5]H){2|C<4>,2|H<1>,3|C<3>} 91.1320 0.000 1 91.1320 0.000 1 90.4995 0.800 2 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[5,5]-3:P[5]-3:C-3: C[5,5]-3:P[5]-3:C-3: P[5](C[5]C[5,5]C)2(C[6a]C[6a]2) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(COO) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(COO) P[5](C[5]C[5,5]C)2(C[6a]C[6a]2){2|C<3>,2|C<4>,2|H<1>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(COO){2|C<4>,2|H<1>,3|C<3>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(COO){2|C<4>,2|H<1>,3|C<3>} 89.8671 0.000 1 89.8671 0.000 1 90.4995 0.800 2 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[5,6]-3:C[6a]-3:P[5]-3: C[5,6]-3:C[6a]-3:P[5]-3: P[5](C[5]C[5,6]C[6a])2(C[6a]C[6a]2) C[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(P[5]C[6a]C[5]) C[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(P[5]C[6a]C[5]) P[5](C[5]C[5,6]C[6a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,2|N<2>,4|C<3>} C[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(P[5]C[6a]C[5]){2|C<4>,3|H<1>,5|C<3>} C[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(P[5]C[6a]C[5]){2|C<4>,3|H<1>,5|C<3>} 91.0541 0.608 2 91.0541 0.370 2 91.0541 0.370 2 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[5]-3:P[5]-3:C[6a]-3: C[6,6]-3:P[5]-3:P[5]-3: P[5](C[5]C[6,6]P[5])(C[5]C[6a]C[5])(C[6a]C[6a]2) C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) C[5](C[6,6]C[3x6]2)(P[5]C[6a]C[5])2 P[5](C[5]C[6,6]P[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){2|C<4>,2|H<1>,6|C<3>} C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[5](C[6,6]C[3x6]2)(P[5]C[6a]C[5])2{2|H<1>,4|C<4>,6|C<3>} 94.9942 0.128 2 94.9942 0.016 2 94.9942 0.016 2 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[5]-3:P[5]-3:C[6a]-3: P[5]-3:P[5]-3:C[6]-3: P[5](C[5]C[6a]C[5])(C[5]C[6]P[5])(C[6a]C[6a]2) C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2) C[5](P[5]C[6a]C[5])2(C[6]C[6,6a]2) P[5](C[5]C[6a]C[5])(C[5]C[6]P[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[5](C[5]C[6a]P[5])(P[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>} C[5](P[5]C[6a]C[5])2(C[6]C[6,6a]2){10|C<3>} 95.3707 0.230 4 95.3707 0.053 4 95.3707 0.053 4 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: C[5a]-3:C[5,6]-3:P[5]-3: C[5a]-3:C[5,6]-3:P[5]-3: P[5](C[5]C[5,6]C[5a])2(C[6a]C[6a]2) C[5](C[5a]C[5a,6]S[5a])(C[5,6]C[5,6]C[6])(P[5]C[6a]C[5]) C[5](C[5a]C[5a,6]S[5a])(C[5,6]C[5,6]C[6])(P[5]C[6a]C[5]) P[5](C[5]C[5,6]C[5a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,2|S<2>,4|C<3>} C[5](C[5a]C[5a,6]S[5a])(C[5,6]C[5,6]C[6])(P[5]C[6a]C[5]){1|O<2>,2|C<4>,2|H<1>,5|C<3>} C[5](C[5a]C[5a,6]S[5a])(C[5,6]C[5,6]C[6])(P[5]C[6a]C[5]){1|O<2>,2|C<4>,2|H<1>,5|C<3>} 90.6590 0.000 1 90.6590 0.000 1 90.6590 0.000 1 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:C[6a]-3: P[5]-3:C[6a]-3:C[5]-3: P[5]-3:C[6a]-3:C[5]-3: P[5](C[5]C[6a]C[5])2(C[6a]C[6a]2) C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H) P[5](C[5]C[6a]C[5])2(C[6a]C[6a]2){4|H<1>,6|C<3>} C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} C[5](P[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]H){3|H<1>,5|C<3>} 91.3796 0.028 3 91.3796 0.001 3 91.3796 0.001 3 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:N-3: C[6a]-3:C[5]-3:P[5]-3: C[6a]-3:C[5]-3:P[5]-3: P[5](C[5]C[6a]C[5])2(NC[6a]2) C[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]N) C[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]N) P[5](C[5]C[6a]C[5])2(NC[6a]2){2|H<1>,4|C<3>} C[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]N){3|C<3>,3|H<1>} C[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]N){3|C<3>,3|H<1>} 91.0717 0.000 1 91.0717 0.000 1 91.0717 0.000 1 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:P[5]-3: C[5,6]-3:C[5a]-3:P[5]-3: C[5,6]-3:C[5a]-3:P[5]-3: P[5](C[5]C[5,6]C[5a])2(P[5]C[5]2) C[5](C[5,6]C[5,6]C[6])(C[5a]C[5a]S[5a])(P[5]C[5]P[5]) C[5](C[5,6]C[5,6]C[6])(C[5a]C[5a]S[5a])(P[5]C[5]P[5]) P[5](C[5]C[5,6]C[5a])2(P[5]C[5]2){2|C<4>,2|S<2>,6|C<3>} C[5](C[5,6]C[5,6]C[6])(C[5a]C[5a]S[5a])(P[5]C[5]P[5]){2|C<4>,3|H<1>,5|C<3>} C[5](C[5,6]C[5,6]C[6])(C[5a]C[5a]S[5a])(P[5]C[5]P[5]){2|C<4>,3|H<1>,5|C<3>} 90.9282 0.129 4 90.9282 0.017 4 90.9282 0.017 4 92.3243 4.304 19 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:3: 3:3:4: C[5]-3:C[5]-3:C-3: C[5]-3:P[5]-3:C-3: C[5]-3:P[5]-3:Si-4: P[5](C[5]C[5]Si)(C[5]C[5]C)(CC[5]O) C[5](C[5]C[5]C)(P[5]C[5]C)(CC[5]O) C[5](C[5]C[5]C)(P[5]C[5]C)(SiC3) P[5](C[5]C[5]Si)(C[5]C[5]C)(CC[5]O){2|C<4>} C[5](C[5]C[5]C)(P[5]C[5]C)(CC[5]O){1|Si<4>,1|C<4>} C[5](C[5]C[5]C)(P[5]C[5]C)(SiC3){1|C<3>,1|C<4>} 91.7752 0.443 4 91.7752 0.196 4 91.7752 0.196 4 91.7752 0.196 4 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 3:3:4: 3:3:4: C[5]-3:C[5]-3:C[6a]-3: C[5,5]-3:P[5]-3:C-4: C[5,5]-3:P[5]-3:C-4: P[5](C[5]C[5,5]C)2(C[6a]C[6a]2) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5a]CC) C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5a]CC) P[5](C[5]C[5,5]C)2(C[6a]C[6a]2){2|C<3>,2|C<4>,2|H<1>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5a]CC){2|C<3>,2|H<1>,3|C<4>} C[5](C[5,5]C[5,5]C[5])(P[5]C[6a]C[5])(CC[5a]CC){2|C<3>,2|H<1>,3|C<4>} 92.6306 0.000 1 92.6306 0.000 1 92.6306 0.000 1 92.6306 0.000 1 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 5:3:3: 3:3:4: C[6a]-3:C[5]-3:C[5]-3: P[5]-5:P[5]-3:C-3: P[5]-3:C[5]-3:C-4: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C) C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH) C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C){1|Al<5>,2|C<4>,4|C<3>} C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH){1|C<4>,4|C<3>} C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3){5|C<3>} 96.3973 0.000 1 94.8527 4.772 2 94.8527 4.772 2 94.8527 4.772 2 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:3: 5:3:3: 3:3:4: C[6a]-3:C[5]-3:C[5]-3: P[5]-5:P[5]-3:C-3: P[5]-3:C[5]-3:C-4: P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C) C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH) C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3) P[5](C[6a]C[6a]2)(C[5]C[5]C)(C[5]P[5]C){1|Al<5>,2|H<1>,4|C<3>} C[5](P[5]C[6a]C[5]AlC)(P[5]C[6a]C[5])(CCH){1|C<4>,4|C<3>} C[5](P[5]C[6a]C[5])(C[5]P[5]Al)(CC3){5|C<3>} 93.3081 0.000 1 94.8527 4.772 2 94.8527 4.772 2 94.8527 4.772 2 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:3:4: 3:3:4: 3:3:4: C[5]-3:C[5]-3:C-4: C[5]-3:P[5]-3:C-4: C[5]-3:P[5]-3:C-4: P[5](C[5]C[5]C)2(CHHP) C[5](C[5]C[5]C)(P[5]C[5]C)(CH3) C[5](C[5]C[5]C)(P[5]C[5]C)(CH3) P[5](C[5]C[5]C)2(CHHP){2|C<4>} C[5](C[5]C[5]C)(P[5]C[5]C)(CH3){2|C<4>} C[5](C[5]C[5]C)(P[5]C[5]C)(CH3){2|C<4>} 91.9965 0.000 1 91.9965 0.000 1 91.9965 0.000 1 91.9965 0.000 1 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 3:4:3: 3:3:3: 3:3:4: C[5]-3:C-4:C[5]-3: C[6a]-3:C[5]-3:P[5]-3: C[5]-3:P[5]-3:C-4: P[5](C[5]C[6a]C[5])(CC[6a]C[5]H)(C[5]C[5]C) C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]C) C[5](C[5]C[5]C)(P[5]C[5]C)(CC[6a]CH) P[5](C[5]C[6a]C[5])(CC[6a]C[5]H)(C[5]C[5]C){2|C<3>,2|C<4>} C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]C){2|C<3>,2|C<4>,2|H<1>} C[5](C[5]C[5]C)(P[5]C[5]C)(CC[6a]CH){1|C<3>,1|C<4>} 91.8659 0.000 1 91.8659 0.000 1 91.8659 0.000 1 91.8659 0.000 1 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 4:3:3: 3:3:3: 3:3:3: C[5]-4:C[5]-3:C[5]-3: C[5]-3:P[5]-3:C-3: C[5]-3:P[5]-3:C-3: P[5](C[5]C[5]2C)(C[5]C[5]C)2 C[5](C[5]C[5]C)(P[5]C[5]2)(COO) C[5](C[5]C[5]C)(P[5]C[5]2)(COO) P[5](C[5]C[5]2C)(C[5]C[5]C)2{2|C<3>,4|C<4>} C[5](C[5]C[5]C)(P[5]C[5]2)(COO){2|C<4>,3|C<3>} C[5](C[5]C[5]C)(P[5]C[5]2)(COO){2|C<4>,3|C<3>} 89.8589 0.000 1 89.8589 0.000 1 89.8589 0.000 1 89.8589 0.000 1 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 4:3:3: 3:3:4: 3:3:4: B[6]-4:C[5]-3:C[5]-3: P[5]-3:C[5]-3:C-4: P[5]-3:C[5]-3:C-4: P[5](B[6]C[6]2Fe)(C[5]C[5]C)2 C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3) C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3) P[5](B[6]C[6]2Fe)(C[5]C[5]C)2{2|H<1>,4|C<4>} C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3){1|Fe<12>,4|C<4>} C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3){1|Fe<12>,4|C<4>} 91.6761 0.000 1 91.6761 0.000 1 91.5177 0.050 2 91.5177 0.050 2 91.8014 3.578 40 91.6611 3.630 44 246 818 818 5:SP3_SP2_SP2 P[5] C[5] C[5] 4:3:3: 3:3:4: 3:3:4: B[6]-4:C[5]-3:C[5]-3: P[5]-3:C[5]-3:C-4: P[5]-3:C[5]-3:C-4: P[5](B[6]C[6]2Li)(C[5]C[5]C)2 C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3) C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3) P[5](B[6]C[6]2Li)(C[5]C[5]C)2{2|H<1>,4|C<4>} C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3){1|Li<8>,4|C<4>} C[5](P[5]B[6]C[5])(C[5]C[5]C)(CH3){1|Li<8>,4|C<4>} 91.3592 0.000 1 91.3592 0.000 1 91.5177 0.050 2 91.5177 0.050 2 91.8014 3.578 40 91.6611 3.630 44 246 818 818 6:SP3_SP2_SP2 P[5,5,6] C[5,6] C[5,6] 3:3:3: 3:2:4: 3:2:4: Si[5,5]-3:C[5,6]-3:C[5,6]-3: P[5,5,6]-3:P[5,6]-2:C-4: P[5,5,6]-3:P[5,6]-2:C-4: P[5,5,6](Si[5,5]C[5,5,6]N)(C[5,6]P[5,6]C)2 C[5,6](P[5,5,6]Si[5,5]C[5,6])(P[5,6]C[5,5,6])(CC3) C[5,6](P[5,5,6]Si[5,5]C[5,6])(P[5,6]C[5,5,6])(CC3) P[5,5,6](Si[5,5]C[5,5,6]N)(C[5,6]P[5,6]C)2{1|C<4>} C[5,6](P[5,5,6]Si[5,5]C[5,6])(P[5,6]C[5,5,6])(CC3){1|N<3>,1|P<2>,2|C<4>} C[5,6](P[5,5,6]Si[5,5]C[5,6])(P[5,6]C[5,5,6])(CC3){1|N<3>,1|P<2>,2|C<4>} 98.3377 0.000 1 98.3377 0.000 1 98.3377 0.000 1 98.3377 0.000 1 97.2369 4.014 5 97.2369 4.014 5 246 818 818 6:SP3_SP2_SP2 P[5,5,6] C[5,6] C[5,6] 3:4:3: 3:3:3: 3:3:4: C[5,6]-3:C[5,5]-4:C[5,6]-3: P[5,5,6]-3:C[5,6]-3:C[6a]-3: P[5,5,6]-3:C[5,6]-3:C-4: P[5,5,6](C[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]C[5,6]C) C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C)(C[6a]C[6a]2) C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C[6a])(CCHO) P[5,5,6](C[5,6]C[5,6]C[6a])(C[5,5]C[5,5,6]HH)(C[5,6]C[5,6]C){2|C<4>,3|C<3>} C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C)(C[6a]C[6a]2){2|C<4>,3|C<3>,4|H<1>} C[5,6](P[5,5,6]C[5,5]C[5,6])(C[5,6]C[5,5,6]C[6a])(CCHO){1|C<4>,2|H<1>,4|C<3>} 95.1814 1.359 2 95.1814 1.848 2 95.1814 1.848 2 95.1814 1.848 2 97.2369 4.014 5 97.2369 4.014 5 246 818 818 6:SP3_SP2_SP2 P[5,5,6] C[5,6] C[5,6] 4:3:3: 3:2:4: 3:2:4: Si[3x5]-4:C[5,6]-3:C[5,6]-3: P[5,5,6]-3:P[5,6]-2:C-4: P[5,5,6]-3:P[5,6]-2:C-4: P[5,5,6](Si[3x5]C[5,5,6]N[5]2)(C[5,6]P[5,6]C)2 C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3) C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3) P[5,5,6](Si[3x5]C[5,5,6]N[5]2)(C[5,6]P[5,6]C)2{2|C<3>,3|C<4>} C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3){1|P<2>,2|C<4>,2|N<3>} C[5,6](P[5,5,6]Si[3x5]C[5,6])(P[5,6]C[5,5,6])(CC3){1|P<2>,2|C<4>,2|N<3>} 98.7421 0.118 2 98.7421 0.014 2 98.7421 0.014 2 98.7421 0.014 2 97.2369 4.014 5 97.2369 4.014 5 246 818 852 5:SP3_SP2_SP3 P[5] C[5] P[3,5] 3:3:4: 3:3:3: 4:4:3: P[3,5]-3:C[5]-3:C-4: C[5]-3:C[6a]-3:P[5]-3: C[3,5]-4:C[3]-4:P[5]-3: P[5](P[3,5]C[3,5]C[3])(C[5]C[6a]C[5])(CCCH) C[5](C[5]C[3,5]C[6a])(C[6a]C[6a]2)(P[5]P[3,5]C) P[3,5](C[3,5]C[6a]C[3]C[5])(C[3]C[3,5]C[6a]2)(P[5]C[5]C) P[5](P[3,5]C[3,5]C[3])(C[5]C[6a]C[5])(CCCH){6|C<3>} C[5](C[5]C[3,5]C[6a])(C[6a]C[6a]2)(P[5]P[3,5]C){1|C<4>,2|H<1>,5|C<3>} P[3,5](C[3,5]C[6a]C[3]C[5])(C[3]C[3,5]C[6a]2)(P[5]C[5]C){8|C<3>} 93.9346 0.000 1 93.9346 0.000 1 93.9346 0.000 1 93.9346 0.000 1 93.9346 0.000 1 93.9346 0.000 1 246 818 882 0:SP3_SP2_SP3 P[5,5,6,6] C[5] P[4,5,5,6,6] 3:3:3: 3:2:4: 4:4:3: P[4,5,5,6,6]-3:P[4,5,5,6,6]-3:C[5]-3: P[5,5,6,6]-3:P[5]-2:C-4: C[4,5,5,6,6]-4:C[4,3x5]-4:P[5,5,6,6]-3: P[5,5,6,6](P[4,5,5,6,6]C[4,5,5,6,6]C[4,3x5])(P[4,5,5,6,6]P[4,3x5,6]C[4,5,6])(C[5]P[5]C) C[5](P[5,5,6,6]P[4,5,5,6,6]2)(P[5]C[4,5,6])(CC3) P[4,5,5,6,6](C[4,5,5,6,6]P[4,5,5,6,6]Si[4,5]C)(C[4,3x5]P[4,3x5,6]Si[4,5]C)(P[5,5,6,6]P[4,5,5,6,6]C[5]) P[5,5,6,6](P[4,5,5,6,6]C[4,5,5,6,6]C[4,3x5])(P[4,5,5,6,6]P[4,3x5,6]C[4,5,6])(C[5]P[5]C){1|Si<4>,1|P<3>,3|C<4>} C[5](P[5,5,6,6]P[4,5,5,6,6]2)(P[5]C[4,5,6])(CC3){2|P<3>,3|C<4>} P[4,5,5,6,6](C[4,5,5,6,6]P[4,5,5,6,6]Si[4,5]C)(C[4,3x5]P[4,3x5,6]Si[4,5]C)(P[5,5,6,6]P[4,5,5,6,6]C[5]){1|P<2>,2|C<4>,2|I<1>} 101.6715 0.532 2 101.6715 0.284 2 101.6715 0.284 2 101.6715 0.284 2 101.6715 0.284 2 101.6715 0.284 2 246 818 882 5:SP3_SP2_SP3 P[5,5,6,6] C[5] P[4,5,5,6,6] 3:3:3: 3:2:4: 3:3:4: P[4,5,5,6,6]-3:P[4,5,5,6,6]-3:C[5]-3: P[5,5,6,6]-3:P[5]-2:C-4: P[4,3x5,6]-3:P[5,5,6,6]-3:C[4,5,6]-4: P[5,5,6,6](P[4,5,5,6,6]C[4,5,5,6,6]C[4,3x5])(P[4,5,5,6,6]P[4,3x5,6]C[4,5,6])(C[5]P[5]C) C[5](P[5,5,6,6]P[4,5,5,6,6]2)(P[5]C[4,5,6])(CC3) P[4,5,5,6,6](P[4,3x5,6]P[4,5,5,6,6]C[4,3x5])(P[5,5,6,6]P[4,5,5,6,6]C[5])(C[4,5,6]P[4,5,5,6,6]P[5]C) P[5,5,6,6](P[4,5,5,6,6]C[4,5,5,6,6]C[4,3x5])(P[4,5,5,6,6]P[4,3x5,6]C[4,5,6])(C[5]P[5]C){1|Si<4>,1|P<3>,3|C<4>} C[5](P[5,5,6,6]P[4,5,5,6,6]2)(P[5]C[4,5,6])(CC3){2|P<3>,3|C<4>} P[4,5,5,6,6](P[4,3x5,6]P[4,5,5,6,6]C[4,3x5])(P[5,5,6,6]P[4,5,5,6,6]C[5])(C[4,5,6]P[4,5,5,6,6]P[5]C){1|Si<4>,3|C<4>} 95.1315 0.380 2 95.1315 0.144 2 95.1315 0.144 2 95.1315 0.144 2 95.1315 0.144 2 95.1315 0.144 2 246 818 893 0:SP3_SP2_SP3 P[5] C[5] O 3:3:2: 3:3:3: 3:4: C[5]-3:C[5]-3:O-2: C[5]-3:C[5]-3:P[5]-3: P[5]-3:C-4: P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC) C[5](C[5]C[5]P[5])(C[5]C[5]C)(P[5]C[5]O) O(P[5]C[5]2)(CCCH) P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC){1|P<3>,2|C<4>,3|C<3>} C[5](C[5]C[5]P[5])(C[5]C[5]C)(P[5]C[5]O){1|O<2>,2|C<4>,3|C<3>} O(P[5]C[5]2)(CCCH) 106.1487 0.796 3 106.1487 0.634 3 105.8358 0.814 4 107.2998 3.052 8 107.7239 4.290 9 107.7239 4.290 9 246 818 893 0:SP3_SP2_SP3 P[5] C[5] O 3:3:2: 3:3:3: 3:4: C[5]-3:C[5]-3:O-2: C[5]-3:C[5]-3:P[5]-3: P[5]-3:C-4: P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC) C[5](C[5]C[5]P[5])(C[5]C[5]C)(P[5]C[5]O) O(P[5]C[5]2)(CCHH) P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC){1|P<3>,2|C<4>,3|C<3>} C[5](C[5]C[5]P[5])(C[5]C[5]C)(P[5]C[5]O){1|O<2>,2|C<4>,3|C<3>} O(P[5]C[5]2)(CCHH) 104.8970 0.000 1 104.8970 0.000 1 105.8358 0.814 4 107.2998 3.052 8 107.7239 4.290 9 107.7239 4.290 9 246 818 893 0:SP3_SP2_SP3 P[5] C[5] O 3:3:2: 3:3:3: 3:4: C[5]-3:C[5]-3:O-2: C[6a]-3:C[5]-3:P[5]-3: P[5]-3:C-4: P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC) C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]O) O(P[5]C[5]2)(CCCH) P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC){1|P<3>,2|C<4>,3|C<3>} C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} O(P[5]C[5]2)(CCCH) 109.1280 0.303 3 109.1280 0.092 3 108.7638 0.592 4 107.2998 3.052 8 107.7239 4.290 9 107.7239 4.290 9 246 818 893 0:SP3_SP2_SP3 P[5] C[5] O 3:3:2: 3:3:3: 3:4: C[5]-3:C[5]-3:O-2: C[6a]-3:C[5]-3:P[5]-3: P[5]-3:C-4: P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC) C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]O) O(P[5]C[5]2)(CCHH) P[5](C[5]C[6a]C[5])(C[5]C[5]2)(OC){1|P<3>,2|C<4>,3|C<3>} C[5](C[6a]C[6a]2)(C[5]C[5]C)(P[5]C[5]O){1|C<4>,2|H<1>,3|C<3>} O(P[5]C[5]2)(CCHH) 107.6710 0.000 1 107.6710 0.000 1 108.7638 0.592 4 107.2998 3.052 8 107.7239 4.290 9 107.7239 4.290 9 246 818 893 0:SP3_SP2_SP3 P[5] C[5] O 3:3:2: 3:3:4: 3:4: N[5]-3:C[5]-3:O-2: C[5,5]-3:P[5]-3:C-4: P[5]-3:Ga-4: P[5](N[5]C[5,5]C[6a])(C[5]C[5,5]C)(OGa) C[5](C[5,5]C[5,5]N[5])(P[5]N[5]O)(CC3) O(P[5]C[5]N[5])(GaCl3) P[5](N[5]C[5,5]C[6a])(C[5]C[5,5]C)(OGa){1|C<4>,1|N<3>,2|C<3>} C[5](C[5,5]C[5,5]N[5])(P[5]N[5]O)(CC3){1|C<4>,3|C<3>} O(P[5]C[5]N[5])(GaCl3) 111.1170 0.000 1 111.1170 0.000 1 111.1170 0.000 1 111.1170 0.000 1 107.7239 4.290 9 107.7239 4.290 9 246 818 930 0:SP3_SP2_SP2 P[5] C[5] C 3:2:3: 3:2:4: 3:3:4: C[5]-3:P[5]-2:C-3: P[5]-3:P[5]-2:C-4: P[5]-3:C[5]-3:C-4: P[5](C[5]P[5]C)(P[5]C[5])(CC[5]C) C[5](P[5]P[5]C)(P[5]C[5])(CC3) C(P[5]C[5]P[5])(C[5]N[5]2)(CC3) P[5](C[5]P[5]C)(P[5]C[5])(CC[5]C){1|C<4>} C[5](P[5]P[5]C)(P[5]C[5])(CC3){1|C<4>} C(P[5]C[5]P[5])(C[5]N[5]2)(CC3) 134.8890 0.000 1 134.8890 0.000 1 134.8890 0.000 1 134.8890 0.000 1 103.7160 154.698 9 103.7160 154.698 9 246 818 930 0:SP3_SP2_SP2 P[5] C[5] C 3:3:3: 3:3:3: 4:3:1: C[5]-3:C[5]-3:C-3: C[5]-3:P[5]-3:C-3: C[5]-4:P[5]-3:O-1: P[5](C[5]C[5]Si)(C[5]C[5]C)(CC[5]O) C[5](C[5]C[5]C)(P[5]C[5]C)(CC[5]O) C(C[5]C[5]P[5]Fe)(P[5]C[5]2)(O) P[5](C[5]C[5]Si)(C[5]C[5]C)(CC[5]O){2|C<4>} C[5](C[5]C[5]C)(P[5]C[5]C)(CC[5]O){1|Si<4>,1|C<4>} C(C[5]C[5]P[5]Fe)(P[5]C[5]2)(O) 95.7274 0.977 4 95.7274 0.955 4 95.7274 0.955 4 95.7274 0.955 4 103.7160 154.698 9 103.7160 154.698 9 246 818 930 0:SP3_SP2_SP2 P[5] C[5] C 3:3:3: 3:3:4: 4:3:1: C[5]-3:C[5]-3:C-3: C[5]-3:P[5]-3:Si-4: C[5]-4:P[5]-3:O-1: P[5](C[5]C[5]Si)(C[5]C[5]C)(CC[5]O) C[5](C[5]C[5]C)(P[5]C[5]C)(SiC3) C(C[5]C[5]P[5]Fe)(P[5]C[5]2)(O) P[5](C[5]C[5]Si)(C[5]C[5]C)(CC[5]O){2|C<4>} C[5](C[5]C[5]C)(P[5]C[5]C)(SiC3){1|C<3>,1|C<4>} C(C[5]C[5]P[5]Fe)(P[5]C[5]2)(O) 103.9112 1.586 4 103.9112 2.514 4 103.9112 2.514 4 103.9112 2.514 4 103.7160 154.698 9 103.7160 154.698 9 246 818 951 0:SP3_SP-NON_SP2 P[5] C[5] H 3:3:1: 3:3:3: 3: C[5,6a]-3:C[5]-3:H-1: C[5]-3:P[5]-3:C[6a]-3: P[5]-3: P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(H) C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]H)(C[6a]C[6a]2) H(P[5]C[5,6a]C[5]) P[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(H){1|H<1>,5|C<3>} C[5](C[5]C[5,6a]C[6a])(P[5]C[5,6a]H)(C[6a]C[6a]2){2|H<1>,6|C<3>} H(P[5]C[5,6a]C[5]) 96.3939 0.000 1 96.3939 0.000 1 96.3939 0.000 1 96.3939 0.000 1 96.3939 0.000 1 96.3939 0.000 1 246 818 956 0:SP3_SP2_SP2 P[5] C[5] N 3:3:3: 3:3:3: 3:3:3: C[5]-3:C[5]-3:N-3: C[6a]-3:C[5]-3:P[5]-3: C[6a]-3:C[6a]-3:P[5]-3: P[5](C[5]C[6a]C[5])2(NC[6a]2) C[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]N) N(C[6a]C[6a]2)2(P[5]C[5]2) P[5](C[5]C[6a]C[5])2(NC[6a]2){2|H<1>,4|C<3>} C[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]N){3|C<3>,3|H<1>} N(C[6a]C[6a]2)2(P[5]C[5]2) 108.0775 0.746 2 108.0775 0.557 2 108.0775 0.557 2 108.0775 0.557 2 108.0775 0.557 2 108.0775 0.557 2 246 818 956 0:SP3_SP2_SP3 P[5] C[5] N 4:3:3: 3:2:3: 3:4:4: C[5,5]-4:C[5]-3:N-3: P[5]-3:N[5]-2:N-3: P[5]-3:C-4:C-4: P[5](C[5,5]C[5,5]C[5]Fe)(C[5]N[5]N)(NCC) C[5](P[5]C[5,5]N)(N[5]C[5,5])(NCC) N(P[5]C[5,5]C[5])(CH3)2 P[5](C[5,5]C[5,5]C[5]Fe)(C[5]N[5]N)(NCC){1|H<1>,2|C<4>} C[5](P[5]C[5,5]N)(N[5]C[5,5])(NCC){1|Fe<10>,2|C<4>} N(P[5]C[5,5]C[5])(CH3)2 103.0702 1.928 6 103.0702 3.716 6 103.0702 3.716 6 103.0702 3.716 6 103.7746 6.570 7 103.7746 6.570 7 246 818 956 0:SP3_SP2_SP3 P[5] C[5] N 6:3:3: 3:3:3: 3:4:4: C[5x3,6x5,20x6]-6:C[5]-3:N-3: C[5]-3:P[5]-3:P-3: P[5]-3:C-4:C-4: P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]C[5]P)(NCC) C[5](C[5]C[5x3,6x5,20x6]C[6a])(P[5]C[5x3,6x5,20x6]N)(PCN) N(P[5]C[5x3,6x5,20x6]C[5])(CH3)2 P[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]C[5]P)(NCC){1|C<3>,4|H<1>,5|B<6>} C[5](C[5]C[5x3,6x5,20x6]C[6a])(P[5]C[5x3,6x5,20x6]N)(PCN){2|C<3>,6|B<6>} N(P[5]C[5x3,6x5,20x6]C[5])(CH3)2 108.0010 0.000 1 108.0010 0.000 1 108.0010 0.000 1 108.0010 0.000 1 103.7746 6.570 7 103.7746 6.570 7 246 818 987 5:SP3_SP-NON_SP2 P[5] C[5] P[5] 3:2:3: 3:2:4: 3:3: C[5]-3:P[5]-2:C-3: P[5]-3:P[5]-2:C-4: C[5]-3:P[5]-3: P[5](C[5]P[5]C)(P[5]C[5])(CC[5]C) C[5](P[5]P[5]C)(P[5]C[5])(CC3) P[5](C[5]P[5]C)(P[5]C[5]C) P[5](C[5]P[5]C)(P[5]C[5])(CC[5]C){1|C<4>} C[5](P[5]P[5]C)(P[5]C[5])(CC3){1|C<4>} P[5](C[5]P[5]C)(P[5]C[5]C){1|C<4>} 107.9880 0.000 1 107.9880 0.000 1 107.9880 0.000 1 107.9880 0.000 1 104.4050 25.676 2 104.4050 25.676 2 246 818 987 5:SP3_SP-NON_SP2 P[5] C[5] P[5] 3:3:2: 3:3:1: 3:3: C[6a]-3:C[5]-3:P[5]-2: P[5]-3:C[5]-3:H-1: P[5]-3:C[5]-3: P[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]) C[5](P[5]C[6a]P[5])(C[5]C[5]H)(H) P[5](P[5]C[6a]C[5])(C[5]C[5]H) P[5](C[6a]C[6a]2)(C[5]C[5]H)(P[5]C[5]){2|C<3>,2|C<4>,2|H<1>} C[5](P[5]C[6a]P[5])(C[5]C[5]H)(H){1|H<1>,2|C<3>} P[5](P[5]C[6a]C[5])(C[5]C[5]H){2|C<3>,2|H<1>} 100.8220 0.000 1 100.8220 0.000 1 100.8220 0.000 1 100.8220 0.000 1 104.4050 25.676 2 104.4050 25.676 2 246 818 989 5:SP3_SP2_SP2 P[5,5,6] C[5,6] Si[5,5] 3:3:3: 3:2:4: 4:3:3: Si[5,5]-3:C[5,6]-3:C[5,6]-3: P[5,5,6]-3:P[5,6]-2:C-4: C[5,5,6]-4:P[5,5,6]-3:N-3: P[5,5,6](Si[5,5]C[5,5,6]N)(C[5,6]P[5,6]C)2 C[5,6](P[5,5,6]Si[5,5]C[5,6])(P[5,6]C[5,5,6])(CC3) Si[5,5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(NCC) P[5,5,6](Si[5,5]C[5,5,6]N)(C[5,6]P[5,6]C)2{1|C<4>} C[5,6](P[5,5,6]Si[5,5]C[5,6])(P[5,6]C[5,5,6])(CC3){1|N<3>,1|P<2>,2|C<4>} Si[5,5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(NCC){2|C<4>} 91.3058 3.388 2 91.3058 11.475 2 91.3058 11.475 2 91.3058 11.475 2 91.3058 11.475 2 91.3058 11.475 2 246 852 852 6:SP3_SP3_SP3 P[3x5,6] P[3,5,5,6] P[3,5,6] 3:3:3: 3:3:3: 3:3:3: P[3,5,5,6]-3:P[3,5,6]-3:P[4x5]-3: P[3,5,5,6]-3:P[3,5,5]-3:P[3x5,6]-3: P[3x5,6]-3:P[3,5,6]-3:P[3]-3: P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]P[3])(P[4x5]P[3x5,6]P[5,5]) P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]P[5,5])(P[3x5,6]P[3,5,6]P[4x5]) P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]P[3])(P[3]P[3,5,6]P) P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]P[3])(P[4x5]P[3x5,6]P[5,5]){2|P<2>} P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]P[5,5])(P[3x5,6]P[3,5,6]P[4x5]){1|P<2>,2|P<3>} P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]P[3])(P[3]P[3,5,6]P){3|P<3>} 94.2970 0.120 2 94.2970 0.014 2 94.2970 0.014 2 94.2970 0.014 2 95.3703 1.687 4 95.3703 1.687 4 246 852 852 6:SP3_SP3_SP3 P[3x5,6] P[3,5,5,6] P[3,5,6] 3:3:3: 3:3:3: 3:3:5: P[3,5,5,6]-3:P[3,5,6]-3:P[4x5]-3: P[3,5,5,6]-3:P[3,5,5]-3:P[3x5,6]-3: P[3x5,6]-3:P[3,5,6]-3:Nb[3]-5: P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]) P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]C[5,5])(P[3x5,6]P[3,5,6]P[4x5]) P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]Nb[3])(Nb[3]P[3,5,6]O3) P[3x5,6](P[3,5,5,6]P[3,5,5,6]P[3,5,5])(P[3,5,6]P[3,5,6]Nb[3])(P[4x5]P[3x5,6]C[5,5]){2|C<3>,3|O<2>} P[3,5,5,6](P[3,5,5,6]P[3,5,5]P[3x5,6])(P[3,5,5]P[3,5,5,6]C[5,5])(P[3x5,6]P[3,5,6]P[4x5]){1|Nb<5>,1|P<3>,2|C<3>} P[3,5,6](P[3x5,6]P[3,5,5,6]P[4x5])(P[3,5,6]P[3x5,6]Nb[3])(Nb[3]P[3,5,6]O3){1|C<4>,2|P<3>} 96.4436 0.661 2 96.4436 0.437 2 96.4436 0.437 2 96.4436 0.437 2 95.3703 1.687 4 95.3703 1.687 4 246 852 940 0:SP3_SP-NON_SP3 P[5,5] P[3,5,5] P 3:3:2: 3:3:3: 3:3: P[3,5,5]-3:P[4x5]-3:P-2: P[3,5,5,6]-3:P[3,5,5,6]-3:P[5,5]-3: P[5,5]-3:C[5]-3: P[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(PC[5]) P[3,5,5](P[3,5,5,6]P[3,5,5,6]P[3x5,6])2(P[5,5]P[4x5]P) P(P[5,5]P[3,5,5]P[4x5])(C[5]N[5]2) P[5,5](P[3,5,5]P[3,5,5,6]2)(P[4x5]P[3x5,6]2)(PC[5]){2|P<3>} P[3,5,5](P[3,5,5,6]P[3,5,5,6]P[3x5,6])2(P[5,5]P[4x5]P){2|P<3>} P(P[5,5]P[3,5,5]P[4x5])(C[5]N[5]2) 94.6279 0.000 1 94.6279 0.000 1 94.6279 0.000 1 94.6279 0.000 1 94.6279 0.000 1 94.6279 0.000 1 246 852 943 0:SP3_SP-NON_SP3 P[5,5] P[3,5,5] Ga[6] 3:3:4: 3:3:3: 3:3:3:1: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5]-3:N[6]-3:N[6]-3:Cl-1: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]) Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(Cl) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2Cl){1|C<4>,2|N<3>,4|C<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]){1|Cl<1>,1|C<4>,4|N<3>} Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(Cl){1|Ga<4>,2|C<4>,3|P<3>,5|C<3>} 95.5172 0.000 1 95.5172 0.000 1 95.5172 0.000 1 95.5172 0.000 1 98.5626 18.549 2 98.5626 18.549 2 246 852 943 0:SP3_SP-NON_SP3 P[5,5] P[3,5,5] Ga[6] 3:3:4: 3:3:3: 3:3:3:2: P[3x5]-3:P[3,5,5]-3:Ga[6]-4: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5]-3:N[6]-3:N[6]-3:O-2: P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O) P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]) Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(OS) P[5,5](P[3x5]Ga[5,5,6]P[5,5])(P[3,5,5]P[3,5,5]2)(Ga[6]N[6]2O){1|C<4>,2|N<3>,4|C<3>} P[3,5,5](P[3,5,5]Ga[5,5,6]P[3,5,5])(P[3,5,5]P[3,5,5]P[5,5])(P[5,5]P[3x5]Ga[6]){1|C<4>,1|O<2>,4|N<3>} Ga[6](P[5,5]P[3,5,5]P[3x5])(N[6]C[6a]C[6])2(OS){1|Ga<4>,2|C<4>,3|P<3>,5|C<3>} 101.6080 0.000 1 101.6080 0.000 1 101.6080 0.000 1 101.6080 0.000 1 98.5626 18.549 2 98.5626 18.549 2 246 852 951 0:SP3_SP-NON_SP3 P[5,5] P[3,5,5] H 3:3:1: 3:3:3: 3: P[3,5,5]-3:P[3x5]-3:H-1: P[3,5,5]-3:P[3,5,5]-3:P[5,5]-3: P[5,5]-3: P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2)(H) P[3,5,5](P[3,5,5]P[3,5,5]P[5,5])2(P[5,5]P[3x5]H) H(P[5,5]P[3,5,5]P[3x5]) P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2)(H){2|Ag<3>} P[3,5,5](P[3,5,5]P[3,5,5]P[5,5])2(P[5,5]P[3x5]H){2|Ag<3>} H(P[5,5]P[3,5,5]P[3x5]) 105.3090 0.000 1 105.3090 0.000 1 105.3090 0.000 1 105.3090 0.000 1 105.3090 0.000 1 105.3090 0.000 1 246 882 882 6:SP3_SP3_SP3 P[5,5,6,6] P[4,5,5,6,6] P[4,5,5,6,6] 3:3:3: 4:4:3: 3:3:4: P[4,5,5,6,6]-3:P[4,5,5,6,6]-3:C[5]-3: C[4,5,5,6,6]-4:C[4,3x5]-4:P[5,5,6,6]-3: P[4,3x5,6]-3:P[5,5,6,6]-3:C[4,5,6]-4: P[5,5,6,6](P[4,5,5,6,6]C[4,5,5,6,6]C[4,3x5])(P[4,5,5,6,6]P[4,3x5,6]C[4,5,6])(C[5]P[5]C) P[4,5,5,6,6](C[4,5,5,6,6]P[4,5,5,6,6]Si[4,5]C)(C[4,3x5]P[4,3x5,6]Si[4,5]C)(P[5,5,6,6]P[4,5,5,6,6]C[5]) P[4,5,5,6,6](P[4,3x5,6]P[4,5,5,6,6]C[4,3x5])(P[5,5,6,6]P[4,5,5,6,6]C[5])(C[4,5,6]P[4,5,5,6,6]P[5]C) P[5,5,6,6](P[4,5,5,6,6]C[4,5,5,6,6]C[4,3x5])(P[4,5,5,6,6]P[4,3x5,6]C[4,5,6])(C[5]P[5]C){1|Si<4>,1|P<3>,3|C<4>} P[4,5,5,6,6](C[4,5,5,6,6]P[4,5,5,6,6]Si[4,5]C)(C[4,3x5]P[4,3x5,6]Si[4,5]C)(P[5,5,6,6]P[4,5,5,6,6]C[5]){1|P<2>,2|C<4>,2|I<1>} P[4,5,5,6,6](P[4,3x5,6]P[4,5,5,6,6]C[4,3x5])(P[5,5,6,6]P[4,5,5,6,6]C[5])(C[4,5,6]P[4,5,5,6,6]P[5]C){1|Si<4>,3|C<4>} 101.4855 0.235 2 101.4855 0.055 2 101.4855 0.055 2 101.4855 0.055 2 101.4855 0.055 2 101.4855 0.055 2 246 891 891 5:SP3_SP2_SP2 P[5] S[5] S[5] 2:2:1: 3:3: 3:3: S[5]-2:S[5]-2:Br-1: C[5,6a]-3:P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(Br) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Br) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Br) P[5](S[5]C[5,6a])2(Br){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Br){1|H<1>,2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Br){1|H<1>,2|C<3>} 95.6652 0.338 3 95.6652 0.114 3 95.6652 0.114 3 95.5935 0.104 8 95.3859 0.347 13 95.3859 0.347 13 246 891 891 5:SP3_SP2_SP2 P[5] S[5] S[5] 2:2:1: 3:3: 3:3: S[5]-2:S[5]-2:Cl-1: C[5,6a]-3:P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(Cl) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Cl) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Cl) P[5](S[5]C[5,6a])2(Cl){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Cl){1|H<1>,2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Cl){1|H<1>,2|C<3>} 95.4160 0.022 2 95.4160 0.000 2 95.4160 0.000 2 95.5935 0.104 8 95.3859 0.347 13 95.3859 0.347 13 246 891 891 5:SP3_SP2_SP2 P[5] S[5] S[5] 2:2:1: 3:3: 3:3: S[5]-2:S[5]-2:I-1: C[5,6a]-3:P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(I) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]I) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]I) P[5](S[5]C[5,6a])2(I){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]I){1|H<1>,2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]I){1|H<1>,2|C<3>} 95.6401 0.456 3 95.6401 0.208 3 95.6401 0.208 3 95.5935 0.104 8 95.3859 0.347 13 95.3859 0.347 13 246 891 891 5:SP3_SP2_SP2 P[5] S[5] S[5] 2:2:2: 3:3: 3:3: S[5]-2:S[5]-2:S-2: C[5,6a]-3:P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(SC[6a]) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]S) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]S) P[5](S[5]C[5,6a])2(SC[6a]){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]S){1|H<1>,2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]S){1|H<1>,2|C<3>} 94.5053 0.106 2 94.5053 0.011 2 94.5053 0.011 2 94.5053 0.011 2 95.3859 0.347 13 95.3859 0.347 13 246 891 891 5:SP3_SP2_SP2 P[5] S[5] S[5] 2:2:3: 3:3: 3:3: S[5]-2:S[5]-2:N-3: C[5,6a]-3:P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(NP[5]2) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]N) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]N) P[5](S[5]C[5,6a])2(NP[5]2){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]N){1|H<1>,2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]N){1|H<1>,2|C<3>} 94.4113 0.000 1 94.4113 0.000 1 94.4113 0.000 1 95.4194 0.763 3 95.3859 0.347 13 95.3859 0.347 13 246 891 891 5:SP3_SP2_SP2 P[5] S[5] S[5] 2:2:3: 3:3: 3:3: S[5]-2:S[5]-2:P[5]-3: C[5,6a]-3:P[5]-3: C[5,6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(P[5]S[5]2) S[5](C[5,6a]C[5,6a]C[6a])(P[5]P[5]S[5]) S[5](C[5,6a]C[5,6a]C[6a])(P[5]P[5]S[5]) P[5](S[5]C[5,6a])2(P[5]S[5]2){4|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]P[5]S[5]){1|H<1>,2|C<3>,2|S<2>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]P[5]S[5]){1|H<1>,2|C<3>,2|S<2>} 95.9235 0.032 2 95.9235 0.001 2 95.9235 0.001 2 95.4194 0.763 3 95.3859 0.347 13 95.3859 0.347 13 246 891 891 5:SP3_SP3_SP3 P[5,5,6] S[5,6] S[5,5] 2:3:2: 3:3: 3:3: S[5,5]-2:P[5,6]-3:S[5,6]-2: P[5,5,6]-3:P[5,6]-3: P[5,5,6]-3:P[5,5,6]-3: P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]) S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I) S[5,5](P[5,5,6]P[5,6]S[5,6])2 P[5,5,6](S[5,5]P[5,5,6])(P[5,6]S[5,6]I)(S[5,6]P[5,6]){1|I<1>} S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I){1|I<1>,1|S<2>} S[5,5](P[5,5,6]P[5,6]S[5,6])2{2|I<1>} 102.9375 0.180 4 102.9375 0.032 4 102.9375 0.032 4 102.9375 0.032 4 102.9375 0.032 4 102.9375 0.032 4 246 891 909 0:SP3_SP2_SP2 P[5] S[5] S 2:2:2: 3:3: 3:3: S[5]-2:S[5]-2:S-2: C[5,6a]-3:P[5]-3: C[6a]-3:P[5]-3: P[5](S[5]C[5,6a])2(SC[6a]) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]S) S(C[6a]C[6a]2)(P[5]S[5]2) P[5](S[5]C[5,6a])2(SC[6a]){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]S){1|H<1>,2|C<3>} S(C[6a]C[6a]2)(P[5]S[5]2) 106.1707 0.490 4 106.1707 0.241 4 106.1707 0.241 4 106.1707 0.241 4 106.1707 0.241 4 106.1707 0.241 4 246 891 924 0:SP3_SP-NON_SP2 P[5] S[5] Br 2:2:1: 3:3: 3: S[5]-2:S[5]-2:Br-1: C[5,6a]-3:P[5]-3: P[5]-3: P[5](S[5]C[5,6a])2(Br) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Br) Br(P[5]S[5]2) P[5](S[5]C[5,6a])2(Br){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]Br){1|H<1>,2|C<3>} Br(P[5]S[5]2) 102.2853 0.520 6 102.2853 0.270 6 102.2853 0.270 6 102.2853 0.270 6 102.2853 0.270 6 102.2853 0.270 6 246 891 944 0:SP3_SP-NON_SP2 P[5] S[5] I 2:2:1: 3:3: 3: S[5]-2:S[5]-2:I-1: C[5,6a]-3:P[5]-3: P[5]-3: P[5](S[5]C[5,6a])2(I) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]I) I(P[5]S[5]2) P[5](S[5]C[5,6a])2(I){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]I){1|H<1>,2|C<3>} I(P[5]S[5]2) 102.5673 0.912 6 102.5673 0.832 6 102.5673 0.832 6 102.5673 0.832 6 102.5673 0.832 6 102.5673 0.832 6 246 891 944 0:SP3_SP-NON_SP3 P[5,6] S[5,6] I 3:2:1: 3:3: 3: P[5,5,6]-3:S[5,6]-2:I-1: P[5,5,6]-3:P[5,6]-3: P[5,6]-3: P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I) S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I) I(P[5,6]P[5,5,6]S[5,6]) P[5,6](P[5,5,6]S[5,5]S[5,6])(S[5,6]P[5,5,6])(I){1|P<3>} S[5,6](P[5,5,6]P[5,6]S[5,5])(P[5,6]P[5,5,6]I){1|I<1>,1|S<2>} I(P[5,6]P[5,5,6]S[5,6]) 102.3452 0.510 4 102.3452 0.260 4 102.3452 0.260 4 102.3452 0.260 4 102.3452 0.260 4 102.3452 0.260 4 246 891 955 5:SP3_SP3_SP3 P[5] S[5] P[5] 4:3:2: 4:3: 4:3:3:1: P[5]-4:C[6a]-3:S[5]-2: C[5,5]-4:P[5]-3: C[5,5]-4:P[5]-3:C[6a]-3:S-1: P[5](P[5]C[5,5]C[6a]S)(C[6a]C[6a]2)(S[5]C[5,5]) S[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]P[5]) P[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]S[5])(C[6a]C[6a]2)(S) P[5](P[5]C[5,5]C[6a]S)(C[6a]C[6a]2)(S[5]C[5,5]){1|C<4>,4|H<1>,5|C<3>} S[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]P[5]){1|C<4>,1|S<1>,2|H<1>,4|C<3>} P[5](C[5,5]C[5,5]C[5]H)(P[5]C[6a]S[5])(C[6a]C[6a]2)(S){5|H<1>,6|C<3>} 90.6707 0.000 1 90.6707 0.000 1 90.6707 0.000 1 90.6707 0.000 1 90.6707 0.000 1 90.6707 0.000 1 246 891 956 0:SP3_SP2_SP3 P[5] S[5] N 2:2:3: 3:3: 3:3:3: S[5]-2:S[5]-2:N-3: C[5,6a]-3:P[5]-3: P[5]-3:P[5]-3:P[5]-3: P[5](S[5]C[5,6a])2(NP[5]2) S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]N) N(P[5]S[5]2)3 P[5](S[5]C[5,6a])2(NP[5]2){2|C<3>} S[5](C[5,6a]C[5,6a]C[6a])(P[5]S[5]N){1|H<1>,2|C<3>} N(P[5]S[5]2)3 104.6930 0.076 2 104.6930 0.006 2 104.6930 0.006 2 104.6930 0.006 2 104.6930 0.006 2 104.6930 0.006 2 246 930 976 0:SP3_SP2_SP2 P[5] C O[5] 2:2:3: 3:3:4: 3:3: O[5]-2:O[5]-2:C-3: C[6]-3:P[5]-3:C-4: C[5,6a]-3:P[5]-3: P[5](O[5]C[5,6a])2(CC[6]C) C(C[6]N[6]2)(P[5]O[5]2)(CC3) O[5](C[5,6a]C[6a,6a]C[5,6a])(P[5]O[5]C) P[5](O[5]C[5,6a])2(CC[6]C){2|C<3>} C(C[6]N[6]2)(P[5]O[5]2)(CC3) O[5](C[5,6a]C[6a,6a]C[5,6a])(P[5]O[5]C){3|C<3>} 104.6270 8.832 2 104.6270 77.999 2 104.6270 77.999 2 104.6270 77.999 2 104.6270 77.999 2 104.6270 77.999 2 246 930 987 0:SP3_SP-NON_SP2 P[5] C P[5] 3:2:3: 3:3:4: 3:3: C[5]-3:P[5]-2:C-3: P[5]-3:C[5]-3:C-4: C[5]-3:P[5]-3: P[5](C[5]P[5]C)(P[5]C[5])(CC[5]C) C(P[5]C[5]P[5])(C[5]N[5]2)(CC3) P[5](C[5]P[5]C)(P[5]C[5]C) P[5](C[5]P[5]C)(P[5]C[5])(CC[5]C){1|C<4>} C(P[5]C[5]P[5])(C[5]N[5]2)(CC3) P[5](C[5]P[5]C)(P[5]C[5]C){1|C<4>} 115.1860 0.000 1 115.1860 0.000 1 115.1860 0.000 1 115.1860 0.000 1 115.1860 0.000 1 115.1860 0.000 1 246 944 955 0:SP3_SP-NON_SP3 P[5] I P[5] 3:4:1: 3: 3:3:3:3: C[5,6a]-3:P[5]-4:I-1: P[5]-3: C[5,6a]-3:P[5]-3:N-3:N-3: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(I) I(P[5]C[5,6a]P[5]) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]I)(NCC)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(I){1|H<1>,3|C<3>} I(P[5]C[5,6a]P[5]) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]I)(NCC)2{1|H<1>,3|C<3>} 96.5229 0.000 1 96.5229 0.000 1 96.5229 0.000 1 96.5229 0.000 1 96.5229 0.000 1 96.5229 0.000 1 246 955 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:4:4: 3:3:3:3: 3:3:4:4: P[5]-4:P[5]-4:C-4: C[6a]-3:C[6a]-3:P[5]-3:P[5]-3: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6a]2P[5])(P[5]P[5]CC)(CH3) P[5](C[6a]C[6a]2)2(P[5]P[5]C)2 P[5](P[5]P[5]C)2(CH3)2 P[5](P[5]C[6a]2P[5])(P[5]P[5]CC)(CH3){2|C<4>,4|C<3>} P[5](C[6a]C[6a]2)2(P[5]P[5]C)2{3|C<4>,4|C<3>,4|H<1>} P[5](P[5]P[5]C)2(CH3)2{1|C<4>,2|C<3>} 95.8422 0.000 1 95.8422 0.000 1 95.8422 0.000 1 95.8422 0.000 1 91.4295 7.737 7 91.4295 7.737 7 246 955 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:4:4: 3:3:4:3: 3:3:4:3: P[5]-4:P[5]-4:C-4: C[6a]-3:C[6a]-3:C[5]-4:P[5]-3: C[6a]-3:C[6a]-3:C[5]-4:P[5]-3: P[5](P[5]C[6a]2C[5])2(CCHH) P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(P[5]P[5]C) P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(P[5]P[5]C) P[5](P[5]C[6a]2C[5])2(CCHH){4|H<1>,8|C<3>} P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(P[5]P[5]C){6|C<3>,6|H<1>} P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(P[5]P[5]C){6|C<3>,6|H<1>} 89.2897 0.159 2 89.2897 0.025 2 89.2897 0.025 2 89.2897 0.025 2 91.4295 7.737 7 91.4295 7.737 7 246 955 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:4:4: 3:3:4:4: 3:3:4:4: P[5]-4:C[6]-4:P[5]-4: P[5]-3:P[5]-3:C[6]-4:C-4: P[5]-3:P[5]-3:C-4:C-4: P[5](P[5]C[6]P[5]C)(C[6]C[6]2H)(P[5]P[5]CC) P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3) P[5](P[5]C[6]P[5])2(CH3)2 P[5](P[5]C[6]P[5]C)(C[6]C[6]2H)(P[5]P[5]CC){5|H<1>,6|C<4>} P[5](P[5]C[6]P[5])2(C[6]C[6]2H)(CH3){6|H<1>,9|C<4>} P[5](P[5]C[6]P[5])2(CH3)2{2|H<1>,7|C<4>} 95.0432 0.000 1 95.0432 0.000 1 95.0432 0.000 1 95.0432 0.000 1 91.4295 7.737 7 91.4295 7.737 7 246 955 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:4:4: 3:4:4:4: 3:4:4:4: C[6]-4:P[5]-4:P[5]-4: P[5]-3:C[5]-4:C-4:C-4: P[5]-3:C[5]-4:C-4:C-4: P[5](C[6]C[6]2H)(P[5]C[5]CC)2 P[5](P[5]C[6]P[5])(C[5]C[5]HH)(CH3)2 P[5](P[5]C[6]P[5])(C[5]C[5]HH)(CH3)2 P[5](C[6]C[6]2H)(P[5]C[5]CC)2{2|C<4>,8|H<1>} P[5](P[5]C[6]P[5])(C[5]C[5]HH)(CH3)2{3|H<1>,4|C<4>} P[5](P[5]C[6]P[5])(C[5]C[5]HH)(CH3)2{3|H<1>,4|C<4>} 90.1795 0.000 1 90.1795 0.000 1 90.1795 0.000 1 90.1795 0.000 1 91.4295 7.737 7 91.4295 7.737 7 246 955 955 5:SP3_SP3_SP3 P[5] P[5] P[5] 4:4:4: 4:3:4:4: 4:3:4:4: P[5]-4:P[5]-4:C-4: C[5]-4:P[5]-3:C-4:C-4: C[5]-4:P[5]-3:C-4:C-4: P[5](P[5]C[5]CC)2(CCHH) P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2 P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2 P[5](P[5]C[5]CC)2(CCHH){4|H<1>} P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2{2|C<4>,2|H<1>} P[5](C[5]C[5]HH)(P[5]P[5]C)(CCHH)2{2|C<4>,2|H<1>} 90.1812 0.171 2 90.1812 0.029 2 90.1812 0.029 2 90.1812 0.029 2 91.4295 7.737 7 91.4295 7.737 7 246 955 956 0:SP3_SP2_SP3 P[5] P[5] N 3:4:3: 3:3:3:3: 3:4:4: C[5,6a]-3:P[5]-4:N-3: C[5,6a]-3:P[5]-3:N-3:N-3: P[5]-3:C-4:C-4: P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(NCC) P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]N)(NCC)2 N(P[5]C[5,6a]P[5])(CH3)2 P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]NN)(NCC){1|H<1>,3|C<3>} P[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]N)(NCC)2{1|H<1>,3|C<3>} N(P[5]C[5,6a]P[5])(CH3)2 104.1900 0.000 1 104.1900 0.000 1 104.1900 0.000 1 104.1900 0.000 1 104.1900 0.000 1 104.1900 0.000 1 246 955 987 5:SP3_SP-NON_SP3 P[5] P[5] P[5] 4:3:2: 3:2:4:4: 4:3: P[5]-4:P[5]-3:P[5]-2: P[5]-3:N[5]-2:C-4:C-4: P[5]-4:P[5]-3: P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]) P[5](P[5]P[5]2)(N[5]P[5])(CCCH)2 P[5](P[5]N[5]CC)(P[5]P[5]2) P[5](P[5]N[5]CC)(P[5]P[5]2)(P[5]P[5]){1|N<2>,1|P<4>,4|C<4>} P[5](P[5]P[5]2)(N[5]P[5])(CCCH)2{1|P<2>,1|P<4>,2|C<4>} P[5](P[5]N[5]CC)(P[5]P[5]2){1|P<2>,1|P<4>,2|C<4>} 93.5223 0.576 2 93.5223 0.332 2 93.5223 0.332 2 93.5223 0.332 2 93.5223 0.332 2 93.5223 0.332 2 246 956 976 0:SP3_SP2_SP3 P[5] N O[5] 2:2:3: 3:4:3: 4:3: O[5]-2:O[5]-2:N-3: P[5]-3:C-4:P-3: C[5]-4:P[5]-3: P[5](O[5]C[5])2(NCP) N(P[5]O[5]2)(CC[6a]CH)(PC[6a]C) O[5](C[5]C[5]HH)(P[5]O[5]N) P[5](O[5]C[5])2(NCP){4|H<1>} N(P[5]O[5]2)(CC[6a]CH)(PC[6a]C) O[5](C[5]C[5]HH)(P[5]O[5]N){2|H<1>} 104.2690 1.535 4 104.2690 2.355 4 104.2690 2.355 4 104.2690 2.355 4 104.2690 2.355 4 104.2690 2.355 4 246 976 976 5:SP3_SP2_SP2 P[5] O[5] O[5] 2:2:3: 3:3: 3:3: O[5]-2:O[5]-2:C-3: C[5,6a]-3:P[5]-3: C[5,6a]-3:P[5]-3: P[5](O[5]C[5,6a])2(CC[6]C) O[5](C[5,6a]C[6a,6a]C[5,6a])(P[5]O[5]C) O[5](C[5,6a]C[6a,6a]C[5,6a])(P[5]O[5]C) P[5](O[5]C[5,6a])2(CC[6]C){2|C<3>} O[5](C[5,6a]C[6a,6a]C[5,6a])(P[5]O[5]C){3|C<3>} O[5](C[5,6a]C[6a,6a]C[5,6a])(P[5]O[5]C){3|C<3>} 92.8384 0.000 1 92.8384 0.000 1 92.8384 0.000 1 92.8384 0.000 1 92.8384 0.000 1 92.8384 0.000 1 246 976 976 5:SP3_SP3_SP3 P[5] O[5] O[5] 2:2:1: 4:3: 4:3: O[5]-2:O[5]-2:Cl-1: C[5]-4:P[5]-3: C[5]-4:P[5]-3: P[5](O[5]C[5])2(Cl) O[5](C[5]C[6a]2C[5])(P[5]O[5]Cl) O[5](C[5]C[6a]2C[5])(P[5]O[5]Cl) P[5](O[5]C[5])2(Cl){4|C<3>} O[5](C[5]C[6a]2C[5])(P[5]O[5]Cl){6|C<3>} O[5](C[5]C[6a]2C[5])(P[5]O[5]Cl){6|C<3>} 94.9427 0.000 1 94.9427 0.000 1 94.9427 0.000 1 94.9427 0.000 1 94.3182 0.470 7 94.3182 0.470 7 246 976 976 5:SP3_SP3_SP3 P[5] O[5] O[5] 2:2:3: 4:3: 4:3: O[5]-2:O[5]-2:N-3: C[5]-4:P[5]-3: C[5]-4:P[5]-3: P[5](O[5]C[5])2(NCP) O[5](C[5]C[5]HH)(P[5]O[5]N) O[5](C[5]C[5]HH)(P[5]O[5]N) P[5](O[5]C[5])2(NCP){4|H<1>} O[5](C[5]C[5]HH)(P[5]O[5]N){2|H<1>} O[5](C[5]C[5]HH)(P[5]O[5]N){2|H<1>} 93.7768 0.030 2 93.7768 0.001 2 93.7768 0.001 2 93.7768 0.001 2 94.3182 0.470 7 94.3182 0.470 7 246 976 976 5:SP3_SP3_SP3 P[5] O[5] O[5] 3:2:2: 3:4: 3:4: C[6a]-3:O[5]-2:O[5]-2: P[5]-3:C[5]-4: P[5]-3:C[5]-4: P[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2 O[5](P[5]C[6a]O[5])(C[5]C[5]HH) O[5](P[5]C[6a]O[5])(C[5]C[5]HH) P[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2{1|N<3>,2|C<3>,5|H<1>} O[5](P[5]C[6a]O[5])(C[5]C[5]HH){2|C<3>,2|H<1>} O[5](P[5]C[6a]O[5])(C[5]C[5]HH){2|C<3>,2|H<1>} 95.0136 0.640 2 95.0136 0.410 2 95.0136 0.410 2 95.0136 0.410 2 94.3182 0.470 7 94.3182 0.470 7 246 976 976 5:SP3_SP3_SP3 P[5] O[5] O[5] 4:2:2: 3:4: 3:4: C[5]-4:O[5]-2:O[5]-2: P[5]-3:C[5]-4: P[5]-3:C[5]-4: P[5](C[5]C[5]2H)(O[5]C[5])2 O[5](P[5]C[5]O[5])(C[5]C[5]CH) O[5](P[5]C[5]O[5])(C[5]C[5]CH) P[5](C[5]C[5]2H)(O[5]C[5])2{1|P<3>,2|C<3>,2|C<4>,5|H<1>} O[5](P[5]C[5]O[5])(C[5]C[5]CH){1|C<3>,2|C<4>,2|H<1>} O[5](P[5]C[5]O[5])(C[5]C[5]CH){1|C<3>,2|C<4>,2|H<1>} 93.8520 0.179 2 93.8520 0.032 2 93.8520 0.032 2 93.8520 0.032 2 94.3182 0.470 7 94.3182 0.470 7 246 987 987 5:SP3_SP-NON_SP-NON P[3x5] P[5,5] P[5,5] 2:2:2: 3:3: 3:3: P[5,5]-2:P[5,5]-2:P[5,5]-2: P[3,5,5]-3:P[3x5]-3: P[3,5,5]-3:P[3x5]-3: P[3x5](P[5,5]P[3,5,5])3 P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2) P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2) P[3x5](P[5,5]P[3,5,5])3 P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2) P[5,5](P[3,5,5]P[3,5,5]2)(P[3x5]P[5,5]2) 101.3342 0.851 6 101.3342 0.725 6 101.3342 0.725 6 101.3342 0.725 6 101.3342 0.725 6 101.3342 0.725 6 254 254 622 6:SP3_SP3_SP3 Ge[6] Ge[6] O[6] 4:3:3:2: 4:3:3:2: 4:4: Ge[6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:Ge[6]-4: Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]) Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]) O[6](Ge[6]C[6a]2Ge[6])2 Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]){10|C<3>,1|Ge<4>,4|H<1>} Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]){10|C<3>,1|Ge<4>,4|H<1>} O[6](Ge[6]C[6a]2Ge[6])2{12|C<3>,1|O<2>} 105.5240 0.977 2 105.5240 0.955 2 105.5240 0.955 2 105.5240 0.955 2 105.5240 0.955 2 105.5240 0.955 2 254 254 643 0:SP3_SP2_SP3 Ge[6] Ge[6] C[6a] 4:3:3:2: 4:3:3:2: 4:3:3: Ge[6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]) Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]) C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2 Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]){10|C<3>,1|Ge<4>,4|H<1>} Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]){10|C<3>,1|Ge<4>,4|H<1>} C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2{1|Ge<4>,1|O<2>,2|H<1>,5|C<3>} 114.5358 1.637 4 114.5358 2.680 4 114.5358 2.680 4 114.5358 2.680 4 114.5358 2.680 4 114.5358 2.680 4 254 278 622 6:SP3_SP2_SP3 Ge[6] Ge[6] O[6] 3:2:2:2: 4:4:4: 4:4: Ge[6]-3:O[6]-2:O-2:O-2: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:Ge[6]-4: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2 Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2{1|Ge<3>,1|N<4>,6|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO){4|Ge<4>} 120.2560 0.000 1 120.2560 0.000 1 120.2560 0.000 1 118.0020 36.130 3 120.1432 42.426 4 120.1432 42.426 4 254 278 622 6:SP3_SP2_SP3 Ge[6] Ge[6] O[6] 3:2:2:2: 4:4:4: 4:4: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:Ge[6]-4: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO){4|Ge<4>} 122.5600 0.000 1 122.5600 0.000 1 116.8750 64.638 2 118.0020 36.130 3 120.1432 42.426 4 120.1432 42.426 4 254 278 622 6:SP3_SP2_SP3 Ge[6] Ge[6] O[6] 3:2:2:2: 4:4:4: 4:4: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:Ge[6]-4: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO){4|Ge<4>} 111.1900 0.000 1 111.1900 0.000 1 116.8750 64.638 2 118.0020 36.130 3 120.1432 42.426 4 120.1432 42.426 4 254 278 622 6:SP3_SP2_SP3 Ge[6] Ge[6] O[6] 3:2:2:4: 4:4:4: 4:4: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:Ge[6]-4: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO){4|Ge<4>} 126.5670 0.000 1 126.5670 0.000 1 126.5670 0.000 1 126.5670 0.000 1 120.1432 42.426 4 120.1432 42.426 4 254 278 892 0:SP3_SP2_SP3 Ge[6] Ge[6] N 3:2:2:4: 4:4:4: 4:1:1:1: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:H-1:H-1:H-1: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) N(Ge[6]Ge[6]O[6]O)(H)3 Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} N(Ge[6]Ge[6]O[6]O)(H)3 118.5820 0.000 1 118.5820 0.000 1 118.5820 0.000 1 118.5820 0.000 1 118.5820 0.000 1 118.5820 0.000 1 254 278 893 0:SP3_SP2_SP2 Ge[6] Ge[6] O 3:2:2:2: 4:4:4: 4:3: Ge[6]-3:O[6]-2:O-2:O-2: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2 Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2{1|Ge<3>,1|N<4>,6|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) 114.2335 5.570 2 114.2335 31.024 2 114.2335 31.024 2 113.0640 19.615 3 111.4220 23.861 4 111.4220 23.861 4 254 278 893 0:SP3_SP2_SP2 Ge[6] Ge[6] O 3:2:2:2: 4:4:4: 4:3: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) O(Ge[6]Ge[6]O[6]2)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} O(Ge[6]Ge[6]O[6]2)(C[6a]C[6a]2) 110.7250 0.000 1 110.7250 0.000 1 110.7250 0.000 1 113.0640 19.615 3 111.4220 23.861 4 111.4220 23.861 4 254 278 893 0:SP3_SP2_SP2 Ge[6] Ge[6] O 3:2:2:4: 4:4:4: 4:3: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) O(Ge[6]Ge[6]O[6]N)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} O(Ge[6]Ge[6]O[6]N)(C[6a]C[6a]2) 106.4960 0.000 1 106.4960 0.000 1 106.4960 0.000 1 106.4960 0.000 1 111.4220 23.861 4 111.4220 23.861 4 254 286 286 6:SP3_SP3_SP3 Ge[3x6] S[6,6] S[6,6] 2:2:2:1: 4:4: 4:4: S[6,6]-2:S[6,6]-2:S[6,6]-2:S-1: Ge[3x6]-4:Ge[3x6]-4: Ge[3x6]-4:Ge[3x6]-4: Ge[3x6](S[6,6]Ge[3x6])3(S) S[6,6](Ge[3x6]S[6,6]2S)2 S[6,6](Ge[3x6]S[6,6]2S)2 Ge[3x6](S[6,6]Ge[3x6])3(S){3|S<1>,3|S<2>} S[6,6](Ge[3x6]S[6,6]2S)2{2|Ge<4>} S[6,6](Ge[3x6]S[6,6]2S)2{2|Ge<4>} 110.5168 1.757 112 110.5168 3.088 112 110.5168 3.088 112 110.5168 3.088 112 110.5168 3.088 112 110.5168 3.088 112 254 286 977 0:SP3_SP-NON_SP3 Ge[3x6] S[6,6] S 2:2:2:1: 4:4: 4: S[6,6]-2:S[6,6]-2:S[6,6]-2:S-1: Ge[3x6]-4:Ge[3x6]-4: Ge[3x6]-4: Ge[3x6](S[6,6]Ge[3x6])3(S) S[6,6](Ge[3x6]S[6,6]2S)2 S(Ge[3x6]S[6,6]3) Ge[3x6](S[6,6]Ge[3x6])3(S){3|S<1>,3|S<2>} S[6,6](Ge[3x6]S[6,6]2S)2{2|Ge<4>} S(Ge[3x6]S[6,6]3) 108.3648 2.225 113 108.3648 4.952 113 108.3648 4.952 113 108.3648 4.952 113 108.3648 4.952 113 108.3648 4.952 113 254 362 362 6:SP3_SPD6_SPD6 Ge[6] C[5x3,5x5,21x6] C[5x3,5x5,21x6] 6:6:4:4: 6:6:6:6:6:4: 6:6:6:6:6:4: C[5x3,5x5,21x6]-6:C[5x3,5x5,21x6]-6:C-4:C-4: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,21x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:Ge[6]-4: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,21x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:Ge[6]-4: Ge[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])2(CH3)2 C[5x3,5x5,21x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,21x6]H)2(C[5x3,5x5,21x6]B[5x3,5x5,20x6]4Ge[6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(Ge[6]C[5x3,5x5,21x6]CC) C[5x3,5x5,21x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,21x6]H)2(C[5x3,5x5,21x6]B[5x3,5x5,20x6]4Ge[6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(Ge[6]C[5x3,5x5,21x6]CC) Ge[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])2(CH3)2{10|B<6>,1|Ge<4>,8|H<1>} C[5x3,5x5,21x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,21x6]H)2(C[5x3,5x5,21x6]B[5x3,5x5,20x6]4Ge[6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(Ge[6]C[5x3,5x5,21x6]CC){1|C<6>,2|C<4>,5|B<6>,5|H<1>} C[5x3,5x5,21x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,21x6]H)2(C[5x3,5x5,21x6]B[5x3,5x5,20x6]4Ge[6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(Ge[6]C[5x3,5x5,21x6]CC){1|C<6>,2|C<4>,5|B<6>,5|H<1>} 110.8940 0.000 1 110.8940 0.000 1 110.8940 0.000 1 110.8940 0.000 1 110.8940 0.000 1 110.8940 0.000 1 254 362 490 0:SP3_SP3_SPD6 Ge[6] C[5x3,5x5,21x6] C 6:6:4:4: 6:6:6:6:6:4: 4:1:1:1: C[5x3,5x5,21x6]-6:C[5x3,5x5,21x6]-6:C-4:C-4: B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,21x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:Ge[6]-4: Ge[6]-4:H-1:H-1:H-1: Ge[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])2(CH3)2 C[5x3,5x5,21x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,21x6]H)2(C[5x3,5x5,21x6]B[5x3,5x5,20x6]4Ge[6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(Ge[6]C[5x3,5x5,21x6]CC) C(Ge[6]C[5x3,5x5,21x6]2C)(H)3 Ge[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])2(CH3)2{10|B<6>,1|Ge<4>,8|H<1>} C[5x3,5x5,21x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,21x6]H)2(C[5x3,5x5,21x6]B[5x3,5x5,20x6]4Ge[6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(Ge[6]C[5x3,5x5,21x6]CC){1|C<6>,2|C<4>,5|B<6>,5|H<1>} C(Ge[6]C[5x3,5x5,21x6]2C)(H)3 108.2043 0.282 4 108.2043 0.080 4 108.2043 0.080 4 108.2043 0.080 4 108.2043 0.080 4 108.2043 0.080 4 254 430 790 0:SP3_SP-NON_SP-NON Ge[6] Se Cl 3:3:1:1: 4: 4: N[6]-3:N[6]-3:Cl-1:Se-1: Ge[6]-4: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(Cl)(Se) Se(Ge[6]N[6]2Cl) Cl(Ge[6]N[6]2Se) Ge[6](N[6]C[6a]C[6])2(Cl)(Se){2|C<4>,5|C<3>} Se(Ge[6]N[6]2Cl) Cl(Ge[6]N[6]2Se) 116.9890 0.000 1 116.9890 0.000 1 116.9890 0.000 1 116.9890 0.000 1 116.9890 0.000 1 116.9890 0.000 1 254 430 818 0:SP3_SP-NON_SP2 Ge[6] Se C[5,6] 3:3:2:1: 4: 4:3:3: C[5,6]-3:C[5,6]-3:Se-2:Se-1: Ge[6]-4: Ge[6]-4:N[5,6]-3:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se) Se(Ge[6]C[5,6]2Se) C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]) Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se){1|C<4>,6|C<3>} Se(Ge[6]C[5,6]2Se) C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} 112.9720 0.000 1 112.9720 0.000 1 112.9720 0.000 1 112.9720 0.000 1 112.9720 0.000 1 112.9720 0.000 1 254 430 856 0:SP3_SP-NON_SP2 Ge[6] Se N[6] 3:3:1:1: 4: 4:3:3: N[6]-3:N[6]-3:Cl-1:Se-1: Ge[6]-4: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(Cl)(Se) Se(Ge[6]N[6]2Cl) N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(Cl)(Se){2|C<4>,5|C<3>} Se(Ge[6]N[6]2Cl) N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 119.0640 0.191 2 119.0640 0.036 2 119.0640 0.036 2 119.0640 0.036 2 113.7136 14.706 8 113.7136 14.706 8 254 430 856 0:SP3_SP-NON_SP2 Ge[6] Se N[6] 3:3:3:1: 4: 4:3:3: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se) Se(Ge[6]N[6]2P) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se){2|C<4>,5|C<3>} Se(Ge[6]N[6]2P) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 110.8607 1.090 4 110.8607 1.189 4 111.9302 5.314 6 111.9302 5.314 6 113.7136 14.706 8 113.7136 14.706 8 254 430 856 0:SP3_SP-NON_SP2 Ge[6] Se N[6] 3:3:3:1: 4: 4:3:3: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PSi2)(Se) Se(Ge[6]N[6]2P) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PSi2)(Se){2|C<4>,5|C<3>} Se(Ge[6]N[6]2P) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 114.0690 3.046 2 114.0690 9.279 2 111.9302 5.314 6 111.9302 5.314 6 113.7136 14.706 8 113.7136 14.706 8 254 430 921 0:SP3_SP-NON_SP3 Ge[6] Se Se 3:3:2:1: 4: 4:4: C[5,6]-3:C[5,6]-3:Se-2:Se-1: Ge[6]-4: Ge[6]-4:Ga-4: Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se) Se(Ge[6]C[5,6]2Se) Se(Ge[6]C[5,6]2Se)(GaCl3) Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se){1|C<4>,6|C<3>} Se(Ge[6]C[5,6]2Se) Se(Ge[6]C[5,6]2Se)(GaCl3) 115.1920 0.000 1 115.1920 0.000 1 115.1920 0.000 1 115.1920 0.000 1 115.1920 0.000 1 115.1920 0.000 1 254 430 945 0:SP3_SP-NON_SP3 Ge[6] Se P 3:3:3:1: 4: 4:4:4: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4: Ge[6]-4:C[6]-4:C[6]-4: Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se) Se(Ge[6]N[6]2P) P(Ge[6]N[6]2Se)(C[6]C[6]2H)2 Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se){2|C<4>,5|C<3>} Se(Ge[6]N[6]2P) P(Ge[6]N[6]2Se)(C[6]C[6]2H)2 123.6365 5.113 2 123.6365 26.144 2 123.6365 26.144 2 122.2200 19.091 3 122.2200 19.091 3 122.2200 19.091 3 254 430 945 0:SP3_SP-NON_SP3 Ge[6] Se P 3:3:3:1: 4: 4:4:4: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4: Ge[6]-4:Si-4:Si-4: Ge[6](N[6]C[6a]C[6])2(PSi2)(Se) Se(Ge[6]N[6]2P) P(Ge[6]N[6]2Se)(SiC3)2 Ge[6](N[6]C[6a]C[6])2(PSi2)(Se){2|C<4>,5|C<3>} Se(Ge[6]N[6]2P) P(Ge[6]N[6]2Se)(SiC3)2 119.3870 0.000 1 119.3870 0.000 1 119.3870 0.000 1 122.2200 19.091 3 122.2200 19.091 3 122.2200 19.091 3 254 466 643 0:SP3_SP2_SP3 Ge[3x6] C[3x6] C[6a] 4:3:3:3: 4:4:3:1: 4:3:3: C[3x6]-4:C[6,6]-3:C[6,6]-3:C[6a]-3: C[5,3x6]-4:Ge[3x6]-4:C[6]-3:H-1: Ge[3x6]-4:C[6a]-3:C[6a]-3: Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2) C[3x6](C[5,3x6]Ge[5,3x6]C[5,6]C)(Ge[3x6]C[6,6]2C[6a])(C[6]C[6]H)(H) C[6a](Ge[3x6]C[3x6]C[6,6]2)(C[6a]C[6a]2)2 Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2){1|Ge<4>,2|H<1>,5|C<4>,6|C<3>} C[3x6](C[5,3x6]Ge[5,3x6]C[5,6]C)(Ge[3x6]C[6,6]2C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,7|C<3>} C[6a](Ge[3x6]C[3x6]C[6,6]2)(C[6a]C[6a]2)2{2|C<4>,4|H<1>,8|C<3>} 123.9270 0.000 1 123.9270 0.000 1 123.9270 0.000 1 123.9270 0.000 1 123.9270 0.000 1 123.9365 0.000 2 254 466 643 0:SP3_SP2_SP3 Ge[6] C[6] C[6a] 3:3:4:3: 3:3:4:1: 4:3:3: C[6,6a]-3:C[6,6a]-3:C[6]-4:C[6a]-3: C[6,6a]-3:C[6,6a]-3:Ge[6]-4:H-1: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2) C[6](C[6,6a]C[6,6a]C[6a])2(Ge[6]C[6,6a]2C[6a])(H) C[6a](Ge[6]C[6,6a]2C[6])(C[6a]C[6a]C)2 Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2){10|C<3>,2|H<1>,3|C<4>} C[6](C[6,6a]C[6,6a]C[6a])2(Ge[6]C[6,6a]2C[6a])(H){10|C<3>,1|Ge<4>,2|H<1>} C[6a](Ge[6]C[6,6a]2C[6])(C[6a]C[6a]C)2{3|H<1>,7|C<3>} 123.9460 0.000 1 123.9460 0.000 1 123.9460 0.000 1 123.9460 0.000 1 123.9460 0.000 1 123.9365 0.000 2 254 466 643 6:SP3_SP2_SP3 Ge[6] C[6] C[6,6a] 3:3:4:3: 3:3:4:1: 4:3:3: C[6,6a]-3:C[6,6a]-3:C[6]-4:C[6a]-3: C[6,6a]-3:C[6,6a]-3:Ge[6]-4:H-1: Ge[6]-4:C[6,6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2) C[6](C[6,6a]C[6,6a]C[6a])2(Ge[6]C[6,6a]2C[6a])(H) C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2){10|C<3>,2|H<1>,3|C<4>} C[6](C[6,6a]C[6,6a]C[6a])2(Ge[6]C[6,6a]2C[6a])(H){10|C<3>,1|Ge<4>,2|H<1>} C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){1|Ge<4>,4|H<1>,7|C<3>} 102.0575 0.794 2 102.0575 0.631 2 102.0575 0.631 2 102.0575 0.631 2 102.0575 0.631 2 102.0575 0.631 2 254 466 762 6:SP3_SP2_SP3 Ge[3x6] C[3x6] C[6,6] 4:3:3:3: 4:4:3:1: 4:3:1: C[3x6]-4:C[6,6]-3:C[6,6]-3:C[6a]-3: C[5,3x6]-4:Ge[3x6]-4:C[6]-3:H-1: Ge[3x6]-4:C[6,6]-3:H-1: Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2) C[3x6](C[5,3x6]Ge[5,3x6]C[5,6]C)(Ge[3x6]C[6,6]2C[6a])(C[6]C[6]H)(H) C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H) Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2){1|Ge<4>,2|H<1>,5|C<4>,6|C<3>} C[3x6](C[5,3x6]Ge[5,3x6]C[5,6]C)(Ge[3x6]C[6,6]2C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,7|C<3>} C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H){1|H<1>,5|C<3>,5|C<4>} 100.3580 0.000 1 100.3580 0.000 1 100.3580 0.000 1 100.3580 0.000 1 101.1660 1.306 2 101.1660 1.306 2 254 466 762 6:SP3_SP2_SP3 Ge[3x6] C[3x6] C[6,6] 4:3:3:3: 4:4:3:1: 4:3:4: C[3x6]-4:C[6,6]-3:C[6,6]-3:C[6a]-3: C[5,3x6]-4:Ge[3x6]-4:C[6]-3:H-1: Ge[3x6]-4:C[6,6]-3:C[3]-4: Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2) C[3x6](C[5,3x6]Ge[5,3x6]C[5,6]C)(Ge[3x6]C[6,6]2C[6a])(C[6]C[6]H)(H) C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C) Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2){1|Ge<4>,2|H<1>,5|C<4>,6|C<3>} C[3x6](C[5,3x6]Ge[5,3x6]C[5,6]C)(Ge[3x6]C[6,6]2C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,7|C<3>} C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C){1|C<4>,1|O<2>,4|H<1>,6|C<3>} 101.9740 0.000 1 101.9740 0.000 1 101.9740 0.000 1 101.9740 0.000 1 101.1660 1.306 2 101.1660 1.306 2 254 474 622 6:SP3_SP2_SP3 Ge[6] C[5,6] O[6] 4:3:3:2: 3:3:4:4: 4:3: C[5,6]-4:C[6a]-3:C[6a]-3:O[6]-2: C[5,6a]-3:C[5,6a]-3:Ge[6]-4:C[6]-4: Ge[6]-4:C[6]-3: Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]) C[5,6](C[5,6a]C[5,6a]C[6a])2(Ge[6]C[6a]2O[6])(C[6]C[6]CH) O[6](Ge[6]C[5,6]C[6a]2)(C[6]C[6]O) Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]){10|C<3>,1|H<1>,1|O<2>,4|C<4>} C[5,6](C[5,6a]C[5,6a]C[6a])2(Ge[6]C[6a]2O[6])(C[6]C[6]CH){3|H<1>,9|C<3>} O[6](Ge[6]C[5,6]C[6a]2)(C[6]C[6]O){1|C<4>,1|H<1>,6|C<3>} 98.4800 0.000 1 98.4800 0.000 1 98.4800 0.000 1 98.4800 0.000 1 98.4800 0.000 1 98.4800 0.000 1 254 474 643 0:SP3_SP2_SP3 Ge[6] C[5,6] C[6a] 4:3:3:2: 3:3:4:4: 4:3:3: C[5,6]-4:C[6a]-3:C[6a]-3:O[6]-2: C[5,6a]-3:C[5,6a]-3:Ge[6]-4:C[6]-4: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]) C[5,6](C[5,6a]C[5,6a]C[6a])2(Ge[6]C[6a]2O[6])(C[6]C[6]CH) C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2 Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]){10|C<3>,1|H<1>,1|O<2>,4|C<4>} C[5,6](C[5,6a]C[5,6a]C[6a])2(Ge[6]C[6a]2O[6])(C[6]C[6]CH){3|H<1>,9|C<3>} C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2{1|C<4>,2|H<1>,6|C<3>} 119.0905 10.746 2 119.0905 115.474 2 119.0905 115.474 2 119.0905 115.474 2 119.0905 115.474 2 119.0905 115.474 2 254 490 490 0:SP3_SP3_SP3 Ge[6] C C 2:2:4:4: 4:1:1:1: 4:1:1:1: O[6]-2:O[6]-2:C-4:C-4: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:H-1:H-1:H-1: Ge[6](O[6]C[6])(O[6]P[6])(CH3)2 C(Ge[6]O[6]2C)(H)3 C(Ge[6]O[6]2C)(H)3 Ge[6](O[6]C[6])(O[6]P[6])(CH3)2{1|W<6>,4|C<4>} C(Ge[6]O[6]2C)(H)3 C(Ge[6]O[6]2C)(H)3 116.0320 0.000 1 116.0320 0.000 1 116.0320 0.000 1 116.0320 0.000 1 114.5925 4.144 2 114.5925 4.144 2 254 490 490 0:SP3_SP3_SP3 Ge[6] C C 6:6:4:4: 4:1:1:1: 4:1:1:1: C[5x3,5x5,21x6]-6:C[5x3,5x5,21x6]-6:C-4:C-4: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:H-1:H-1:H-1: Ge[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])2(CH3)2 C(Ge[6]C[5x3,5x5,21x6]2C)(H)3 C(Ge[6]C[5x3,5x5,21x6]2C)(H)3 Ge[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])2(CH3)2{10|B<6>,1|Ge<4>,8|H<1>} C(Ge[6]C[5x3,5x5,21x6]2C)(H)3 C(Ge[6]C[5x3,5x5,21x6]2C)(H)3 113.1530 0.000 1 113.1530 0.000 1 113.1530 0.000 1 113.1530 0.000 1 114.5925 4.144 2 114.5925 4.144 2 254 490 622 0:SP3_SP2_SP3 Ge[6] C O[6] 3:3:2:4: 4:4:4:4: 4:3: C[6a]-3:C[6]-3:O[6]-2:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6]-4:C[6]-3: Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3) C(Ge[6]C[6a]C[6]O[6])(CH3)3 O[6](Ge[6]C[6a]C[6]C)(C[6]C[6]C) Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3){2|H<1>,3|C<3>,3|C<4>} C(Ge[6]C[6a]C[6]O[6])(CH3)3 O[6](Ge[6]C[6a]C[6]C)(C[6]C[6]C){1|C<4>,1|H<1>,1|P<2>,2|C<3>} 101.4650 0.000 1 101.4650 0.000 1 101.4650 0.000 1 101.4650 0.000 1 101.4650 0.000 1 101.4650 0.000 1 254 490 622 0:SP3_SP3_SP3 Ge[6] C O[6] 2:2:4:4: 4:1:1:1: 4:4: O[6]-2:O[6]-2:C-4:C-4: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:C[6]-4: Ge[6](O[6]C[6])(O[6]P[6])(CH3)2 C(Ge[6]O[6]2C)(H)3 O[6](Ge[6]O[6]CC)(C[6]C[6]CC) Ge[6](O[6]C[6])(O[6]P[6])(CH3)2{1|W<6>,4|C<4>} C(Ge[6]O[6]2C)(H)3 O[6](Ge[6]O[6]CC)(C[6]C[6]CC){1|P<4>,2|H<1>} 109.3340 5.491 2 109.3340 30.155 2 109.3340 30.155 2 109.8012 14.844 4 109.8012 14.844 4 109.8012 14.844 4 254 490 622 0:SP3_SP3_SP3 Ge[6] C O[6] 2:2:4:4: 4:1:1:1: 4:4: O[6]-2:O[6]-2:C-4:C-4: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:P[6]-4: Ge[6](O[6]C[6])(O[6]P[6])(CH3)2 C(Ge[6]O[6]2C)(H)3 O[6](Ge[6]O[6]CC)(P[6]C[6]CW) Ge[6](O[6]C[6])(O[6]P[6])(CH3)2{1|W<6>,4|C<4>} C(Ge[6]O[6]2C)(H)3 O[6](Ge[6]O[6]CC)(P[6]C[6]CW){1|C<4>,2|H<1>} 110.2685 3.675 2 110.2685 13.504 2 110.2685 13.504 2 109.8012 14.844 4 109.8012 14.844 4 109.8012 14.844 4 254 490 643 0:SP3_SP2_SP3 Ge[6] C C[6a] 3:3:2:4: 4:4:4:4: 4:3:3: C[6a]-3:C[6]-3:O[6]-2:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3) C(Ge[6]C[6a]C[6]O[6])(CH3)3 C[6a](Ge[6]C[6]O[6]C)(C[6a]C[6a]C)2 Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3){2|H<1>,3|C<3>,3|C<4>} C(Ge[6]C[6a]C[6]O[6])(CH3)3 C[6a](Ge[6]C[6]O[6]C)(C[6a]C[6a]C)2{1|C<4>,1|P<2>,2|C<3>,2|H<1>} 113.9760 0.000 1 113.9760 0.000 1 113.9760 0.000 1 113.9760 0.000 1 113.9760 0.000 1 113.9760 0.000 1 254 490 762 0:SP3_SP2_SP3 Ge[6] C C[6] 3:3:2:4: 4:4:4:4: 4:4:2: C[6a]-3:C[6]-3:O[6]-2:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6]-4:C[6]-4:P-2: Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3) C(Ge[6]C[6a]C[6]O[6])(CH3)3 C[6](Ge[6]C[6a]O[6]C)(C[6]C[6]HH)(PC[6a]) Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3){2|H<1>,3|C<3>,3|C<4>} C(Ge[6]C[6a]C[6]O[6])(CH3)3 C[6](Ge[6]C[6a]O[6]C)(C[6]C[6]HH)(PC[6a]){1|H<1>,3|C<3>} 118.8020 0.000 1 118.8020 0.000 1 118.8020 0.000 1 118.8020 0.000 1 118.8020 0.000 1 118.8020 0.000 1 254 490 818 0:SP3_SP2_SP3 Ge[6] C C[5,6] 3:3:4:1: 4:3:3:3: 3:4:3: C[5,6]-3:C[5,6]-3:C-4:H-1: Ge[6]-4:C[6a]-3:C[6a]-3:C[6a]-3: N[5,6]-3:Ge[6]-4:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H) C(Ge[6]C[5,6]2H)(C[6a]C[6a]2)3 C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C) Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H){1|B<4>,2|C<4>,4|C<3>} C(Ge[6]C[5,6]2H)(C[6a]C[6a]2)3 C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C){2|C<3>,2|H<1>,2|N<3>} 115.6610 1.164 2 115.6610 1.355 2 115.6610 1.355 2 115.6610 1.355 2 115.6610 1.355 2 115.6610 1.355 2 254 490 856 0:SP3_SP2_SP3 Ge[6] C N[6] 3:3:4:1: 4:1:1:1: 4:3:3: N[6]-3:N[6]-3:C-4:S-1: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(CH3)(S) C(Ge[6]N[6]2S)(H)3 N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(CH3)(S){2|C<4>,5|C<3>} C(Ge[6]N[6]2S)(H)3 N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 108.6750 1.142 4 108.6750 1.304 4 108.6750 1.304 4 108.6750 1.304 4 108.6750 1.304 4 108.6750 1.304 4 254 490 951 0:SP3_SP-NON_SP3 Ge[6] C H 3:3:4:1: 4:3:3:3: 4: C[5,6]-3:C[5,6]-3:C-4:H-1: Ge[6]-4:C[6a]-3:C[6a]-3:C[6a]-3: Ge[6]-4: Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H) C(Ge[6]C[5,6]2H)(C[6a]C[6a]2)3 H(Ge[6]C[5,6]2C) Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H){1|B<4>,2|C<4>,4|C<3>} C(Ge[6]C[5,6]2H)(C[6a]C[6a]2)3 H(Ge[6]C[5,6]2C) 113.1980 0.000 1 113.1980 0.000 1 113.1980 0.000 1 113.1980 0.000 1 113.1980 0.000 1 113.1980 0.000 1 254 490 977 0:SP3_SP-NON_SP3 Ge[6] C S 3:3:4:1: 4:1:1:1: 4: N[6]-3:N[6]-3:C-4:S-1: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(CH3)(S) C(Ge[6]N[6]2S)(H)3 S(Ge[6]N[6]2C) Ge[6](N[6]C[6a]C[6])2(CH3)(S){2|C<4>,5|C<3>} C(Ge[6]N[6]2S)(H)3 S(Ge[6]N[6]2C) 120.2530 0.000 2 120.2530 0.000 2 120.2530 0.000 2 120.2530 0.000 2 120.2530 0.000 2 120.2530 0.000 2 254 610 790 0:SP3_SP-NON_SP3 Ge[6] B Cl 3:3:4:1: 4:3:3:3: 4: N[6,6]-3:N[6]-3:B-4:Cl-1: Ge[6]-4:C[6a]-3:C[6a]-3:C[6a]-3: Ge[6]-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl) B(Ge[6]N[6,6]N[6]Cl)(C[6a]C[6a]2)3 Cl(Ge[6]N[6,6]N[6]B) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl){1|H<1>,4|C<3>} B(Ge[6]N[6,6]N[6]Cl)(C[6a]C[6a]2)3 Cl(Ge[6]N[6,6]N[6]B) 104.2530 0.000 1 104.2530 0.000 1 104.2530 0.000 1 104.2530 0.000 1 104.2530 0.000 1 104.2530 0.000 1 254 610 856 0:SP3_SP2_SP3 Ge[6] B N[6,6] 3:3:4:1: 4:1:1:1: 4:3:3: N[6,6]-3:N[6]-3:B-4:H-1: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:C[6,6]-3:C[6]-3: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H) B(Ge[6]N[6,6]N[6]H)(H)3 N[6,6](Ge[6]N[6]BH)(C[6,6]C[6]2)(C[6]C[6]H) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H){1|H<1>,4|C<3>} B(Ge[6]N[6,6]N[6]H)(H)3 N[6,6](Ge[6]N[6]BH)(C[6,6]C[6]2)(C[6]C[6]H){2|Si<4>,2|C<3>,2|H<1>} 110.2910 0.000 1 110.2910 0.000 1 110.2910 0.000 1 110.2910 0.000 1 110.2880 0.000 2 121.7638 201.163 4 254 610 856 0:SP3_SP2_SP3 Ge[6] B N[6,6] 3:3:4:1: 4:3:3:3: 4:3:3: N[6,6]-3:N[6]-3:B-4:Cl-1: Ge[6]-4:C[6a]-3:C[6a]-3:C[6a]-3: Ge[6]-4:C[6,6]-3:C[6]-3: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl) B(Ge[6]N[6,6]N[6]Cl)(C[6a]C[6a]2)3 N[6,6](Ge[6]N[6]ClB)(C[6,6]C[6]2)(C[6]C[6]H) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl){1|H<1>,4|C<3>} B(Ge[6]N[6,6]N[6]Cl)(C[6a]C[6a]2)3 N[6,6](Ge[6]N[6]ClB)(C[6,6]C[6]2)(C[6]C[6]H){2|Si<4>,2|C<3>,2|H<1>} 110.2850 0.000 1 110.2850 0.000 1 110.2850 0.000 1 110.2850 0.000 1 110.2880 0.000 2 121.7638 201.163 4 254 610 856 0:SP3_SP2_SP3 Ge[6] B N[6] 3:3:4:1: 4:1:1:1: 4:3:4: N[6,6]-3:N[6]-3:B-4:H-1: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:C[6]-3:Si-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H) B(Ge[6]N[6,6]N[6]H)(H)3 N[6](Ge[6]N[6,6]BH)(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H){1|H<1>,4|C<3>} B(Ge[6]N[6,6]N[6]H)(H)3 N[6](Ge[6]N[6,6]BH)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} 127.0460 0.000 1 127.0460 0.000 1 127.0460 0.000 1 127.0460 0.000 1 133.2395 76.719 2 121.7638 201.163 4 254 610 856 0:SP3_SP2_SP3 Ge[6] B N[6] 3:3:4:1: 4:3:3:3: 4:3:4: N[6,6]-3:N[6]-3:B-4:Cl-1: Ge[6]-4:C[6a]-3:C[6a]-3:C[6a]-3: Ge[6]-4:C[6]-3:Si-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl) B(Ge[6]N[6,6]N[6]Cl)(C[6a]C[6a]2)3 N[6](Ge[6]N[6,6]ClB)(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl){1|H<1>,4|C<3>} B(Ge[6]N[6,6]N[6]Cl)(C[6a]C[6a]2)3 N[6](Ge[6]N[6,6]ClB)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} 139.4330 0.000 1 139.4330 0.000 1 139.4330 0.000 1 139.4330 0.000 1 133.2395 76.719 2 121.7638 201.163 4 254 610 951 0:SP3_SP-NON_SP3 Ge[6] B H 3:3:4:1: 4:1:1:1: 4: N[6,6]-3:N[6]-3:B-4:H-1: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H) B(Ge[6]N[6,6]N[6]H)(H)3 H(Ge[6]N[6,6]N[6]B) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H){1|H<1>,4|C<3>} B(Ge[6]N[6,6]N[6]H)(H)3 H(Ge[6]N[6,6]N[6]B) 122.4560 0.000 1 122.4560 0.000 1 122.4560 0.000 1 122.4560 0.000 1 122.4560 0.000 1 122.4560 0.000 1 254 622 622 6:SP3_SP3_SP3 Ge[6] O[6] O[6] 2:2:4:4: 4:4: 4:4: O[6]-2:O[6]-2:C-4:C-4: Ge[6]-4:C[6]-4: Ge[6]-4:P[6]-4: Ge[6](O[6]C[6])(O[6]P[6])(CH3)2 O[6](Ge[6]O[6]CC)(C[6]C[6]CC) O[6](Ge[6]O[6]CC)(P[6]C[6]CW) Ge[6](O[6]C[6])(O[6]P[6])(CH3)2{1|W<6>,4|C<4>} O[6](Ge[6]O[6]CC)(C[6]C[6]CC){1|P<4>,2|H<1>} O[6](Ge[6]O[6]CC)(P[6]C[6]CW){1|C<4>,2|H<1>} 100.6110 0.000 1 100.6110 0.000 1 100.6110 0.000 1 100.6110 0.000 1 103.9990 22.957 2 103.9990 22.957 2 254 622 622 6:SP3_SP3_SP3 Ge[6] O[6] O[6] 3:2:2:2: 4:4: 4:4: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6]-4:Ge[6]-4: Ge[6]-4:Ge[6]-4: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO){4|Ge<4>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO){4|Ge<4>} 107.3870 0.000 1 107.3870 0.000 1 107.3870 0.000 1 107.3870 0.000 1 103.9990 22.957 2 103.9990 22.957 2 254 622 643 0:SP3_SP2_SP2 Ge[6] O[6] C[6a] 3:3:2:4: 4:3: 4:3:3: C[6a]-3:C[6]-3:O[6]-2:C-4: Ge[6]-4:C[6]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3) O[6](Ge[6]C[6a]C[6]C)(C[6]C[6]C) C[6a](Ge[6]C[6]O[6]C)(C[6a]C[6a]C)2 Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3){2|H<1>,3|C<3>,3|C<4>} O[6](Ge[6]C[6a]C[6]C)(C[6]C[6]C){1|C<4>,1|H<1>,1|P<2>,2|C<3>} C[6a](Ge[6]C[6]O[6]C)(C[6a]C[6a]C)2{1|C<4>,1|P<2>,2|C<3>,2|H<1>} 109.4460 0.000 1 109.4460 0.000 1 109.4460 0.000 1 109.4460 0.000 1 106.2903 42.050 3 106.2903 42.050 3 254 622 643 0:SP3_SP2_SP2 Ge[6] O[6] C[6a] 4:3:3:2: 4:3: 4:3:3: C[5,6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:C[6]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]) O[6](Ge[6]C[5,6]C[6a]2)(C[6]C[6]O) C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2 Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]){10|C<3>,1|H<1>,1|O<2>,4|C<4>} O[6](Ge[6]C[5,6]C[6a]2)(C[6]C[6]O){1|C<4>,1|H<1>,6|C<3>} C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2{1|C<4>,2|H<1>,6|C<3>} 104.7124 8.316 2 104.7124 69.163 2 104.7124 69.163 2 104.7124 69.163 2 106.2903 42.050 3 106.2903 42.050 3 254 622 643 0:SP3_SP2_SP3 Ge[6] O[6] C[6a] 4:3:3:2: 4:4: 4:3:3: Ge[6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]) O[6](Ge[6]C[6a]2Ge[6])2 C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2 Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]){10|C<3>,1|Ge<4>,4|H<1>} O[6](Ge[6]C[6a]2Ge[6])2{12|C<3>,1|O<2>} C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2{1|Ge<4>,1|O<2>,2|H<1>,5|C<3>} 105.8065 3.918 4 105.8065 15.347 4 105.8065 15.347 4 105.8065 15.347 4 105.8065 15.347 4 105.8065 15.347 4 254 622 762 6:SP3_SP2_SP2 Ge[6] O[6] C[6] 3:3:2:4: 4:3: 4:4:2: C[6a]-3:C[6]-3:O[6]-2:C-4: Ge[6]-4:C[6]-3: Ge[6]-4:C[6]-4:P-2: Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3) O[6](Ge[6]C[6a]C[6]C)(C[6]C[6]C) C[6](Ge[6]C[6a]O[6]C)(C[6]C[6]HH)(PC[6a]) Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3){2|H<1>,3|C<3>,3|C<4>} O[6](Ge[6]C[6a]C[6]C)(C[6]C[6]C){1|C<4>,1|H<1>,1|P<2>,2|C<3>} C[6](Ge[6]C[6a]O[6]C)(C[6]C[6]HH)(PC[6a]){1|H<1>,3|C<3>} 95.6252 0.000 1 95.6252 0.000 1 95.6252 0.000 1 95.6252 0.000 1 95.6252 0.000 1 95.6252 0.000 1 254 622 892 0:SP3_SP3_SP3 Ge[6] O[6] N 3:2:2:4: 4:4: 4:1:1:1: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6]-4:Ge[6]-4: Ge[6]-4:H-1:H-1:H-1: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO) N(Ge[6]Ge[6]O[6]O)(H)3 Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO){4|Ge<4>} N(Ge[6]Ge[6]O[6]O)(H)3 96.1062 0.000 1 96.1062 0.000 1 96.1062 0.000 1 96.1062 0.000 1 96.1062 0.000 1 96.1062 0.000 1 254 622 893 0:SP3_SP2_SP3 Ge[6] O[6] O 3:2:2:2: 4:4: 4:3: Ge[6]-3:O[6]-2:O-2:O-2: Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2 O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO) O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2{1|Ge<3>,1|N<4>,6|O<2>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO){4|Ge<4>} O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) 99.4429 2.834 2 99.4429 8.033 2 99.4429 8.033 2 100.2331 8.796 4 101.6577 16.744 5 101.6577 16.744 5 254 622 893 0:SP3_SP2_SP3 Ge[6] O[6] O 3:2:2:2: 4:4: 4:3: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO) O(Ge[6]Ge[6]O[6]2)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO){4|Ge<4>} O(Ge[6]Ge[6]O[6]2)(C[6a]C[6a]2) 103.8390 0.000 1 103.8390 0.000 1 101.0233 15.856 2 100.2331 8.796 4 101.6577 16.744 5 101.6577 16.744 5 254 622 893 0:SP3_SP2_SP3 Ge[6] O[6] O 3:2:2:2: 4:4: 4:3: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO) O(Ge[6]Ge[6]O[6]2)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]OO){4|Ge<4>} O(Ge[6]Ge[6]O[6]2)(C[6a]C[6a]2) 98.2076 0.000 1 98.2076 0.000 1 101.0233 15.856 2 100.2331 8.796 4 101.6577 16.744 5 101.6577 16.744 5 254 622 893 0:SP3_SP2_SP3 Ge[6] O[6] O 3:2:2:4: 4:4: 4:3: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6]-4:Ge[6]-4: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO) O(Ge[6]Ge[6]O[6]N)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} O[6](Ge[6]Ge[6]O[6]O)(Ge[6]Ge[6]NO){4|Ge<4>} O(Ge[6]Ge[6]O[6]N)(C[6a]C[6a]2) 107.3560 0.000 1 107.3560 0.000 1 107.3560 0.000 1 107.3560 0.000 1 101.6577 16.744 5 101.6577 16.744 5 254 643 643 0:SP3_SP2_SP2 Ge[6] C[6,6a] C[6a] 3:3:3:3: 4:3:3: 4:3:3: C[6,6a]-3:C[6,6a]-3:C[6a]-3:C[6a]-3: Ge[6]-4:C[6,6a]-3:C[6a]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)2 C[6,6a](Ge[6]C[6,6a]C[6a]2)(C[6,6a]C[6a]N[6])(C[6a]C[6a]H) C[6a](Ge[6]C[6,6a]2C[6a])(C[6a]C[6a]H)2 Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)2{1|N<3>,6|H<1>,8|C<3>} C[6,6a](Ge[6]C[6,6a]C[6a]2)(C[6,6a]C[6a]N[6])(C[6a]C[6a]H){1|C<4>,1|H<1>,8|C<3>} C[6a](Ge[6]C[6,6a]2C[6a])(C[6a]C[6a]H)2{2|H<1>,7|C<3>} 111.9240 0.632 4 111.9240 0.399 4 111.9240 0.399 4 111.9240 0.399 4 112.0317 0.801 6 111.0440 2.336 10 254 643 643 0:SP3_SP2_SP2 Ge[6] C[6,6a] C[6a] 3:3:4:3: 4:3:3: 4:3:3: C[6,6a]-3:C[6,6a]-3:C[6]-4:C[6a]-3: Ge[6]-4:C[6,6a]-3:C[6a]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2) C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) C[6a](Ge[6]C[6,6a]2C[6])(C[6a]C[6a]C)2 Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2){10|C<3>,2|H<1>,3|C<4>} C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){1|Ge<4>,4|H<1>,7|C<3>} C[6a](Ge[6]C[6,6a]2C[6])(C[6a]C[6a]C)2{3|H<1>,7|C<3>} 112.2470 1.633 2 112.2470 2.668 2 112.2470 2.668 2 112.2470 2.668 2 112.0317 0.801 6 111.0440 2.336 10 254 643 643 0:SP3_SP2_SP2 Ge[6] C[6a] C[6a] 3:3:3:3: 4:3:3: 4:3:3: C[6,6a]-3:C[6,6a]-3:C[6a]-3:C[6a]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)2 C[6a](Ge[6]C[6,6a]2C[6a])(C[6a]C[6a]H)2 C[6a](Ge[6]C[6,6a]2C[6a])(C[6a]C[6a]H)2 Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)2{1|N<3>,6|H<1>,8|C<3>} C[6a](Ge[6]C[6,6a]2C[6a])(C[6a]C[6a]H)2{2|H<1>,7|C<3>} C[6a](Ge[6]C[6,6a]2C[6a])(C[6a]C[6a]H)2{2|H<1>,7|C<3>} 110.0730 0.000 1 110.0730 0.000 1 110.0730 0.000 1 110.0730 0.000 1 109.5625 0.795 4 111.0440 2.336 10 254 643 643 0:SP3_SP2_SP2 Ge[6] C[6a] C[6a] 4:3:3:2: 4:3:3: 4:3:3: C[5,6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]) C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2 C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2 Ge[6](C[5,6]C[5,6a]2C[6])(C[6a]C[6a]2)2(O[6]C[6]){10|C<3>,1|H<1>,1|O<2>,4|C<4>} C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2{1|C<4>,2|H<1>,6|C<3>} C[6a](Ge[6]C[5,6]C[6a]O[6])(C[6a]C[6a]C)2{1|C<4>,2|H<1>,6|C<3>} 108.5870 0.000 1 108.5870 0.000 1 108.5870 0.000 1 109.3923 1.019 3 109.5625 0.795 4 111.0440 2.336 10 254 643 643 0:SP3_SP2_SP2 Ge[6] C[6a] C[6a] 4:3:3:2: 4:3:3: 4:3:3: Ge[6]-4:C[6a]-3:C[6a]-3:O[6]-2: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]) C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2 C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2 Ge[6](Ge[6]C[6a]2O[6])(C[6a]C[6a]2)2(O[6]Ge[6]){10|C<3>,1|Ge<4>,4|H<1>} C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2{1|Ge<4>,1|O<2>,2|H<1>,5|C<3>} C[6a](Ge[6]C[6a]Ge[6]O[6])(C[6a]C[6a]H)2{1|Ge<4>,1|O<2>,2|H<1>,5|C<3>} 109.7950 1.032 2 109.7950 1.066 2 109.7950 1.066 2 109.3923 1.019 3 109.5625 0.795 4 111.0440 2.336 10 254 643 643 6:SP3_SP2_SP2 Ge[6] C[6,6a] C[6,6a] 3:3:3:3: 4:3:3: 4:3:3: C[6,6a]-3:C[6,6a]-3:C[6a]-3:C[6a]-3: Ge[6]-4:C[6,6a]-3:C[6a]-3: Ge[6]-4:C[6,6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)2 C[6,6a](Ge[6]C[6,6a]C[6a]2)(C[6,6a]C[6a]N[6])(C[6a]C[6a]H) C[6,6a](Ge[6]C[6,6a]C[6a]2)(C[6,6a]C[6a]N[6])(C[6a]C[6a]H) Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)2{1|N<3>,6|H<1>,8|C<3>} C[6,6a](Ge[6]C[6,6a]C[6a]2)(C[6,6a]C[6a]N[6])(C[6a]C[6a]H){1|C<4>,1|H<1>,8|C<3>} C[6,6a](Ge[6]C[6,6a]C[6a]2)(C[6,6a]C[6a]N[6])(C[6a]C[6a]H){1|C<4>,1|H<1>,8|C<3>} 98.6733 0.000 1 98.6733 0.000 1 98.6733 0.000 1 98.6733 0.000 1 100.0731 3.919 2 100.0731 3.919 2 254 643 643 6:SP3_SP2_SP2 Ge[6] C[6,6a] C[6,6a] 3:3:4:3: 4:3:3: 4:3:3: C[6,6a]-3:C[6,6a]-3:C[6]-4:C[6a]-3: Ge[6]-4:C[6,6a]-3:C[6a]-3: Ge[6]-4:C[6,6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2) C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]2H)(C[6a]C[6a]2){10|C<3>,2|H<1>,3|C<4>} C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){1|Ge<4>,4|H<1>,7|C<3>} C[6,6a](Ge[6]C[6,6a]C[6a]C[6])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){1|Ge<4>,4|H<1>,7|C<3>} 101.4730 0.000 1 101.4730 0.000 1 101.4730 0.000 1 101.4730 0.000 1 100.0731 3.919 2 100.0731 3.919 2 254 643 762 0:SP3_SP2_SP2 Ge[3x6] C[6a] C[6,6] 4:3:3:3: 4:3:3: 4:3:1: C[3x6]-4:C[6,6]-3:C[6,6]-3:C[6a]-3: Ge[3x6]-4:C[6a]-3:C[6a]-3: Ge[3x6]-4:C[6,6]-3:H-1: Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2) C[6a](Ge[3x6]C[3x6]C[6,6]2)(C[6a]C[6a]2)2 C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H) Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2){1|Ge<4>,2|H<1>,5|C<4>,6|C<3>} C[6a](Ge[3x6]C[3x6]C[6,6]2)(C[6a]C[6a]2)2{2|C<4>,4|H<1>,8|C<3>} C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H){1|H<1>,5|C<3>,5|C<4>} 108.0230 0.000 1 108.0230 0.000 1 108.0230 0.000 1 108.0230 0.000 1 111.4045 22.869 2 112.5628 11.200 5 254 643 762 0:SP3_SP2_SP2 Ge[3x6] C[6a] C[6,6] 4:3:3:3: 4:3:3: 4:3:4: C[3x6]-4:C[6,6]-3:C[6,6]-3:C[6a]-3: Ge[3x6]-4:C[6a]-3:C[6a]-3: Ge[3x6]-4:C[6,6]-3:C[3]-4: Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2) C[6a](Ge[3x6]C[3x6]C[6,6]2)(C[6a]C[6a]2)2 C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C) Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2){1|Ge<4>,2|H<1>,5|C<4>,6|C<3>} C[6a](Ge[3x6]C[3x6]C[6,6]2)(C[6a]C[6a]2)2{2|C<4>,4|H<1>,8|C<3>} C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C){1|C<4>,1|O<2>,4|H<1>,6|C<3>} 114.7860 0.000 1 114.7860 0.000 1 114.7860 0.000 1 114.7860 0.000 1 111.4045 22.869 2 112.5628 11.200 5 254 643 762 0:SP3_SP2_SP2 Ge[6] C[6a] C[6] 3:3:2:4: 4:3:3: 4:4:2: C[6a]-3:C[6]-3:O[6]-2:C-4: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6]-4:C[6]-4:P-2: Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3) C[6a](Ge[6]C[6]O[6]C)(C[6a]C[6a]C)2 C[6](Ge[6]C[6a]O[6]C)(C[6]C[6]HH)(PC[6a]) Ge[6](C[6a]C[6a]2)(C[6]C[6]P)(O[6]C[6])(CC3){2|H<1>,3|C<3>,3|C<4>} C[6a](Ge[6]C[6]O[6]C)(C[6a]C[6a]C)2{1|C<4>,1|P<2>,2|C<3>,2|H<1>} C[6](Ge[6]C[6a]O[6]C)(C[6]C[6]HH)(PC[6a]){1|H<1>,3|C<3>} 114.3660 0.000 1 114.3660 0.000 1 114.3660 0.000 1 114.3660 0.000 1 113.3350 8.730 3 112.5628 11.200 5 254 643 762 0:SP3_SP2_SP2 Ge[6] C[6a] C[6] 3:3:3:2: 4:3:3: 4:3:4: C[6a]-3:C[6]-3:C[6]-3:O-2: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6]-4:C[6]-3:C-4: Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH) C[6a](Ge[6]C[6]2O)(C[6a]C[6a]C)2 C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH) Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH){1|Ge<4>,2|C<3>,4|C<4>} C[6a](Ge[6]C[6]2O)(C[6a]C[6a]C)2{2|C<4>,2|H<1>,3|C<3>} C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH){1|C<4>,1|O<2>,4|C<3>} 112.8195 3.983 2 112.8195 15.865 2 112.8195 15.865 2 112.8195 15.865 2 113.3350 8.730 3 112.5628 11.200 5 254 643 893 0:SP3_SP2_SP3 Ge[6] C[6a] O 3:3:3:2: 4:3:3: 4:1: C[6a]-3:C[6]-3:C[6]-3:O-2: Ge[6]-4:C[6a]-3:C[6a]-3: Ge[6]-4:H-1: Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH) C[6a](Ge[6]C[6]2O)(C[6a]C[6a]C)2 O(Ge[6]C[6a]C[6]2)(H) Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH){1|Ge<4>,2|C<3>,4|C<4>} C[6a](Ge[6]C[6]2O)(C[6a]C[6a]C)2{2|C<4>,2|H<1>,3|C<3>} O(Ge[6]C[6a]C[6]2)(H) 110.1700 0.000 1 110.1700 0.000 1 110.1700 0.000 1 110.1700 0.000 1 110.1700 0.000 1 110.1700 0.000 1 254 658 658 6:SP3_SP3_SP3 Ge[6] Si[6] Si[6] 4:4:3:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3) Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3){1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} 111.3330 0.000 1 111.3330 0.000 1 110.6937 5.342 3 110.6937 5.342 3 110.6829 3.005 7 110.6829 3.005 7 254 658 658 6:SP3_SP3_SP3 Ge[6] Si[6] Si[6] 4:4:3:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3) Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3){1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} 110.3740 3.173 2 110.3740 10.071 2 110.6937 5.342 3 110.6937 5.342 3 110.6829 3.005 7 110.6829 3.005 7 254 658 658 6:SP3_SP3_SP3 Ge[6] Si[6] Si[6] 4:4:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:Si-4:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(SiC3)2 Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2 Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2 Ge[6](Si[6]Si[6]CC)2(SiC3)2{1|Ge<3>,4|C<4>} Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2{1|Si<4>,1|C<3>,2|C<4>} Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2{1|Si<4>,1|C<3>,2|C<4>} 112.4010 0.000 1 110.6748 2.449 4 110.6748 2.449 4 110.6748 2.449 4 110.6829 3.005 7 110.6829 3.005 7 254 658 658 6:SP3_SP3_SP3 Ge[6] Si[6] Si[6] 4:4:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:Si-4:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(SiC3)2 Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2 Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2 Ge[6](Si[6]Si[6]CC)2(SiC3)2{1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2{2|Si<4>,1|C<3>,2|C<4>} Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2{2|Si<4>,1|C<3>,2|C<4>} 110.0993 1.299 3 110.6748 2.449 4 110.6748 2.449 4 110.6748 2.449 4 110.6829 3.005 7 110.6829 3.005 7 254 658 762 6:SP3_SP2_SP3 Ge[6] Si[6] C[6] 4:3:4:4: 4:4:4:4: 3:4:1: Si[6]-4:C[6]-3:Si-4:Si-4: Si[6]-4:Ge[6]-4:C-4:C-4: C[6]-3:Ge[6]-4:H-1: Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2 Si[6](Si[6]Ge[4,6]CC)(Ge[6]C[6]Si2)(CH3)2 C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H) Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2{1|Ge<4>,1|C<3>,2|C<4>} Si[6](Si[6]Ge[4,6]CC)(Ge[6]C[6]Si2)(CH3)2{1|Ge<4>,1|H<1>,2|C<3>} C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H){1|Ge<4>,1|Si<4>,2|C<4>,3|C<3>} 113.9940 0.000 1 113.9940 0.000 1 113.9940 0.000 1 113.9940 0.000 1 113.9940 0.000 1 113.9940 0.000 1 254 658 880 0:SP3_SP3_SP3 Ge[6] Si[6] Si 4:3:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:C[6]-3:Si-4:Si-4: Si[6]-4:Ge[6]-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2 Si[6](Si[6]Ge[4,6]CC)(Ge[6]C[6]Si2)(CH3)2 Si(Ge[6]Si[6]C[6]Si)(CH3)3 Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2{1|Ge<4>,1|C<3>,2|C<4>} Si[6](Si[6]Ge[4,6]CC)(Ge[6]C[6]Si2)(CH3)2{1|Ge<4>,1|H<1>,2|C<3>} Si(Ge[6]Si[6]C[6]Si)(CH3)3 110.6610 0.368 2 110.6610 0.135 2 110.6610 0.135 2 110.6610 0.135 2 110.2353 6.774 24 110.2353 6.774 24 254 658 880 0:SP3_SP3_SP3 Ge[6] Si[6] Si 4:4:3:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3) Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 Si(Ge[6]Si[6]2C)(CH3)3 Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3){1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} Si(Ge[6]Si[6]2C)(CH3)3 109.7185 0.689 2 109.7185 0.475 2 111.3670 12.239 6 111.3670 12.239 6 110.2353 6.774 24 110.2353 6.774 24 254 658 880 0:SP3_SP3_SP3 Ge[6] Si[6] Si 4:4:3:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3) Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 Si(Ge[6]Si[6]2C)(CH3)3 Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3){1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} Si(Ge[6]Si[6]2C)(CH3)3 112.1912 4.186 4 112.1912 17.522 4 111.3670 12.239 6 111.3670 12.239 6 110.2353 6.774 24 110.2353 6.774 24 254 658 880 0:SP3_SP3_SP3 Ge[6] Si[6] Si 4:4:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:Si-4:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(SiC3)2 Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2 Si(Ge[6]Si[6]2Si)(CH3)3 Ge[6](Si[6]Si[6]CC)2(SiC3)2{1|Ge<3>,4|C<4>} Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2{1|Si<4>,1|C<3>,2|C<4>} Si(Ge[6]Si[6]2Si)(CH3)3 108.9575 1.210 4 109.7578 5.519 16 109.7578 5.519 16 109.7578 5.519 16 110.2353 6.774 24 110.2353 6.774 24 254 658 880 0:SP3_SP3_SP3 Ge[6] Si[6] Si 4:4:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:Si-4:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(SiC3)2 Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2 Si(Ge[6]Si[6]2Si)(CH3)3 Ge[6](Si[6]Si[6]CC)2(SiC3)2{1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]Si2)(Si[6]Ge[6]CC)(CH3)2{2|Si<4>,1|C<3>,2|C<4>} Si(Ge[6]Si[6]2Si)(CH3)3 110.0245 2.611 12 109.7578 5.519 16 109.7578 5.519 16 109.7578 5.519 16 110.2353 6.774 24 110.2353 6.774 24 254 658 930 0:SP3_SP2_SP3 Ge[6] Si[6] C 4:4:3:4: 4:4:4:4: 4:3:1: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: Ge[6]-4:C[6a]-3:O-1: Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3) Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 C(Ge[6]Si[6]2Si)(C[6a]C[6a]2)(O) Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3){1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} C(Ge[6]Si[6]2Si)(C[6a]C[6a]2)(O) 105.6745 5.753 4 105.6745 33.098 4 105.6745 33.098 4 105.6745 33.098 4 107.9284 98.758 6 107.9284 98.758 6 254 658 930 0:SP3_SP2_SP3 Ge[6] Si[6] C 4:4:3:4: 4:4:4:4: 4:4:1: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:Si[6]-4:C-4:C-4: C[3x6]-4:Ge[6]-4:O-1: Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3) Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2 C(C[3x6]C[6,6]3)(Ge[6]Si[6]2Si)(O) Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3){1|Ge<4>,4|C<4>} Si[6](Ge[6]Si[6]SiC)(Si[6]Ge[6]CC)(CH3)2{3|Si<4>,2|C<4>} C(C[3x6]C[6,6]3)(Ge[6]Si[6]2Si)(O) 112.4362 18.263 2 112.4362 333.532 2 112.4362 333.532 2 112.4362 333.532 2 107.9284 98.758 6 107.9284 98.758 6 254 762 762 6:SP3_SP2_SP2 Ge[3x6] C[6,6] C[6,6] 4:3:3:3: 4:3:4: 4:3:1: C[3x6]-4:C[6,6]-3:C[6,6]-3:C[6a]-3: Ge[3x6]-4:C[6,6]-3:C[3]-4: Ge[3x6]-4:C[6,6]-3:H-1: Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2) C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C) C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H) Ge[3x6](C[3x6]C[5,3x6]C[6]H)(C[6,6]C[6,6]C[3])(C[6,6]C[6,6]H)(C[6a]C[6a]2){1|Ge<4>,2|H<1>,5|C<4>,6|C<3>} C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C){1|C<4>,1|O<2>,4|H<1>,6|C<3>} C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H){1|H<1>,5|C<3>,5|C<4>} 105.6740 0.000 1 105.6740 0.000 1 105.6740 0.000 1 105.6740 0.000 1 105.6740 0.000 1 107.9840 10.672 2 254 762 762 6:SP3_SP2_SP2 Ge[6] C[6] C[6] 3:3:3:2: 4:3:4: 4:3:4: C[6a]-3:C[6]-3:C[6]-3:O-2: Ge[6]-4:C[6]-3:C-4: Ge[6]-4:C[6]-3:C-4: Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH) C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH) C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH) Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH){1|Ge<4>,2|C<3>,4|C<4>} C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH){1|C<4>,1|O<2>,4|C<3>} C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH){1|C<4>,1|O<2>,4|C<3>} 110.2940 0.000 1 110.2940 0.000 1 110.2940 0.000 1 110.2940 0.000 1 110.2940 0.000 1 107.9840 10.672 2 254 762 856 6:SP3_SP2_SP2 Ge[6] C[6] N[6] 3:3:3:2: 4:4:3: 4:3:3: N[6]-3:C[6]-3:N-3:C-2: Ga[6]-4:Ge[6]-4:C-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC) C[6](Ga[6]S[6]CC)(Ge[6]N[6]CN)(CCH) N[6](Ge[6]C[6]CN)(C[6a]C[6a]2)(C[6]S[6]N) Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC){1|N<3>,1|S<2>,2|C<3>,2|C<4>} C[6](Ga[6]S[6]CC)(Ge[6]N[6]CN)(CCH){2|C<3>} N[6](Ge[6]C[6]CN)(C[6a]C[6a]2)(C[6]S[6]N){1|Ga<4>,2|H<1>,3|C<3>} 111.0810 0.000 1 111.0810 0.000 1 111.0810 0.000 1 111.0810 0.000 1 111.0810 0.000 1 111.0810 0.000 1 254 762 880 0:SP3_SP2_SP3 Ge[6] C[6] Si 4:3:4:4: 3:4:1: 4:4:4:4: Si[6]-4:C[6]-3:Si-4:Si-4: C[6]-3:Ge[6]-4:H-1: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2 C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H) Si(Ge[6]Si[6]C[6]Si)(CH3)3 Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2{1|Ge<4>,1|C<3>,2|C<4>} C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H){1|Ge<4>,1|Si<4>,2|C<4>,3|C<3>} Si(Ge[6]Si[6]C[6]Si)(CH3)3 104.9385 5.453 2 104.9385 29.730 2 104.9385 29.730 2 104.9385 29.730 2 104.9385 29.730 2 104.9385 29.730 2 254 762 893 0:SP3_SP2_SP3 Ge[6] C[6] O 3:3:3:2: 4:3:4: 4:1: C[6a]-3:C[6]-3:C[6]-3:O-2: Ge[6]-4:C[6]-3:C-4: Ge[6]-4:H-1: Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH) C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH) O(Ge[6]C[6a]C[6]2)(H) Ge[6](C[6a]C[6a]2)(C[6]C[6]C)2(OH){1|Ge<4>,2|C<3>,4|C<4>} C[6](Ge[6]C[6a]C[6]O)(C[6]Ge[5,6]C)(CCHH){1|C<4>,1|O<2>,4|C<3>} O(Ge[6]C[6a]C[6]2)(H) 105.0695 0.378 2 105.0695 0.143 2 105.0695 0.143 2 105.0695 0.143 2 105.0695 0.143 2 105.0695 0.143 2 254 762 956 0:SP3_SP2_SP2 Ge[6] C[6] N 3:3:3:2: 4:4:3: 4:4:4: N[6]-3:C[6]-3:N-3:C-2: Ga[6]-4:Ge[6]-4:C-3: Ge[6]-4:C-4:C-4: Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC) C[6](Ga[6]S[6]CC)(Ge[6]N[6]CN)(CCH) N(Ge[6]C[6]N[6]C)(CCHH)2 Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC){1|N<3>,1|S<2>,2|C<3>,2|C<4>} C[6](Ga[6]S[6]CC)(Ge[6]N[6]CN)(CCH){2|C<3>} N(Ge[6]C[6]N[6]C)(CCHH)2 115.3900 0.000 1 115.3900 0.000 1 115.3900 0.000 1 115.3900 0.000 1 115.3900 0.000 1 115.3900 0.000 1 254 762 983 0:SP3_SP1_SP2 Ge[6] C[6] C 3:3:3:2: 4:4:3: 4:2: N[6]-3:C[6]-3:N-3:C-2: Ga[6]-4:Ge[6]-4:C-3: Ge[6]-4:C-2: Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC) C[6](Ga[6]S[6]CC)(Ge[6]N[6]CN)(CCH) C(Ge[6]C[6]N[6]N)(CC) Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC){1|N<3>,1|S<2>,2|C<3>,2|C<4>} C[6](Ga[6]S[6]CC)(Ge[6]N[6]CN)(CCH){2|C<3>} C(Ge[6]C[6]N[6]N)(CC) 116.8160 0.000 1 116.8160 0.000 1 116.8160 0.000 1 116.8160 0.000 1 116.8160 0.000 1 116.8160 0.000 1 254 790 790 0:SP3_SP-NON_SP-NON Ge[6] Cl Cl 3:3:1:1: 4: 4: N[6]-3:N[6]-3:Cl-1:Cl-1: Ge[6]-4: Ge[6]-4: Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2 Cl(Ge[6]N[6]2Cl) Cl(Ge[6]N[6]2Cl) Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2{1|C<3>,2|N<3>} Cl(Ge[6]N[6]2Cl) Cl(Ge[6]N[6]2Cl) 105.2950 0.000 1 105.2950 0.000 1 105.2950 0.000 1 105.2950 0.000 1 105.2950 0.000 1 105.2950 0.000 1 254 790 856 0:SP3_SP-NON_SP2 Ge[6] Cl N[6,6] 3:3:4:1: 4: 4:3:3: N[6,6]-3:N[6]-3:B-4:Cl-1: Ge[6]-4: Ge[6]-4:C[6,6]-3:C[6]-3: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl) Cl(Ge[6]N[6,6]N[6]B) N[6,6](Ge[6]N[6]ClB)(C[6,6]C[6]2)(C[6]C[6]H) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl){1|H<1>,4|C<3>} Cl(Ge[6]N[6,6]N[6]B) N[6,6](Ge[6]N[6]ClB)(C[6,6]C[6]2)(C[6]C[6]H){2|Si<4>,2|C<3>,2|H<1>} 98.7157 0.000 1 98.7157 0.000 1 98.7157 0.000 1 98.7157 0.000 1 98.7157 0.000 1 103.8984 28.372 14 254 790 856 0:SP3_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1:1: 4: 3:4:4: N[6]-3:N[6]-3:Cl-1:S-1: Ge[6]-4: C[6,6a]-3:Ge[6]-4:P-4: Ge[6](N[6]C[6,6a]P)2(Cl)(S) Cl(Ge[6]N[6]2S) N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3) Ge[6](N[6]C[6,6a]P)2(Cl)(S){3|C<3>} Cl(Ge[6]N[6]2S) N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3){1|H<1>,1|P<4>,3|C<3>} 100.7280 1.162 2 100.7280 1.351 2 100.7280 1.351 2 100.7280 1.351 2 104.2971 28.326 13 103.8984 28.372 14 254 790 856 0:SP3_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1:1: 4: 4:3:1: N[6]-3:N[6]-3:Cl-1:Cl-1: Ge[6]-4: Ge[6]-4:C[6]-3:H-1: Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2 Cl(Ge[6]N[6]2Cl) N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(H) Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2{1|C<3>,2|N<3>} Cl(Ge[6]N[6]2Cl) N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(H){1|Ge<4>,1|C<3>,1|H<1>} 112.5145 0.424 2 112.5145 0.179 2 112.5145 0.179 2 112.5145 0.179 2 104.2971 28.326 13 103.8984 28.372 14 254 790 856 0:SP3_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1:1: 4: 4:3:3: N[6]-3:N[6]-3:Cl-1:S-1: Ge[6]-4: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(Cl)(S) Cl(Ge[6]N[6]2S) N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(Cl)(S){2|C<4>,5|C<3>} Cl(Ge[6]N[6]2S) N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 100.5265 1.173 4 100.5265 1.375 4 100.5265 1.375 4 100.3735 0.881 6 104.2971 28.326 13 103.8984 28.372 14 254 790 856 0:SP3_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1:1: 4: 4:3:3: N[6]-3:N[6]-3:Cl-1:Se-1: Ge[6]-4: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(Cl)(Se) Cl(Ge[6]N[6]2Se) N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(Cl)(Se){2|C<4>,5|C<3>} Cl(Ge[6]N[6]2Se) N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 100.0675 0.036 2 100.0675 0.001 2 100.0675 0.001 2 100.3735 0.881 6 104.2971 28.326 13 103.8984 28.372 14 254 790 856 0:SP3_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1:1: 4: 4:3:4: N[6]-3:N[6]-3:Cl-1:Cl-1: Ge[6]-4: Ge[6]-4:C[6]-3:Ge-4: Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2 Cl(Ge[6]N[6]2Cl) N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(GeCl3) Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2{1|C<3>,2|N<3>} Cl(Ge[6]N[6]2Cl) N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(GeCl3){1|C<3>,2|H<1>} 110.2735 2.095 2 110.2735 4.390 2 110.2735 4.390 2 110.2735 4.390 2 104.2971 28.326 13 103.8984 28.372 14 254 790 856 0:SP3_SP-NON_SP2 Ge[6] Cl N[6] 3:3:4:1: 4: 4:3:4: N[6,6]-3:N[6]-3:B-4:Cl-1: Ge[6]-4: Ge[6]-4:C[6]-3:Si-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl) Cl(Ge[6]N[6,6]N[6]B) N[6](Ge[6]N[6,6]ClB)(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl){1|H<1>,4|C<3>} Cl(Ge[6]N[6,6]N[6]B) N[6](Ge[6]N[6,6]ClB)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} 106.5890 0.000 1 106.5890 0.000 1 106.5890 0.000 1 106.5890 0.000 1 104.2971 28.326 13 103.8984 28.372 14 254 790 977 0:SP3_SP-NON_SP-NON Ge[6] Cl S 3:3:1:1: 4: 4: N[6]-3:N[6]-3:Cl-1:S-1: Ge[6]-4: Ge[6]-4: Ge[6](N[6]C[6,6a]P)2(Cl)(S) Cl(Ge[6]N[6]2S) S(Ge[6]N[6]2Cl) Ge[6](N[6]C[6,6a]P)2(Cl)(S){3|C<3>} Cl(Ge[6]N[6]2S) S(Ge[6]N[6]2Cl) 113.4990 0.000 1 113.4990 0.000 1 115.7123 3.674 3 115.7123 3.674 3 115.7123 3.674 3 115.7123 3.674 3 254 790 977 0:SP3_SP-NON_SP-NON Ge[6] Cl S 3:3:1:1: 4: 4: N[6]-3:N[6]-3:Cl-1:S-1: Ge[6]-4: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(Cl)(S) Cl(Ge[6]N[6]2S) S(Ge[6]N[6]2Cl) Ge[6](N[6]C[6a]C[6])2(Cl)(S){2|C<4>,5|C<3>} Cl(Ge[6]N[6]2S) S(Ge[6]N[6]2Cl) 116.8190 0.000 2 116.8190 0.000 2 115.7123 3.674 3 115.7123 3.674 3 115.7123 3.674 3 115.7123 3.674 3 254 813 813 6:SP3_SP2_SP2 Ge[4x6] N[5a,6,6] N[5a,6,6] 3:3:3:3: 3:3:4: 3:3:4: N[5a,6,6]-3:N[5a,6,6]-3:N[5a,6,6]-3:N[5a,6,6]-3: C[5a,6]-3:C[5a,6]-3:Ge[4x6]-4: C[5a,6]-3:C[5a,6]-3:Ge[4x6]-4: Ge[4x6](N[5a,6,6]C[5a,6]2)4 N[5a,6,6](C[5a,6]C[5a,6a]N[6])2(Ge[4x6]N[5a,6,6]3) N[5a,6,6](C[5a,6]C[5a,6a]N[6])2(Ge[4x6]N[5a,6,6]3) Ge[4x6](N[5a,6,6]C[5a,6]2)4{4|N<2>,8|C<3>} N[5a,6,6](C[5a,6]C[5a,6a]N[6])2(Ge[4x6]N[5a,6,6]3){8|C<3>} N[5a,6,6](C[5a,6]C[5a,6a]N[6])2(Ge[4x6]N[5a,6,6]3){8|C<3>} 120.0000 51.962 3 120.0000 2700.022 3 120.0000 2700.022 3 120.0000 2700.022 3 120.0000 2700.022 3 120.0000 2700.022 3 254 818 818 6:SP3_SP2_SP2 Ge[6] C[5,6] C[5,6] 3:3:2:1: 3:4:3: 3:4:3: C[5,6]-3:C[5,6]-3:S-2:S-1: N[5,6]-3:Ge[6]-4:N[5]-3: N[5,6]-3:Ge[6]-4:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]) Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} 91.3469 0.000 1 91.3469 0.000 1 91.3469 0.000 1 91.3469 0.000 1 93.6737 13.423 3 93.6737 13.423 3 254 818 818 6:SP3_SP2_SP2 Ge[6] C[5,6] C[5,6] 3:3:2:1: 4:3:3: 4:3:3: C[5,6]-3:C[5,6]-3:Se-2:Se-1: Ge[6]-4:N[5,6]-3:N[5]-3: Ge[6]-4:N[5,6]-3:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se) C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]) C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]) Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se){1|C<4>,6|C<3>} C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} 91.7772 0.000 1 91.7772 0.000 1 91.7772 0.000 1 91.7772 0.000 1 93.6737 13.423 3 93.6737 13.423 3 254 818 818 6:SP3_SP2_SP2 Ge[6] C[5,6] C[5,6] 3:3:4:1: 3:4:3: 3:4:3: C[5,6]-3:C[5,6]-3:C-4:H-1: N[5,6]-3:Ge[6]-4:N[5]-3: N[5,6]-3:Ge[6]-4:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H) C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C) C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C) Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H){1|B<4>,2|C<4>,4|C<3>} C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C){2|C<3>,2|H<1>,2|N<3>} C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C){2|C<3>,2|H<1>,2|N<3>} 97.8969 0.000 1 97.8969 0.000 1 97.8969 0.000 1 97.8969 0.000 1 93.6737 13.423 3 93.6737 13.423 3 254 818 856 0:SP3_SP2_SP2 Ge[6] C[5] N[6] 3:3:3:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:C[5]-3:O-1: Ge[6]-4:N[5]-3:N[5]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O) C[5](Ge[6]N[6]2O)(N[5]C[5]C)2 N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O){3|C<4>,8|C<3>} C[5](Ge[6]N[6]2O)(N[5]C[5]C)2{2|C<4>,4|C<3>} N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|N<3>,4|C<3>} 106.8218 4.515 4 106.8218 20.389 4 106.8218 20.389 4 106.8218 20.389 4 106.8218 20.389 4 106.8218 20.389 4 254 818 863 0:SP3_SP2_SP2 Ge[6] C[5] O 3:3:3:1: 4:3:3: 4: N[6]-3:N[6]-3:C[5]-3:O-1: Ge[6]-4:N[5]-3:N[5]-3: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O) C[5](Ge[6]N[6]2O)(N[5]C[5]C)2 O(Ge[6]C[5]N[6]2) Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O){3|C<4>,8|C<3>} C[5](Ge[6]N[6]2O)(N[5]C[5]C)2{2|C<4>,4|C<3>} O(Ge[6]C[5]N[6]2) 108.7480 0.368 2 108.7480 0.135 2 108.7480 0.135 2 108.7480 0.135 2 108.7480 0.135 2 108.7480 0.135 2 254 818 909 0:SP3_SP2_SP3 Ge[6] C[5,6] S 3:3:2:1: 3:4:3: 4:4: C[5,6]-3:C[5,6]-3:S-2:S-1: N[5,6]-3:Ge[6]-4:N[5]-3: Ge[6]-4:Ga-4: Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]) S(Ge[6]C[5,6]2S)(GaCl3) Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} S(Ge[6]C[5,6]2S)(GaCl3) 110.9190 0.000 1 110.9190 0.000 1 110.9190 0.000 1 110.9190 0.000 1 110.9190 0.000 1 110.9190 0.000 1 254 818 921 0:SP3_SP2_SP3 Ge[6] C[5,6] Se 3:3:2:1: 4:3:3: 4:4: C[5,6]-3:C[5,6]-3:Se-2:Se-1: Ge[6]-4:N[5,6]-3:N[5]-3: Ge[6]-4:Ga-4: Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se) C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]) Se(Ge[6]C[5,6]2Se)(GaCl3) Ge[6](C[5,6]N[5,6]N[5])2(SeGa)(Se){1|C<4>,6|C<3>} C[5,6](Ge[6]C[5,6]Se2)(N[5,6]C[5]C[6])(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} Se(Ge[6]C[5,6]2Se)(GaCl3) 110.8180 0.000 1 110.8180 0.000 1 110.8180 0.000 1 110.8180 0.000 1 110.8180 0.000 1 110.8180 0.000 1 254 818 951 0:SP3_SP-NON_SP2 Ge[6] C[5,6] H 3:3:4:1: 3:4:3: 4: C[5,6]-3:C[5,6]-3:C-4:H-1: N[5,6]-3:Ge[6]-4:N[5]-3: Ge[6]-4: Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H) C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C) H(Ge[6]C[5,6]2C) Ge[6](C[5,6]N[5,6]N[5])2(CC[6a]3)(H){1|B<4>,2|C<4>,4|C<3>} C[5,6](N[5,6]B[6]C[5])(Ge[6]C[5,6]CH)(N[5]C[5]C){2|C<3>,2|H<1>,2|N<3>} H(Ge[6]C[5,6]2C) 106.4555 0.614 2 106.4555 0.378 2 106.4555 0.378 2 106.4555 0.378 2 106.4555 0.378 2 106.4555 0.378 2 254 818 977 0:SP3_SP-NON_SP2 Ge[6] C[5,6] S 3:3:2:1: 3:4:3: 4: C[5,6]-3:C[5,6]-3:S-2:S-1: N[5,6]-3:Ge[6]-4:N[5]-3: Ge[6]-4: Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]) S(Ge[6]C[5,6]2S) Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]SS)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} S(Ge[6]C[5,6]2S) 113.0080 0.000 1 113.0080 0.000 1 113.0080 0.000 1 113.0080 0.000 1 113.0080 0.000 1 113.0080 0.000 1 254 830 856 0:SP3_SP-NON_SP2 Ge[6] F N[6] 3:3:1:1: 4: 4:3:3: N[6]-3:N[6]-3:F-1:S-1: Ge[6]-4: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(F)(S) F(Ge[6]N[6]2S) N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(F)(S){2|C<4>,5|C<3>} F(Ge[6]N[6]2S) N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 99.3392 0.314 4 99.3392 0.099 4 99.3392 0.099 4 99.3392 0.099 4 99.3392 0.099 4 99.3392 0.099 4 254 830 977 0:SP3_SP-NON_SP-NON Ge[6] F S 3:3:1:1: 4: 4: N[6]-3:N[6]-3:F-1:S-1: Ge[6]-4: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(F)(S) F(Ge[6]N[6]2S) S(Ge[6]N[6]2F) Ge[6](N[6]C[6a]C[6])2(F)(S){2|C<4>,5|C<3>} F(Ge[6]N[6]2S) S(Ge[6]N[6]2F) 116.5650 0.000 2 116.5650 0.000 2 116.5650 0.000 2 116.5650 0.000 2 116.5650 0.000 2 116.5650 0.000 2 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6,6] N[6] 3:3:4:1: 4:3:3: 4:3:4: N[6,6]-3:N[6]-3:B-4:Cl-1: Ge[6]-4:C[6,6]-3:C[6]-3: Ge[6]-4:C[6]-3:Si-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl) N[6,6](Ge[6]N[6]ClB)(C[6,6]C[6]2)(C[6]C[6]H) N[6](Ge[6]N[6,6]ClB)(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BC[6a]3)(Cl){1|H<1>,4|C<3>} N[6,6](Ge[6]N[6]ClB)(C[6,6]C[6]2)(C[6]C[6]H){2|Si<4>,2|C<3>,2|H<1>} N[6](Ge[6]N[6,6]ClB)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} 90.4155 0.000 1 90.4155 0.000 1 90.4155 0.000 1 90.5854 0.058 2 90.5854 0.058 2 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6,6] N[6] 3:3:4:1: 4:3:3: 4:3:4: N[6,6]-3:N[6]-3:B-4:H-1: Ge[6]-4:C[6,6]-3:C[6]-3: Ge[6]-4:C[6]-3:Si-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H) N[6,6](Ge[6]N[6]BH)(C[6,6]C[6]2)(C[6]C[6]H) N[6](Ge[6]N[6,6]BH)(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H){1|H<1>,4|C<3>} N[6,6](Ge[6]N[6]BH)(C[6,6]C[6]2)(C[6]C[6]H){2|Si<4>,2|C<3>,2|H<1>} N[6](Ge[6]N[6,6]BH)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} 90.7552 0.000 1 90.7552 0.000 1 90.7552 0.000 1 90.5854 0.058 2 90.5854 0.058 2 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:1:1: 3:4:4: 3:4:4: N[6]-3:N[6]-3:Cl-1:S-1: C[6,6a]-3:Ge[6]-4:P-4: C[6,6a]-3:Ge[6]-4:P-4: Ge[6](N[6]C[6,6a]P)2(Cl)(S) N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3) N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3) Ge[6](N[6]C[6,6a]P)2(Cl)(S){3|C<3>} N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3){1|H<1>,1|P<4>,3|C<3>} N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3){1|H<1>,1|P<4>,3|C<3>} 93.0010 0.000 1 93.0010 0.000 1 93.0010 0.000 1 93.0010 0.000 1 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:1:1: 4:3:1: 4:3:4: N[6]-3:N[6]-3:Cl-1:Cl-1: Ge[6]-4:C[6]-3:H-1: Ge[6]-4:C[6]-3:Ge-4: Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2 N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(H) N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(GeCl3) Ge[6](N[6]C[6]Ge)(N[6]C[6]H)(Cl)2{1|C<3>,2|N<3>} N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(H){1|Ge<4>,1|C<3>,1|H<1>} N[6](Ge[6]N[6]Cl2)(C[6]C[6]N)(GeCl3){1|C<3>,2|H<1>} 106.0360 0.000 1 106.0360 0.000 1 106.0360 0.000 1 106.0360 0.000 1 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:1:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:Cl-1:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(Cl)(S) N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(Cl)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 98.1808 0.000 2 98.1808 0.000 2 98.1808 0.000 2 97.8935 0.069 5 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:1:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:Cl-1:Se-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(Cl)(Se) N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(Cl)(Se){2|C<4>,5|C<3>} N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 97.7283 0.000 1 97.7283 0.000 1 97.7283 0.000 1 97.8935 0.069 5 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:1:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:F-1:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(F)(S) N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(F)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 97.6889 0.000 2 97.6889 0.000 2 97.6889 0.000 2 97.8935 0.069 5 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:2:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(SH)(S) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(SH)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 95.7926 0.000 1 95.7926 0.000 1 95.3790 0.342 2 95.3790 0.342 2 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:2:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(SP)(S) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(SP)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 94.9654 0.000 1 94.9654 0.000 1 95.3790 0.342 2 95.3790 0.342 2 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:2:2: 4:3:4: 4:3:4: N[6]-3:N[6]-3:O-2:O-2: Ge[6]-4:B[5a]-3:C[6]-4: Ge[6]-4:B[5a]-3:C[6]-4: Ge[6](N[6]B[5a]C[6])2(OC)(OH) N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH) N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH) Ge[6](N[6]B[5a]C[6])2(OC)(OH){1|C<4>,4|H<1>,4|N<3>} N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH){1|B<3>,1|C<4>,2|H<1>,4|C<3>} N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH){1|B<3>,1|C<4>,2|H<1>,4|C<3>} 103.4010 0.000 1 103.4010 0.000 1 103.4010 0.000 1 103.4010 0.000 1 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:3:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:C[5]-3:O-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O) N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O){3|C<4>,8|C<3>} N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|N<3>,4|C<3>} N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|N<3>,4|C<3>} 100.5065 0.050 2 100.5065 0.003 2 100.5065 0.003 2 96.2991 15.558 5 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:3:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 92.8046 0.606 2 92.8046 0.367 2 93.4941 1.610 3 96.2991 15.558 5 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:3:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PSi2)(Se) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PSi2)(Se){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 94.8732 0.000 1 94.8732 0.000 1 93.4941 1.610 3 96.2991 15.558 5 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:3:2: 4:3:3: 4:3:3: N[6]-3:N[6]-3:N-3:N-2: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi) N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi){1|C<4>,6|C<3>} N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 101.5930 0.000 1 101.5930 0.000 1 101.5930 0.000 1 101.5930 0.000 1 97.4471 14.525 18 96.7609 17.460 20 254 856 856 6:SP3_SP2_SP2 Ge[6] N[6] N[6] 3:3:4:1: 4:3:3: 4:3:3: N[6]-3:N[6]-3:C-4:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(CH3)(S) N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(CH3)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 94.1480 0.000 2 94.1480 0.000 2 94.1480 0.000 2 94.1480 0.000 2 97.4471 14.525 18 96.7609 17.460 20 254 856 863 0:SP3_SP2_SP2 Ge[6] N[6] O 3:3:3:1: 4:3:3: 4: N[6]-3:N[6]-3:C[5]-3:O-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O) N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C) O(Ge[6]C[5]N[6]2) Ge[6](N[6]C[6a]C[6])2(C[5]N[5]2)(O){3|C<4>,8|C<3>} N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|N<3>,4|C<3>} O(Ge[6]C[5]N[6]2) 116.5772 2.396 4 116.5772 5.743 4 116.5772 5.743 4 116.5772 5.743 4 116.5772 5.743 4 116.5772 5.743 4 254 856 893 0:SP3_SP2_SP3 Ge[6] N[6] O 3:3:2:2: 4:3:4: 4:1: N[6]-3:N[6]-3:O-2:O-2: Ge[6]-4:B[5a]-3:C[6]-4: Ge[6]-4:H-1: Ge[6](N[6]B[5a]C[6])2(OC)(OH) N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH) O(Ge[6]N[6]2O)(H) Ge[6](N[6]B[5a]C[6])2(OC)(OH){1|C<4>,4|H<1>,4|N<3>} N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH){1|B<3>,1|C<4>,2|H<1>,4|C<3>} O(Ge[6]N[6]2O)(H) 109.4985 5.131 2 109.4985 26.332 2 109.4985 26.332 2 109.4985 26.332 2 111.6453 21.478 4 111.6453 21.478 4 254 856 893 0:SP3_SP2_SP3 Ge[6] N[6] O 3:3:2:2: 4:3:4: 4:4: N[6]-3:N[6]-3:O-2:O-2: Ge[6]-4:B[5a]-3:C[6]-4: Ge[6]-4:C-4: Ge[6](N[6]B[5a]C[6])2(OC)(OH) N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH) O(Ge[6]N[6]2O)(CHHN) Ge[6](N[6]B[5a]C[6])2(OC)(OH){1|C<4>,4|H<1>,4|N<3>} N[6](Ge[6]N[6]OO)(B[5a]N[5a]2)(C[6]C[6]HH){1|B<3>,1|C<4>,2|H<1>,4|C<3>} O(Ge[6]N[6]2O)(CHHN) 113.7920 4.435 2 113.7920 19.669 2 113.7920 19.669 2 113.7920 19.669 2 111.6453 21.478 4 111.6453 21.478 4 254 856 909 0:SP3_SP2_SP3 Ge[6] N[6] S 3:3:2:1: 4:3:3: 4:1: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:H-1: Ge[6](N[6]C[6a]C[6])2(SH)(S) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) S(Ge[6]N[6]2S)(H) Ge[6](N[6]C[6a]C[6])2(SH)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} S(Ge[6]N[6]2S)(H) 101.6285 1.372 2 101.6285 1.884 2 101.6285 1.884 2 101.6285 1.884 2 101.9638 0.893 4 101.9638 0.893 4 254 856 909 0:SP3_SP2_SP3 Ge[6] N[6] S 3:3:2:1: 4:3:3: 4:4: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:P-4: Ge[6](N[6]C[6a]C[6])2(SP)(S) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) S(Ge[6]N[6]2S)(PC[6]2S) Ge[6](N[6]C[6a]C[6])2(SP)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} S(Ge[6]N[6]2S)(PC[6]2S) 102.2990 0.587 2 102.2990 0.344 2 102.2990 0.344 2 102.2990 0.344 2 101.9638 0.893 4 101.9638 0.893 4 254 856 941 0:SP3_SP2_SP2 Ge[6] N[6] N 3:3:3:2: 4:3:3: 4:4: N[6]-3:N[6]-3:N-3:N-2: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:Si-4: Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi) N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C) N(Ge[6]N[6]2N)(SiC3) Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi){1|C<4>,6|C<3>} N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(Ge[6]N[6]2N)(SiC3) 111.7585 0.309 2 111.7585 0.095 2 111.7585 0.095 2 111.7585 0.095 2 111.7585 0.095 2 111.7585 0.095 2 254 856 945 0:SP3_SP2_SP3 Ge[6] N[6] P 3:3:3:1: 4:3:3: 4:4:4: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C[6]-4:C[6]-4: Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) P(Ge[6]N[6]2Se)(C[6]C[6]2H)2 Ge[6](N[6]C[6a]C[6])2(PC[6]2)(Se){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} P(Ge[6]N[6]2Se)(C[6]C[6]2H)2 107.1200 2.744 4 107.1200 7.529 4 107.1200 7.529 4 106.5473 41.909 6 106.5473 41.909 6 106.5473 41.909 6 254 856 945 0:SP3_SP2_SP3 Ge[6] N[6] P 3:3:3:1: 4:3:3: 4:4:4: N[6]-3:N[6]-3:P-3:Se-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:Si-4:Si-4: Ge[6](N[6]C[6a]C[6])2(PSi2)(Se) N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C) P(Ge[6]N[6]2Se)(SiC3)2 Ge[6](N[6]C[6a]C[6])2(PSi2)(Se){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} P(Ge[6]N[6]2Se)(SiC3)2 105.4019 13.529 2 105.4019 183.021 2 105.4019 183.021 2 106.5473 41.909 6 106.5473 41.909 6 106.5473 41.909 6 254 856 951 0:SP3_SP-NON_SP2 Ge[6] N[6,6] H 3:3:4:1: 4:3:3: 4: N[6,6]-3:N[6]-3:B-4:H-1: Ge[6]-4:C[6,6]-3:C[6]-3: Ge[6]-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H) N[6,6](Ge[6]N[6]BH)(C[6,6]C[6]2)(C[6]C[6]H) H(Ge[6]N[6,6]N[6]B) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H){1|H<1>,4|C<3>} N[6,6](Ge[6]N[6]BH)(C[6,6]C[6]2)(C[6]C[6]H){2|Si<4>,2|C<3>,2|H<1>} H(Ge[6]N[6,6]N[6]B) 95.6780 0.000 1 95.6780 0.000 1 95.6780 0.000 1 95.6780 0.000 1 95.6780 0.000 1 98.7455 18.819 2 254 856 951 0:SP3_SP-NON_SP2 Ge[6] N[6] H 3:3:4:1: 4:3:4: 4: N[6,6]-3:N[6]-3:B-4:H-1: Ge[6]-4:C[6]-3:Si-4: Ge[6]-4: Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H) N[6](Ge[6]N[6,6]BH)(C[6]C[6a]C[6])(SiC3) H(Ge[6]N[6,6]N[6]B) Ge[6](N[6,6]C[6,6]C[6])(N[6]C[6]Si)(BH3)(H){1|H<1>,4|C<3>} N[6](Ge[6]N[6,6]BH)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} H(Ge[6]N[6,6]N[6]B) 101.8130 0.000 1 101.8130 0.000 1 101.8130 0.000 1 101.8130 0.000 1 101.8130 0.000 1 98.7455 18.819 2 254 856 956 0:SP3_SP2_SP2 Ge[6] N[6] N 3:3:3:2: 4:3:3: 4:4:1: N[6]-3:N[6]-3:N-3:N-2: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:Si-4:H-1: Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi) N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C) N(Ge[6]N[6]2N)(SiC3)(H) Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi){1|C<4>,6|C<3>} N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(Ge[6]N[6]2N)(SiC3)(H) 110.0105 3.905 2 110.0105 15.252 2 110.0105 15.252 2 110.0105 15.252 2 108.2403 17.026 3 108.2403 17.026 3 254 856 956 0:SP3_SP2_SP2 Ge[6] N[6] N 3:3:3:2: 4:3:3: 4:4:4: N[6]-3:C[6]-3:N-3:C-2: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C-4:C-4: Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC) N[6](Ge[6]C[6]CN)(C[6a]C[6a]2)(C[6]S[6]N) N(Ge[6]C[6]N[6]C)(CCHH)2 Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC){1|N<3>,1|S<2>,2|C<3>,2|C<4>} N[6](Ge[6]C[6]CN)(C[6a]C[6a]2)(C[6]S[6]N){1|Ga<4>,2|H<1>,3|C<3>} N(Ge[6]C[6]N[6]C)(CCHH)2 104.7000 0.000 1 104.7000 0.000 1 104.7000 0.000 1 104.7000 0.000 1 108.2403 17.026 3 108.2403 17.026 3 254 856 977 0:SP3_SP-NON_SP2 Ge[6] N[6] S 3:3:1:1: 3:4:4: 4: N[6]-3:N[6]-3:Cl-1:S-1: C[6,6a]-3:Ge[6]-4:P-4: Ge[6]-4: Ge[6](N[6]C[6,6a]P)2(Cl)(S) N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3) S(Ge[6]N[6]2Cl) Ge[6](N[6]C[6,6a]P)2(Cl)(S){3|C<3>} N[6](C[6,6a]C[6,6a,6a]C[6a])(Ge[6]N[6]ClS)(PC3){1|H<1>,1|P<4>,3|C<3>} S(Ge[6]N[6]2Cl) 122.2490 1.940 2 122.2490 3.765 2 122.2490 3.765 2 122.2490 3.765 2 117.1731 14.862 18 117.1731 14.862 18 254 856 977 0:SP3_SP-NON_SP2 Ge[6] N[6] S 3:3:1:1: 4:3:3: 4: N[6]-3:N[6]-3:Cl-1:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(Cl)(S) N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C) S(Ge[6]N[6]2Cl) Ge[6](N[6]C[6a]C[6])2(Cl)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} S(Ge[6]N[6]2Cl) 118.6055 0.309 4 118.6055 0.095 4 118.6055 0.095 4 119.2327 0.537 8 117.1731 14.862 18 117.1731 14.862 18 254 856 977 0:SP3_SP-NON_SP2 Ge[6] N[6] S 3:3:1:1: 4:3:3: 4: N[6]-3:N[6]-3:F-1:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(F)(S) N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C) S(Ge[6]N[6]2F) Ge[6](N[6]C[6a]C[6])2(F)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} S(Ge[6]N[6]2F) 119.8600 0.329 4 119.8600 0.108 4 119.8600 0.108 4 119.2327 0.537 8 117.1731 14.862 18 117.1731 14.862 18 254 856 977 0:SP3_SP-NON_SP2 Ge[6] N[6] S 3:3:2:1: 4:3:3: 4: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(SH)(S) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) S(Ge[6]N[6]2S) Ge[6](N[6]C[6a]C[6])2(SH)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} S(Ge[6]N[6]2S) 117.2260 1.598 2 117.2260 2.554 2 116.7157 1.259 4 116.7157 1.259 4 117.1731 14.862 18 117.1731 14.862 18 254 856 977 0:SP3_SP-NON_SP2 Ge[6] N[6] S 3:3:2:1: 4:3:3: 4: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(SP)(S) N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C) S(Ge[6]N[6]2S) Ge[6](N[6]C[6a]C[6])2(SP)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} S(Ge[6]N[6]2S) 116.2055 0.428 2 116.2055 0.183 2 116.7157 1.259 4 116.7157 1.259 4 117.1731 14.862 18 117.1731 14.862 18 254 856 977 0:SP3_SP-NON_SP2 Ge[6] N[6] S 3:3:4:1: 4:3:3: 4: N[6]-3:N[6]-3:C-4:S-1: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(CH3)(S) N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C) S(Ge[6]N[6]2C) Ge[6](N[6]C[6a]C[6])2(CH3)(S){2|C<4>,5|C<3>} N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} S(Ge[6]N[6]2C) 110.9730 0.655 4 110.9730 0.429 4 110.9730 0.429 4 110.9730 0.429 4 117.1731 14.862 18 117.1731 14.862 18 254 856 983 0:SP3_SP1_SP2 Ge[6] N[6] C 3:3:3:2: 4:3:3: 4:2: N[6]-3:C[6]-3:N-3:C-2: Ge[6]-4:C[6a]-3:C[6]-3: Ge[6]-4:C-2: Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC) N[6](Ge[6]C[6]CN)(C[6a]C[6a]2)(C[6]S[6]N) C(Ge[6]C[6]N[6]N)(CC) Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC){1|N<3>,1|S<2>,2|C<3>,2|C<4>} N[6](Ge[6]C[6]CN)(C[6a]C[6a]2)(C[6]S[6]N){1|Ga<4>,2|H<1>,3|C<3>} C(Ge[6]C[6]N[6]N)(CC) 99.4597 0.000 1 99.4597 0.000 1 99.4597 0.000 1 99.4597 0.000 1 99.4597 0.000 1 99.4597 0.000 1 254 880 880 0:SP3_SP3_SP3 Ge[6] Si Si 4:3:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:C[6]-3:Si-4:Si-4: Ge[6]-4:C-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2 Si(Ge[6]Si[6]C[6]Si)(CH3)3 Si(Ge[6]Si[6]C[6]Si)(CH3)3 Ge[6](Si[6]Si[6]CC)(C[6]C[6]H)(SiC3)2{1|Ge<4>,1|C<3>,2|C<4>} Si(Ge[6]Si[6]C[6]Si)(CH3)3 Si(Ge[6]Si[6]C[6]Si)(CH3)3 111.2830 0.000 1 111.2830 0.000 1 111.2830 0.000 1 111.2830 0.000 1 107.8918 5.704 5 107.8918 5.704 5 254 880 880 0:SP3_SP3_SP3 Ge[6] Si Si 4:4:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:Si-4:Si-4: Ge[6]-4:C-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(SiC3)2 Si(Ge[6]Si[6]2Si)(CH3)3 Si(Ge[6]Si[6]2Si)(CH3)3 Ge[6](Si[6]Si[6]CC)2(SiC3)2{1|Ge<3>,4|C<4>} Si(Ge[6]Si[6]2Si)(CH3)3 Si(Ge[6]Si[6]2Si)(CH3)3 108.5290 0.000 1 107.0440 2.814 4 107.0440 2.814 4 107.0440 2.814 4 107.8918 5.704 5 107.8918 5.704 5 254 880 880 0:SP3_SP3_SP3 Ge[6] Si Si 4:4:4:4: 4:4:4:4: 4:4:4:4: Si[6]-4:Si[6]-4:Si-4:Si-4: Ge[6]-4:C-4:C-4:C-4: Ge[6]-4:C-4:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(SiC3)2 Si(Ge[6]Si[6]2Si)(CH3)3 Si(Ge[6]Si[6]2Si)(CH3)3 Ge[6](Si[6]Si[6]CC)2(SiC3)2{1|Ge<4>,4|C<4>} Si(Ge[6]Si[6]2Si)(CH3)3 Si(Ge[6]Si[6]2Si)(CH3)3 106.5490 1.658 3 107.0440 2.814 4 107.0440 2.814 4 107.0440 2.814 4 107.8918 5.704 5 107.8918 5.704 5 254 880 930 0:SP3_SP2_SP3 Ge[6] Si C 4:4:3:4: 4:4:4:4: 4:3:1: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:C-4:C-4:C-4: Ge[6]-4:C[6a]-3:O-1: Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3) Si(Ge[6]Si[6]2C)(CH3)3 C(Ge[6]Si[6]2Si)(C[6a]C[6a]2)(O) Ge[6](Si[6]Si[6]CC)2(CC[6a]O)(SiC3){1|Ge<4>,4|C<4>} Si(Ge[6]Si[6]2C)(CH3)3 C(Ge[6]Si[6]2Si)(C[6a]C[6a]2)(O) 110.0265 0.941 2 110.0265 0.886 2 110.0265 0.886 2 110.0265 0.886 2 106.7270 33.103 3 106.7270 33.103 3 254 880 930 0:SP3_SP2_SP3 Ge[6] Si C 4:4:3:4: 4:4:4:4: 4:4:1: Si[6]-4:Si[6]-4:C-3:Si-4: Ge[6]-4:C-4:C-4:C-4: C[3x6]-4:Ge[6]-4:O-1: Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3) Si(Ge[6]Si[6]2C)(CH3)3 C(C[3x6]C[6,6]3)(Ge[6]Si[6]2Si)(O) Ge[6](Si[6]Si[6]CC)2(CC[3x6]O)(SiC3){1|Ge<4>,4|C<4>} Si(Ge[6]Si[6]2C)(CH3)3 C(C[3x6]C[6,6]3)(Ge[6]Si[6]2Si)(O) 100.1280 0.000 1 100.1280 0.000 1 100.1280 0.000 1 100.1280 0.000 1 106.7270 33.103 3 106.7270 33.103 3 254 892 893 0:SP3_SP2_SP3 Ge[6] N O 3:2:2:4: 4:1:1:1: 4:3: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6]-4:H-1:H-1:H-1: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) N(Ge[6]Ge[6]O[6]O)(H)3 O(Ge[6]Ge[6]O[6]N)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} N(Ge[6]Ge[6]O[6]O)(H)3 O(Ge[6]Ge[6]O[6]N)(C[6a]C[6a]2) 97.8816 0.000 1 97.8816 0.000 1 97.8816 0.000 1 97.8816 0.000 1 97.8816 0.000 1 97.8816 0.000 1 254 893 893 0:SP3_SP2_SP2 Ge[6] O O 3:2:2:2: 4:3: 4:3: Ge[6]-3:O[6]-2:O-2:O-2: Ge[6]-4:C[6a]-3: Ge[6]-4:C[6a]-3: Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2 O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2{1|Ge<3>,1|N<4>,6|O<2>} O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) O(Ge[6]Ge[6]O[6]O)(C[6a]C[6a]2) 106.6380 0.000 1 106.6380 0.000 1 106.6380 0.000 1 106.6380 0.000 1 106.6380 0.000 1 106.6380 0.000 1 254 893 893 0:SP3_SP3_SP3 Ge[6] O O 3:3:2:2: 4:4: 4:1: N[6]-3:N[6]-3:O-2:O-2: Ge[6]-4:C-4: Ge[6]-4:H-1: Ge[6](N[6]B[5a]C[6])2(OC)(OH) O(Ge[6]N[6]2O)(CHHN) O(Ge[6]N[6]2O)(H) Ge[6](N[6]B[5a]C[6])2(OC)(OH){1|C<4>,4|H<1>,4|N<3>} O(Ge[6]N[6]2O)(CHHN) O(Ge[6]N[6]2O)(H) 106.9500 0.000 1 106.9500 0.000 1 106.9500 0.000 1 106.9500 0.000 1 106.9500 0.000 1 106.9500 0.000 1 254 909 977 0:SP3_SP-NON_SP3 Ge[6] S S 3:3:2:1: 4:1: 4: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:H-1: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(SH)(S) S(Ge[6]N[6]2S)(H) S(Ge[6]N[6]2S) Ge[6](N[6]C[6a]C[6])2(SH)(S){2|C<4>,5|C<3>} S(Ge[6]N[6]2S)(H) S(Ge[6]N[6]2S) 119.4870 0.000 1 119.4870 0.000 1 119.4870 0.000 1 119.4870 0.000 1 118.5247 8.459 3 118.5247 8.459 3 254 909 977 0:SP3_SP-NON_SP3 Ge[6] S S 3:3:2:1: 4:4: 4: C[5,6]-3:C[5,6]-3:S-2:S-1: Ge[6]-4:Ga-4: Ge[6]-4: Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S) S(Ge[6]C[5,6]2S)(GaCl3) S(Ge[6]C[5,6]2S) Ge[6](C[5,6]N[5,6]N[5])2(SGa)(S){1|C<4>,6|C<3>} S(Ge[6]C[5,6]2S)(GaCl3) S(Ge[6]C[5,6]2S) 115.2570 0.000 1 115.2570 0.000 1 115.2570 0.000 1 118.0435 15.529 2 118.5247 8.459 3 118.5247 8.459 3 254 909 977 0:SP3_SP-NON_SP3 Ge[6] S S 3:3:2:1: 4:4: 4: N[6]-3:N[6]-3:S-2:S-1: Ge[6]-4:P-4: Ge[6]-4: Ge[6](N[6]C[6a]C[6])2(SP)(S) S(Ge[6]N[6]2S)(PC[6]2S) S(Ge[6]N[6]2S) Ge[6](N[6]C[6a]C[6])2(SP)(S){2|C<4>,5|C<3>} S(Ge[6]N[6]2S)(PC[6]2S) S(Ge[6]N[6]2S) 120.8300 0.000 1 120.8300 0.000 1 120.8300 0.000 1 118.0435 15.529 2 118.5247 8.459 3 118.5247 8.459 3 254 941 956 0:SP3_SP2_SP2 Ge[6] N N 3:3:3:2: 4:4: 4:4:1: N[6]-3:N[6]-3:N-3:N-2: Ge[6]-4:Si-4: Ge[6]-4:Si-4:H-1: Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi) N(Ge[6]N[6]2N)(SiC3) N(Ge[6]N[6]2N)(SiC3)(H) Ge[6](N[6]C[6a]C[6])2(NSiH)(NSi){1|C<4>,6|C<3>} N(Ge[6]N[6]2N)(SiC3) N(Ge[6]N[6]2N)(SiC3)(H) 111.2410 0.000 1 111.2410 0.000 1 111.2410 0.000 1 111.2410 0.000 1 111.2410 0.000 1 111.2410 0.000 1 254 956 983 0:SP3_SP1_SP2 Ge[6] N C 3:3:3:2: 4:4:4: 4:2: N[6]-3:C[6]-3:N-3:C-2: Ge[6]-4:C-4:C-4: Ge[6]-4:C-2: Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC) N(Ge[6]C[6]N[6]C)(CCHH)2 C(Ge[6]C[6]N[6]N)(CC) Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC){1|N<3>,1|S<2>,2|C<3>,2|C<4>} N(Ge[6]C[6]N[6]C)(CCHH)2 C(Ge[6]C[6]N[6]N)(CC) 107.6090 0.000 1 107.6090 0.000 1 107.6090 0.000 1 107.6090 0.000 1 107.6090 0.000 1 107.6090 0.000 1 262 74 74 4:SP1_SP2_SP2 Ge[4] N[4] N[4] 3:3: 3:2:2: 3:2:2: N[4]-3:N[4]-3: C[6a]-3:Ge[4]-2:Ge[4]-2: C[6a]-3:Ge[4]-2:Ge[4]-2: Ge[4](N[4]C[6a]Ge[4])2 N[4](C[6a]C[6a]2)(Ge[4]N[4])2 N[4](C[6a]C[6a]2)(Ge[4]N[4])2 Ge[4](N[4]C[6a]Ge[4])2{4|C<3>} N[4](C[6a]C[6a]2)(Ge[4]N[4])2{5|C<3>} N[4](C[6a]C[6a]2)(Ge[4]N[4])2{5|C<3>} 81.1638 0.217 2 81.1638 0.047 2 81.1638 0.047 2 81.1638 0.047 2 79.7104 25.120 8 79.7104 25.120 8 262 74 74 4:SP1_SP2_SP2 Ge[4] N[4] N[4] 3:3: 3:3:2: 3:3:2: N[4]-3:N[4]-3: C[6a]-3:C[4]-3:Ge[4]-2: C[6a]-3:C[4]-3:Ge[4]-2: Ge[4](N[4]C[6a]C[4])2 N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]) N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]) Ge[4](N[4]C[6a]C[4])2{1|N<3>,4|C<3>} N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]){2|C<4>,3|C<3>} N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]){2|C<4>,3|C<3>} 67.4723 0.000 1 67.4723 0.000 1 67.4723 0.000 1 67.4723 0.000 1 79.7104 25.120 8 79.7104 25.120 8 262 74 74 4:SP1_SP2_SP2 Ge[4] N[4] N[4] 3:3: 4:2:4: 4:2:4: N[4]-3:N[4]-3: Si[4]-4:Ge[4]-2:C-4: Si[4]-4:Ge[4]-2:C-4: Ge[4](N[4]Si[4]C)2 N[4](Si[4]N[4]CC)(Ge[4]N[4])(CC3) N[4](Si[4]N[4]CC)(Ge[4]N[4])(CC3) Ge[4](N[4]Si[4]C)2{2|C<4>} N[4](Si[4]N[4]CC)(Ge[4]N[4])(CC3){1|C<4>} N[4](Si[4]N[4]CC)(Ge[4]N[4])(CC3){1|C<4>} 81.4150 0.123 2 81.4150 0.015 2 81.4150 0.015 2 82.0465 1.204 3 79.7104 25.120 8 79.7104 25.120 8 262 74 74 4:SP1_SP2_SP2 Ge[4] N[4] N[4] 3:3: 4:2:4: 4:2:4: N[4]-3:N[4]-3: Si[4]-4:Ge[4]-2:Si-4: Si[4]-4:Ge[4]-2:Si-4: Ge[4](N[4]Si[4]Si)2 N[4](Si[4]N[4]CC)(Ge[4]N[4])(SiC[6a]3) N[4](Si[4]N[4]CC)(Ge[4]N[4])(SiC[6a]3) Ge[4](N[4]Si[4]Si)2{2|C<4>} N[4](Si[4]N[4]CC)(Ge[4]N[4])(SiC[6a]3){1|Si<4>} N[4](Si[4]N[4]CC)(Ge[4]N[4])(SiC[6a]3){1|Si<4>} 83.3094 0.000 1 83.3094 0.000 1 83.3094 0.000 1 82.0465 1.204 3 79.7104 25.120 8 79.7104 25.120 8 262 74 74 4:SP1_SP2_SP2 Ge[4] N[4] N[4] 3:3: 4:3:2: 4:3:2: N[4]-3:N[4]-3: Si[4]-4:C[6a]-3:Ge[4]-2: Si[4]-4:C[6a]-3:Ge[4]-2: Ge[4](N[4]C[6a]Si[4])2 N[4](Si[4]C[6a]2N[4])(C[6a]C[6a]2)(Ge[4]N[4]) N[4](Si[4]C[6a]2N[4])(C[6a]C[6a]2)(Ge[4]N[4]) Ge[4](N[4]C[6a]Si[4])2{6|C<3>} N[4](Si[4]C[6a]2N[4])(C[6a]C[6a]2)(Ge[4]N[4]){2|C<4>,7|C<3>} N[4](Si[4]C[6a]2N[4])(C[6a]C[6a]2)(Ge[4]N[4]){2|C<4>,7|C<3>} 80.4739 0.000 1 80.4739 0.000 1 80.8718 0.317 2 80.8718 0.317 2 79.7104 25.120 8 79.7104 25.120 8 262 74 74 4:SP1_SP2_SP2 Ge[4] N[4] N[4] 3:3: 4:3:2: 4:3:2: N[4]-3:N[4]-3: Si[4]-4:C[6a]-3:Ge[4]-2: Si[4]-4:C[6a]-3:Ge[4]-2: Ge[4](N[4]C[6a]Si[4])2 N[4](Si[4]N[4]CC)(C[6a]C[6a]2)(Ge[4]N[4]) N[4](Si[4]N[4]CC)(C[6a]C[6a]2)(Ge[4]N[4]) Ge[4](N[4]C[6a]Si[4])2{2|C<4>,4|C<3>} N[4](Si[4]N[4]CC)(C[6a]C[6a]2)(Ge[4]N[4]){2|C<4>,3|C<3>} N[4](Si[4]N[4]CC)(C[6a]C[6a]2)(Ge[4]N[4]){2|C<4>,3|C<3>} 81.2697 0.000 1 81.2697 0.000 1 80.8718 0.317 2 80.8718 0.317 2 79.7104 25.120 8 79.7104 25.120 8 262 74 74 4:SP1_SP2_SP3 Ge[4] N[4] N[4] 3:3: 3:3:2: 3:2:4: N[4]-3:N[4]-3: P[4]-3:C[6a]-3:Ge[4]-2: P[4]-3:Ge[4]-2:C-4: Ge[4](N[4]C[6a]P[4])(N[4]P[4]C) N[4](P[4]C[6a]N[4])(C[6a]C[6a]2)(Ge[4]N[4]) N[4](P[4]C[6a]N[4])(Ge[4]N[4])(CC3) Ge[4](N[4]C[6a]P[4])(N[4]P[4]C){3|C<3>} N[4](P[4]C[6a]N[4])(C[6a]C[6a]2)(Ge[4]N[4]){3|C<4>,4|C<3>} N[4](P[4]C[6a]N[4])(Ge[4]N[4])(CC3){3|C<3>} 77.3892 0.000 1 77.3892 0.000 1 77.3892 0.000 1 77.3892 0.000 1 73.9219 78.772 3 73.9219 78.772 3 262 74 74 4:SP1_SP2_SP3 Ge[4] N[4] N[4] 3:3: 3:3:2: 3:3:2: N[4]-3:N[4]-3: C[6a]-3:C[4]-3:Ge[4]-2: C[6a]-3:C[4]-3:Ge[4]-2: Ge[4](N[4]C[6a]C[4])2 N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]) N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]) Ge[4](N[4]C[6a]C[4])2{1|N<3>,4|C<3>} N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]){2|C<4>,3|C<3>} N[4](C[6a]C[6a]2)(C[4]N[4]N)(Ge[4]N[4]){2|C<4>,3|C<3>} 63.8363 0.000 1 63.8363 0.000 1 63.8363 0.000 1 63.8363 0.000 1 73.9219 78.772 3 73.9219 78.772 3 262 74 74 4:SP1_SP2_SP3 Ge[4] N[4] N[4] 3:3: 4:3:2: 4:2:4: N[4]-3:N[4]-3: Si[4]-4:C[5]-3:Ge[4]-2: Si[4]-4:Ge[4]-2:Si-4: Ge[4](N[4]Si[4]C[5])(N[4]Si[4]Si) N[4](Si[4]N[4]CC)(C[5]N[5]2)(Ge[4]N[4]) N[4](Si[4]N[4]CC)(Ge[4]N[4])(SiC3) Ge[4](N[4]Si[4]C[5])(N[4]Si[4]Si){2|C<4>,2|N<3>} N[4](Si[4]N[4]CC)(C[5]N[5]2)(Ge[4]N[4]){1|Si<4>,4|C<3>} N[4](Si[4]N[4]CC)(Ge[4]N[4])(SiC3){1|C<3>} 80.5402 0.000 1 80.5402 0.000 1 80.5402 0.000 1 80.5402 0.000 1 73.9219 78.772 3 73.9219 78.772 3 262 634 857 4:SP1_SP2_SP3 Ge[4,5,6] Ge[3,4,4,3x5,6] Ge[4,4x5,6] 4:3: 4:4:3:2: 4:3:2: Ge[3,4,4,3x5,6]-4:Ge[4,4x5,6]-3: Ge[3x3,4,5,6]-4:Ge[3,3,4,4x5]-4:Ge[3,4,3x5]-3:Ge[4,5,6]-2: Ge[3,3,4,4x5]-4:Ge[3,4x5,6]-3:Ge[4,5,6]-2: Ge[4,5,6](Ge[3,4,4,3x5,6]Ge[3,3,4,4x5]Ge[3x3,4,5,6]Ge[3,4,3x5])(Ge[4,4x5,6]Ge[3,3,4,4x5]Ge[3,4x5,6]) Ge[3,4,4,3x5,6](Ge[3x3,4,5,6]Ge[3,3,4,3x5,6]Ge[3,3,4,4x5]Ge[3,3,5,5])(Ge[3,3,4,4x5]Ge[3x3,4,5,6]Ge[3,3,5,5]Ge[4,4x5,6])(Ge[3,4,3x5]Ge[3,3,4,3x5,6]Ge[3,4x5,6])(Ge[4,5,6]Ge[4,4x5,6]) Ge[4,4x5,6](Ge[3,3,4,4x5]Ge[3,4,4,3x5,6]Ge[3x3,4,5,6]Ge[3,3,5,5])(Ge[3,4x5,6]Ge[3,3,4,3x5,6]Ge[3,4,3x5])(Ge[4,5,6]Ge[3,4,4,3x5,6]) Ge[4,5,6](Ge[3,4,4,3x5,6]Ge[3,3,4,4x5]Ge[3x3,4,5,6]Ge[3,4,3x5])(Ge[4,4x5,6]Ge[3,3,4,4x5]Ge[3,4x5,6]){1|Ge<3>,1|Ge<4>} Ge[3,4,4,3x5,6](Ge[3x3,4,5,6]Ge[3,3,4,3x5,6]Ge[3,3,4,4x5]Ge[3,3,5,5])(Ge[3,3,4,4x5]Ge[3x3,4,5,6]Ge[3,3,5,5]Ge[4,4x5,6])(Ge[3,4,3x5]Ge[3,3,4,3x5,6]Ge[3,4x5,6])(Ge[4,5,6]Ge[4,4x5,6]) Ge[4,4x5,6](Ge[3,3,4,4x5]Ge[3,4,4,3x5,6]Ge[3x3,4,5,6]Ge[3,3,5,5])(Ge[3,4x5,6]Ge[3,3,4,3x5,6]Ge[3,4,3x5])(Ge[4,5,6]Ge[3,4,4,3x5,6]) 111.1480 0.000 1 111.1480 0.000 1 111.1480 0.000 1 111.1480 0.000 1 111.1480 0.000 1 111.1480 0.000 1 262 634 907 5:SP1_SP3_SP3 Ge[4,5,5,6,6] Ge[3,4,4,3x5,4x6] Ge[3x4,4x5,4x6] 4:4: 4:4:3:2: 3:3:3:2: Ge[3,4,4,3x5,4x6]-4:Ge[3x4,4x5,4x6]-4: Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2: Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Ge[3,4,3x5,6,6]-3:Ge[4,5,5,6,6]-2: Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]) Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6]) Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6]) Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]){2|Ge<4>} Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6]){1|Ge<3>,2|Ge<4>} Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6]){1|Ge<4>} 110.4420 0.000 1 110.4420 0.000 1 110.4420 0.000 1 110.4420 0.000 1 110.4420 0.000 1 110.4420 0.000 1 262 634 982 6:SP1_SP3_SPD5 Ge[4,5,3x6] Ge[3,4,4,5,5,4x6] Ge[3,4,4,5,5,4x6] 5:4: 4:4:2:2: 4:4:2:2:3: Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4: Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2: Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3: Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]) Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2 Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH) Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]){1|Ge<5>} Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2{1|Ge<2>,2|C<3>} Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>} 105.2340 0.344 2 105.2340 0.118 2 105.2340 0.118 2 105.2340 0.118 2 105.2340 0.118 2 105.2340 0.118 2 262 686 686 4:SP1_SPD5_SPD5 Ge[4,5,5,6,6] Ge[4,4,4x5,5x6] Ge[4,4,4x5,5x6] 5:5: 3:3:2:2:4: 3:3:2:2:4: Ge[4,4,4x5,5x6]-5:Ge[4,4,4x5,5x6]-5: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2:Si-4: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2:Si-4: Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]Si)2 Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3) Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3) Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]Si)2{1|Ge<5>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3){2|Si<4>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3){2|Si<4>} 96.0944 0.000 1 96.0944 0.000 1 96.0944 0.000 1 96.0944 0.000 1 96.0944 0.000 1 96.0944 0.000 1 262 686 686 5:SP1_SPD5_SPD5 Ge[4,5,5,6,6] Ge[4,4,4x5,5x6] Ge[4,4,4x5,5x6] 5:5: 3:3:2:2:4: 3:3:2:2:4: Ge[4,4,4x5,5x6]-5:Ge[4,4,4x5,5x6]-5: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2:Si-4: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2:Si-4: Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]Si)2 Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3) Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3) Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]Si)2{1|Ge<5>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3){2|Si<4>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3){2|Si<4>} 96.6435 0.000 1 96.6435 0.000 1 96.6435 0.000 1 96.6435 0.000 1 96.6435 0.000 1 96.6435 0.000 1 262 686 686 6:SP1_SPD5_SPD5 Ge[4,5,5,6,6] Ge[4,4,4x5,5x6] Ge[4,4,4x5,5x6] 5:5: 3:3:2:2:4: 3:3:2:2:4: Ge[4,4,4x5,5x6]-5:Ge[4,4,4x5,5x6]-5: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2:Si-4: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2:Si-4: Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]Si)2 Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3) Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3) Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]Si)2{1|Ge<5>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3){2|Si<4>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2(SiSi3){2|Si<4>} 98.0524 0.605 2 98.0524 0.367 2 98.0524 0.367 2 98.0524 0.367 2 98.0524 0.367 2 98.0524 0.367 2 262 686 907 4:SP1_SP3_SPD5 Ge[4,5,5,6,6] Ge[4,4,4x5,5x6] Ge[4,4,4x5,5x6] 5:4: 5:3:3:2:2: 3:3:2:2: Ge[4,4,4x5,5x6]-5:Ge[4,4,4x5,5x6]-4: Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2: Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,4,4x5,5x6]Ge[4,5,5,6,6])(Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]) Ge[4,4,4x5,5x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]2)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2 Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2 Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,4,4x5,5x6]Ge[4,5,5,6,6])(Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]){1|Ge<4>,2|Ge<2>,2|Ge<3>} Ge[4,4,4x5,5x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]2)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2{2|Ge<3>,2|Ge<4>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2{1|Ge<5>} 105.0570 0.000 1 105.0570 0.000 1 105.0570 0.000 1 105.0570 0.000 1 105.0570 0.000 1 105.0570 0.000 1 262 686 907 6:SP1_SP3_SPD5 Ge[4,5,5,6,6] Ge[4,4,4x5,5x6] Ge[4,4,4x5,5x6] 5:4: 5:3:3:2:2: 3:3:2:2: Ge[4,4,4x5,5x6]-5:Ge[4,4,4x5,5x6]-4: Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2: Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2: Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,4,4x5,5x6]Ge[4,5,5,6,6])(Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]) Ge[4,4,4x5,5x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]2)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2 Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2 Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,4,4x5,5x6]Ge[4,5,5,6,6])(Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]){1|Ge<4>,2|Ge<2>,2|Ge<3>} Ge[4,4,4x5,5x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]2Ge[4,5,5,6,6]2)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2{2|Ge<3>,2|Ge<4>} Ge[4,4,4x5,5x6](Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])2(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2{1|Ge<5>} 105.5340 0.000 1 105.5340 0.000 1 105.5340 0.000 1 105.5340 0.000 1 105.5340 0.000 1 105.5340 0.000 1 262 686 982 4:SP1_SPD5_SPD5 Ge[4,5,5,6,6] Ge[3x4,4x5,4x6] Ge[3,4,4,3x5,4x6] 5:5: 3:3:3:2:4: 4:3:3:2:4: Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5: Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Ge[3,4,3x5,6,6]-3:Ge[4,5,5,6,6]-2:Si-4: Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4: Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si) Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6])(SiSi3) Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C) Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>} Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6])(SiSi3){2|Si<4>} Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>} 95.8771 0.000 1 95.8771 0.000 1 95.8771 0.000 1 95.8771 0.000 1 95.8771 0.000 1 95.8771 0.000 1 262 686 982 5:SP1_SPD5_SPD5 Ge[4,5,5,6,6] Ge[3x4,4x5,4x6] Ge[3,4,4,3x5,4x6] 5:5: 3:3:3:2:4: 4:3:3:2:4: Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5: Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Ge[3,4,3x5,6,6]-3:Ge[4,5,5,6,6]-2:Si-4: Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4: Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si) Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6])(SiSi3) Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3) Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>} Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6])(SiSi3){2|Si<4>} Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>} 95.4711 0.000 1 95.4711 0.000 1 95.4711 0.000 1 95.4711 0.000 1 95.4711 0.000 1 95.4711 0.000 1 262 686 982 6:SP1_SPD5_SPD5 Ge[4,5,5,6,6] Ge[3x4,4x5,4x6] Ge[3,4,4,3x5,4x6] 5:5: 3:3:3:2:4: 5:4:3:2:4: Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5: Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Ge[3,4,3x5,6,6]-3:Ge[4,5,5,6,6]-2:Si-4: Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4: Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si) Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6])(SiSi3) Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH) Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<4>,2|Si<4>} Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6])(SiSi3){2|Si<4>,1|C<4>} Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>} 97.9311 0.257 2 97.9311 0.066 2 97.9311 0.066 2 97.9311 0.066 2 97.9311 0.066 2 97.9311 0.066 2 262 857 857 4:SP1_SP2_SP2 Ge[4,4] Ge[3x4] Ge[3x4] 3:3: 2:2:2: 2:2:2: Ge[3x4]-3:Ge[3x4]-3: Ge[4,4]-2:Ge[4,4]-2:Ge[4,4]-2: Ge[4,4]-2:Ge[4,4]-2:Ge[4,4]-2: Ge[4,4](Ge[3x4]Ge[4,4]2)2 Ge[3x4](Ge[4,4]Ge[3x4])3 Ge[3x4](Ge[4,4]Ge[3x4])3 Ge[4,4](Ge[3x4]Ge[4,4]2)2 Ge[3x4](Ge[4,4]Ge[3x4])3 Ge[3x4](Ge[4,4]Ge[3x4])3 102.9826 0.585 9 102.9826 0.343 9 102.9826 0.343 9 102.9826 0.343 9 102.9826 0.343 9 91.9411 297.615 13 262 857 857 4:SP1_SP2_SP2 Ge[4] Ge[4,4] Ge[4,4] 3:3: 4:2:2: 4:2:2: Ge[4,4]-3:Ge[4,4]-3: Ge[4x4]-4:Ge[4]-2:Ge[4]-2: Ge[4x4]-4:Ge[4]-2:Ge[4]-2: Ge[4](Ge[4,4]Ge[4x4]Ge[4])2 Ge[4,4](Ge[4x4]Ge[4,4]3)(Ge[4]Ge[4,4])2 Ge[4,4](Ge[4x4]Ge[4,4]3)(Ge[4]Ge[4,4])2 Ge[4](Ge[4,4]Ge[4x4]Ge[4])2{2|Ge<3>} Ge[4,4](Ge[4x4]Ge[4,4]3)(Ge[4]Ge[4,4])2{2|Ge<2>} Ge[4,4](Ge[4x4]Ge[4,4]3)(Ge[4]Ge[4,4])2{2|Ge<2>} 67.0978 0.942 4 67.0978 0.888 4 67.0978 0.888 4 67.0978 0.888 4 67.0978 0.888 4 91.9411 297.615 13 262 857 907 4:SP1_SP2_SP3 Ge[4] Ge[4] Ge[4,4] 4:3: 4:2:3: 4:3:2:3: Ge[4,4]-4:Ge[4]-3: Ge[4,4]-4:Ge[4]-2:N-3: Ge[4,4]-4:Ge[4]-3:Ge[4]-2:N-3: Ge[4](Ge[4,4]Ge[4,4]Ge[4]N)(Ge[4]Ge[4,4]N) Ge[4](Ge[4,4]Ge[4,4]Ge[4]N)(Ge[4]Ge[4,4])(NC[6a]Si) Ge[4,4](Ge[4,4]Ge[4]2N)(Ge[4]Ge[4]N)(Ge[4]Ge[4])(NC[6a]Si) Ge[4](Ge[4,4]Ge[4,4]Ge[4]N)(Ge[4]Ge[4,4]N){1|Ge<2>,2|N<3>} Ge[4](Ge[4,4]Ge[4,4]Ge[4]N)(Ge[4]Ge[4,4])(NC[6a]Si){1|Ge<3>,1|N<3>} Ge[4,4](Ge[4,4]Ge[4]2N)(Ge[4]Ge[4]N)(Ge[4]Ge[4])(NC[6a]Si){1|N<3>} 78.6402 0.000 1 78.6402 0.000 1 78.6402 0.000 1 78.6402 0.000 1 78.6402 0.000 1 78.6402 0.000 1 262 907 907 5:SP1_SP3_SP3 Ge[4,5,5,6,6] Ge[4,4,4x5,5x6] Ge[4,4,4x5,5x6] 4:4: 4:4:2:2: 4:3:2:2: Ge[4,4,4x5,5x6]-4:Ge[4,4,4x5,5x6]-4: Ge[3,4,4,5,5,3x6]-4:Ge[3,4,5,5,3x6]-4:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2: Ge[3,4,4,5,5,3x6]-4:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Ge[4,5,5,6,6]-2: Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])2 Ge[4,4,4x5,5x6](Ge[3,4,4,5,5,3x6]Ge[3,4,4,5,5,3x6]2Ge[3,3,4,4,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]2)(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2 Ge[4,4,4x5,5x6](Ge[3,4,4,5,5,3x6]Ge[3,4,4,5,5,3x6]2Ge[3,3,4,4,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2 Ge[4,5,5,6,6](Ge[4,4,4x5,5x6]Ge[3,4,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])2{4|Ge<4>} Ge[4,4,4x5,5x6](Ge[3,4,4,5,5,3x6]Ge[3,4,4,5,5,3x6]2Ge[3,3,4,4,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]2)(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2{1|Ge<3>,5|Ge<4>} Ge[4,4,4x5,5x6](Ge[3,4,4,5,5,3x6]Ge[3,4,4,5,5,3x6]2Ge[3,3,4,4,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[4,4,4x5,5x6])2{4|Ge<4>} 112.2395 0.128 2 112.2395 0.016 2 112.2395 0.016 2 112.2395 0.016 2 112.2395 0.016 2 112.2395 0.016 2 262 907 982 4:SP1_SP3_SPD5 Ge[4,5,5,6,6] Ge[3x4,4x5,4x6] Ge[3,4,4,3x5,4x6] 5:4: 3:3:3:2: 4:3:3:2:3: Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-4: Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Ge[3,4,3x5,6,6]-3:Ge[4,5,5,6,6]-2: Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3: Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]) Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6]) Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2) Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]){1|Ge<5>,2|C<3>} Ge[3x4,4x5,4x6](Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[4,5,5,6,6]Ge[3,4,4,3x5,4x6]){1|Sb<3>,1|C<3>} Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>} 104.1460 0.000 1 104.1460 0.000 1 104.1460 0.000 1 104.1460 0.000 1 104.1460 0.000 1 104.1460 0.000 1 262 982 982 6:SP1_SPD5_SPD5 Ge[4,5,3x6] Ge[3,4,4,5,5,4x6] Ge[3,4,4,5,5,4x6] 5:5: 4:4:2:2:3: 4:4:2:2:3: Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5: Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3: Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3: Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2 Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH) Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH) Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2{1|Ge<4>} Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>} Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>} 75.8919 0.000 1 75.8919 0.000 1 75.8919 0.000 1 75.8919 0.000 1 75.8919 0.000 1 75.8919 0.000 1 270 270 893 0:SPD5_SP3_SPD5 C C O 5:2:1:1:1: 5:2:1:1:1: 5:1: C-5:O-2:H-1:H-1:H-1: C-5:O-2:H-1:H-1:H-1: C-5:H-1: C(CH3O)(OH)(H)3 C(CH3O)(OH)(H)3 O(CCH3)(H) C(CH3O)(OH)(H)3 C(CH3O)(OH)(H)3 O(CCH3)(H) 132.8750 0.000 2 132.8750 0.000 2 132.8750 0.000 2 132.8750 0.000 2 132.8750 0.000 2 132.8750 0.000 2 270 270 951 0:SPD5_SP-NON_SPD5 C C H 5:2:1:1:1: 5:2:1:1:1: 5: C-5:O-2:H-1:H-1:H-1: C-5:O-2:H-1:H-1:H-1: C-5: C(CH3O)(OH)(H)3 C(CH3O)(OH)(H)3 H(CCHHO) C(CH3O)(OH)(H)3 C(CH3O)(OH)(H)3 H(CCHHO) 63.7087 41.530 6 63.7087 1724.748 6 63.7087 1724.748 6 63.7087 1724.748 6 63.7087 1724.748 6 63.7087 1724.748 6 270 490 490 0:SPD5_SP3_SP3 C C C 4:4:2:1:1: 3:5:1:1: 5:3:1:1: C-4:C-4:O-2:H-1:O-1: N[5a]-3:C-5:H-1:H-1: C-5:N-3:H-1:H-1: C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 C(CCHOO)(NCC)(H)2 C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 C(CCHOO)(NCC)(H)2 112.7570 0.000 1 112.7570 0.000 1 112.7570 0.000 1 112.7570 0.000 1 114.4310 5.605 2 114.4310 5.605 2 270 490 490 0:SPD5_SP3_SP3 C C C 4:4:4:1:1: 5:1:1:1: 5:1:1:1: P-4:C-4:C-4:H-1:H-1: C-5:H-1:H-1:H-1: C-5:H-1:H-1:H-1: C(PCNS)(CH3)2(H)2 C(CCHHP)(H)3 C(CCHHP)(H)3 C(PCNS)(CH3)2(H)2 C(CCHHP)(H)3 C(CCHHP)(H)3 116.1050 0.000 1 116.1050 0.000 1 116.1050 0.000 1 116.1050 0.000 1 114.4310 5.605 2 114.4310 5.605 2 270 490 643 0:SPD5_SP2_SP3 C C C[6a] 3:4:4:2:1: 5:1:1:1: 3:3:5: C[6a]-3:P-4:C-4:O-2:H-1: C-5:H-1:H-1:H-1: C[6a]-3:C[6a]-3:C-5: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 C[6a](C[6a]C[6a]H)2(CCHOP) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 C[6a](C[6a]C[6a]H)2(CCHOP){1|C<3>,1|H<1>,1|N<3>} 113.9390 0.000 1 113.9390 0.000 1 113.9390 0.000 1 113.9390 0.000 1 113.9390 0.000 1 113.9390 0.000 1 270 490 863 0:SPD5_SP2_SP3 C C O 4:4:2:1:1: 3:5:1:1: 5: C-4:C-4:O-2:H-1:O-1: N[5a]-3:C-5:H-1:H-1: C-5: C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 O(CCCHO) C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 O(CCCHO) 113.2140 0.000 1 113.2140 0.000 1 113.2140 0.000 1 113.2140 0.000 1 118.4415 54.654 2 118.4415 54.654 2 270 490 863 0:SPD5_SP2_SP3 C C O 4:4:2:1:1: 5:3:1:1: 5: C-4:C-4:O-2:H-1:O-1: C-5:N-3:H-1:H-1: C-5: C(CN[5a]HH)(CHHN)(OH)(H)(O) C(CCHOO)(NCC)(H)2 O(CCCHO) C(CN[5a]HH)(CHHN)(OH)(H)(O) C(CCHOO)(NCC)(H)2 O(CCCHO) 123.6690 0.000 1 123.6690 0.000 1 123.6690 0.000 1 123.6690 0.000 1 118.4415 54.654 2 118.4415 54.654 2 270 490 893 0:SPD5_SP3_SP3 C C O 3:4:4:2:1: 5:1:1:1: 5:1: C[6a]-3:P-4:C-4:O-2:H-1: C-5:H-1:H-1:H-1: C-5:H-1: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 O(CC[6a]CHP)(H) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 O(CC[6a]CHP)(H) 112.3270 0.000 1 112.3270 0.000 1 112.3270 0.000 1 112.3270 0.000 1 110.4960 4.978 3 110.4960 4.978 3 270 490 893 0:SPD5_SP3_SP3 C C O 4:4:2:1:1: 3:5:1:1: 5:1: C-4:C-4:O-2:H-1:O-1: N[5a]-3:C-5:H-1:H-1: C-5:H-1: C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 O(CCCHO)(H) C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 O(CCCHO)(H) 108.0110 0.000 1 108.0110 0.000 1 108.0110 0.000 1 108.0110 0.000 1 110.4960 4.978 3 110.4960 4.978 3 270 490 893 0:SPD5_SP3_SP3 C C O 4:4:2:1:1: 5:3:1:1: 5:1: C-4:C-4:O-2:H-1:O-1: C-5:N-3:H-1:H-1: C-5:H-1: C(CN[5a]HH)(CHHN)(OH)(H)(O) C(CCHOO)(NCC)(H)2 O(CCCHO)(H) C(CN[5a]HH)(CHHN)(OH)(H)(O) C(CCHOO)(NCC)(H)2 O(CCCHO)(H) 111.1500 0.000 1 111.1500 0.000 1 111.1500 0.000 1 111.1500 0.000 1 110.4960 4.978 3 110.4960 4.978 3 270 490 951 0:SPD5_SP-NON_SP3 C C H 3:4:4:2:1: 5:1:1:1: 5: C[6a]-3:P-4:C-4:O-2:H-1: C-5:H-1:H-1:H-1: C-5: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 H(CC[6a]COP) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 H(CC[6a]COP) 107.3460 0.000 1 107.3460 0.000 1 107.3460 0.000 1 107.3460 0.000 1 103.9279 183.159 14 103.9279 183.159 14 270 490 951 0:SPD5_SP-NON_SP3 C C H 4:1:1:1:1: 4:5:1:1: 5: C-4:H-1:H-1:H-1:H-1: C-4:C-5:H-1:H-1: C-5: C(CCHH)(H)4 C(CHHO)(CH4)(H)2 H(CCH3) C(CCHH)(H)4 C(CHHO)(CH4)(H)2 H(CCH3) 109.7565 2.658 4 109.7565 7.064 4 109.7565 7.064 4 109.7565 7.064 4 103.9279 183.159 14 103.9279 183.159 14 270 490 951 0:SPD5_SP-NON_SP3 C C H 4:4:1:1:1: 4:5:1:1: 5: N-4:C-4:H-1:H-1:H-1: N-4:C-5:H-1:H-1: C-5: C(NNiCC)(CHHN)(H)3 C(NNiCC)(CH3N)(H)2 H(CCHHN) C(NNiCC)(CHHN)(H)3 C(NNiCC)(CH3N)(H)2 H(CCHHN) 113.6910 7.481 3 113.6910 55.969 3 113.6910 55.969 3 113.6910 55.969 3 103.9279 183.159 14 103.9279 183.159 14 270 490 951 0:SPD5_SP-NON_SP3 C C H 4:4:2:1:1: 3:5:1:1: 5: C-4:C-4:O-2:H-1:O-1: N[5a]-3:C-5:H-1:H-1: C-5: C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 H(CCCOO) C(CN[5a]HH)(CHHN)(OH)(H)(O) C(N[5a]C[5a,6a]C[5a])(CCHOO)(H)2 H(CCCOO) 105.3920 0.000 1 105.3920 0.000 1 105.3920 0.000 1 105.3920 0.000 1 103.9279 183.159 14 103.9279 183.159 14 270 490 951 0:SPD5_SP-NON_SP3 C C H 4:4:2:1:1: 5:3:1:1: 5: C-4:C-4:O-2:H-1:O-1: C-5:N-3:H-1:H-1: C-5: C(CN[5a]HH)(CHHN)(OH)(H)(O) C(CCHOO)(NCC)(H)2 H(CCCOO) C(CN[5a]HH)(CHHN)(OH)(H)(O) C(CCHOO)(NCC)(H)2 H(CCCOO) 109.4210 0.000 1 109.4210 0.000 1 109.4210 0.000 1 109.4210 0.000 1 103.9279 183.159 14 103.9279 183.159 14 270 490 951 0:SPD5_SP-NON_SP3 C C H 4:4:4:1:1: 5:1:1:1: 5: P-4:C-4:C-4:H-1:H-1: C-5:H-1:H-1:H-1: C-5: C(PCNS)(CH3)2(H)2 C(CCHHP)(H)3 H(CCCHP) C(PCNS)(CH3)2(H)2 C(CCHHP)(H)3 H(CCCHP) 88.1830 16.233 4 88.1830 263.498 4 88.1830 263.498 4 88.1830 263.498 4 103.9279 183.159 14 103.9279 183.159 14 270 490 992 0:SPD5_SP3_SP3 C C P 3:4:4:2:1: 5:1:1:1: 3:5:2:1: C[6a]-3:P-4:C-4:O-2:H-1: C-5:H-1:H-1:H-1: C[6a]-3:C-5:O-2:O-1: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C(CC[6a]HOP)(H)3 P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) 108.3810 0.000 1 108.3810 0.000 1 108.3810 0.000 1 108.3810 0.000 1 114.7283 67.500 3 114.7283 67.500 3 270 490 992 0:SPD5_SP3_SP3 C C P 4:4:4:1:1: 5:1:1:1: 5:4:2:2: P-4:C-4:C-4:H-1:H-1: C-5:H-1:H-1:H-1: C-5:C-4:S-2:N-2: C(PCNS)(CH3)2(H)2 C(CCHHP)(H)3 P(CCCHH)(CCCH)(SRu)(NP) C(PCNS)(CH3)2(H)2 C(CCHHP)(H)3 P(CCCHH)(CCCH)(SRu)(NP) 117.9020 8.635 2 117.9020 74.566 2 117.9020 74.566 2 117.9020 74.566 2 114.7283 67.500 3 114.7283 67.500 3 270 643 863 0:SPD5_SP2_SP2 C C[6a] O 3:1:1:1:1: 3:3:5: 5: C[6a]-3:H-1:H-1:O-1:O-1: C[6a]-3:C[6a]-3:C-5: C-5: C(C[6a]C[6a]2)(H)2(O)2 C[6a](C[6a]C[6a]H)2(CHHOO) O(CC[6a]HHO) C(C[6a]C[6a]2)(H)2(O)2 C[6a](C[6a]C[6a]H)2(CHHOO){1|C<3>,2|H<1>} O(CC[6a]HHO) 117.6555 2.041 2 117.6555 4.167 2 117.6555 4.167 2 117.6555 4.167 2 117.6555 4.167 2 117.6555 4.167 2 270 643 893 0:SPD5_SP2_SP3 C C[6a] O 3:4:4:2:1: 3:3:5: 5:1: C[6a]-3:P-4:C-4:O-2:H-1: C[6a]-3:C[6a]-3:C-5: C-5:H-1: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C[6a](C[6a]C[6a]H)2(CCHOP) O(CC[6a]CHP)(H) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C[6a](C[6a]C[6a]H)2(CCHOP){1|C<3>,1|H<1>,1|N<3>} O(CC[6a]CHP)(H) 108.0980 0.000 1 108.0980 0.000 1 108.0980 0.000 1 108.0980 0.000 1 108.0980 0.000 1 108.0980 0.000 1 270 643 951 0:SPD5_SP-NON_SP2 C C[6a] H 3:1:1:1:1: 3:3:5: 5: C[6a]-3:H-1:H-1:O-1:O-1: C[6a]-3:C[6a]-3:C-5: C-5: C(C[6a]C[6a]2)(H)2(O)2 C[6a](C[6a]C[6a]H)2(CHHOO) H(CC[6a]HOO) C(C[6a]C[6a]2)(H)2(O)2 C[6a](C[6a]C[6a]H)2(CHHOO){1|C<3>,2|H<1>} H(CC[6a]HOO) 118.2715 6.707 2 118.2715 44.983 2 118.2715 44.983 2 118.2715 44.983 2 114.6800 61.188 3 114.6800 61.188 3 270 643 951 0:SPD5_SP-NON_SP2 C C[6a] H 3:4:4:2:1: 3:3:5: 5: C[6a]-3:P-4:C-4:O-2:H-1: C[6a]-3:C[6a]-3:C-5: C-5: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C[6a](C[6a]C[6a]H)2(CCHOP) H(CC[6a]COP) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C[6a](C[6a]C[6a]H)2(CCHOP){1|C<3>,1|H<1>,1|N<3>} H(CC[6a]COP) 107.4970 0.000 1 107.4970 0.000 1 107.4970 0.000 1 107.4970 0.000 1 114.6800 61.188 3 114.6800 61.188 3 270 643 992 0:SPD5_SP2_SP3 C C[6a] P 3:4:4:2:1: 3:3:5: 3:5:2:1: C[6a]-3:P-4:C-4:O-2:H-1: C[6a]-3:C[6a]-3:C-5: C[6a]-3:C-5:O-2:O-1: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C[6a](C[6a]C[6a]H)2(CCHOP) P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) C[6a](C[6a]C[6a]H)2(CCHOP){1|C<3>,1|H<1>,1|N<3>} P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) 106.3760 0.000 1 106.3760 0.000 1 106.3760 0.000 1 106.3760 0.000 1 106.3760 0.000 1 106.3760 0.000 1 270 863 863 0:SPD5_SP2_SP2 C O O 3:1:1:1:1: 5: 5: C[6a]-3:H-1:H-1:O-1:O-1: C-5: C-5: C(C[6a]C[6a]2)(H)2(O)2 O(CC[6a]HHO) O(CC[6a]HHO) C(C[6a]C[6a]2)(H)2(O)2 O(CC[6a]HHO) O(CC[6a]HHO) 124.6500 0.000 1 124.6500 0.000 1 124.6500 0.000 1 124.6500 0.000 1 124.6500 0.000 1 124.6500 0.000 1 270 863 893 0:SPD5_SP2_SP3 C O O 4:4:2:1:1: 5: 5:1: C-4:C-4:O-2:H-1:O-1: C-5: C-5:H-1: C(CN[5a]HH)(CHHN)(OH)(H)(O) O(CCCHO) O(CCCHO)(H) C(CN[5a]HH)(CHHN)(OH)(H)(O) O(CCCHO) O(CCCHO)(H) 83.2334 0.000 1 83.2334 0.000 1 83.2334 0.000 1 83.2334 0.000 1 83.2334 0.000 1 83.2334 0.000 1 270 863 951 0:SPD5_SP-NON_SP2 C O H 3:1:1:1:1: 5: 5: C[6a]-3:H-1:H-1:O-1:O-1: C-5: C-5: C(C[6a]C[6a]2)(H)2(O)2 O(CC[6a]HHO) H(CC[6a]HOO) C(C[6a]C[6a]2)(H)2(O)2 O(CC[6a]HHO) H(CC[6a]HOO) 63.9211 69.347 4 63.9211 4809.014 4 63.9211 4809.014 4 63.9211 4809.014 4 56.4959 3882.429 5 56.4959 3882.429 5 270 863 951 0:SPD5_SP-NON_SP2 C O H 4:4:2:1:1: 5: 5: C-4:C-4:O-2:H-1:O-1: C-5: C-5: C(CN[5a]HH)(CHHN)(OH)(H)(O) O(CCCHO) H(CCCOO) C(CN[5a]HH)(CHHN)(OH)(H)(O) O(CCCHO) H(CCCOO) 26.7951 0.000 1 26.7951 0.000 1 26.7951 0.000 1 26.7951 0.000 1 56.4959 3882.429 5 56.4959 3882.429 5 270 892 951 0:SPD5_SP-NON_SP3 C N H 4:4:1:1:1: 5:4:3:1: 5: N-4:P-4:H-1:H-1:H-1: C-5:C-4:C-3:H-1: C-5: C(NCCH)(PO3)(H)3 N(CH3P)(CHHP)(CHP)(H) H(CHHNP) C(NCCH)(PO3)(H)3 N(CH3P)(CHHP)(CHP)(H) H(CHHNP) 110.2027 2.514 3 110.2027 6.322 3 110.2027 6.322 3 110.2027 6.322 3 110.2027 6.322 3 110.2027 6.322 3 270 892 992 0:SPD5_SP3_SP3 C N P 4:4:1:1:1: 5:4:3:1: 5:2:1:1: N-4:P-4:H-1:H-1:H-1: C-5:C-4:C-3:H-1: C-5:O-2:O-1:O-1: C(NCCH)(PO3)(H)3 N(CH3P)(CHHP)(CHP)(H) P(CH3N)(OH)(O)2 C(NCCH)(PO3)(H)3 N(CH3P)(CHHP)(CHP)(H) P(CH3N)(OH)(O)2 114.1140 0.000 1 114.1140 0.000 1 114.1140 0.000 1 114.1140 0.000 1 114.1140 0.000 1 114.1140 0.000 1 270 893 951 0:SPD5_SP-NON_SP3 C O H 3:4:4:2:1: 5:1: 5: C[6a]-3:P-4:C-4:O-2:H-1: C-5:H-1: C-5: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) O(CC[6a]CHP)(H) H(CC[6a]COP) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) O(CC[6a]CHP)(H) H(CC[6a]COP) 107.3290 0.000 1 107.3290 0.000 1 107.3290 0.000 1 107.3290 0.000 1 118.3110 48.396 8 118.3110 48.396 8 270 893 951 0:SPD5_SP-NON_SP3 C O H 4:4:2:1:1: 5:1: 5: C-4:C-4:O-2:H-1:O-1: C-5:H-1: C-5: C(CN[5a]HH)(CHHN)(OH)(H)(O) O(CCCHO)(H) H(CCCOO) C(CN[5a]HH)(CHHN)(OH)(H)(O) O(CCCHO)(H) H(CCCOO) 109.9370 0.000 1 109.9370 0.000 1 109.9370 0.000 1 109.9370 0.000 1 118.3110 48.396 8 118.3110 48.396 8 270 893 951 0:SPD5_SP-NON_SP3 C O H 5:2:1:1:1: 5:1: 5: C-5:O-2:H-1:H-1:H-1: C-5:H-1: C-5: C(CH3O)(OH)(H)3 O(CCH3)(H) H(CCHHO) C(CH3O)(OH)(H)3 O(CCH3)(H) H(CCHHO) 121.5370 4.138 6 121.5370 17.120 6 121.5370 17.120 6 121.5370 17.120 6 118.3110 48.396 8 118.3110 48.396 8 270 893 992 0:SPD5_SP3_SP3 C O P 3:4:4:2:1: 5:1: 3:5:2:1: C[6a]-3:P-4:C-4:O-2:H-1: C-5:H-1: C[6a]-3:C-5:O-2:O-1: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) O(CC[6a]CHP)(H) P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) O(CC[6a]CHP)(H) P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) 107.3610 0.000 1 107.3610 0.000 1 107.3610 0.000 1 107.3610 0.000 1 107.3610 0.000 1 107.3610 0.000 1 270 951 951 0:SPD5_SP-NON_SP-NON C H H 3:1:1:1:1: 5: 5: C[6a]-3:H-1:H-1:O-1:O-1: C-5: C-5: C(C[6a]C[6a]2)(H)2(O)2 H(CC[6a]HOO) H(CC[6a]HOO) C(C[6a]C[6a]2)(H)2(O)2 H(CC[6a]HOO) H(CC[6a]HOO) 123.2480 0.000 1 123.2480 0.000 1 123.2480 0.000 1 92.7182 826.477 7 98.1713 676.898 29 98.1713 676.898 29 270 951 951 0:SPD5_SP-NON_SP-NON C H H 3:1:1:1:1: 5: 5: N-3:H-1:H-1:H-1:H-1: C-5: C-5: C(NC[6a]C[3])(H)4 H(CH3N) H(CH3N) C(NC[6a]C[3])(H)4 H(CH3N) H(CH3N) 87.6298 27.826 6 87.6298 774.289 6 87.6298 774.289 6 92.7182 826.477 7 98.1713 676.898 29 98.1713 676.898 29 270 951 951 0:SPD5_SP-NON_SP-NON C H H 4:1:1:1:1: 5: 5: C-4:H-1:H-1:H-1:H-1: C-5: C-5: C(CCHH)(H)4 H(CCH3) H(CCH3) C(CCHH)(H)4 H(CCH3) H(CCH3) 97.5147 30.235 6 97.5147 914.170 6 97.5147 914.170 6 97.5147 914.170 6 98.1713 676.898 29 98.1713 676.898 29 270 951 951 0:SPD5_SP-NON_SP-NON C H H 4:4:1:1:1: 5: 5: N-4:C-4:H-1:H-1:H-1: C-5: C-5: C(NNiCC)(CHHN)(H)3 H(CCHHN) H(CCHHN) C(NNiCC)(CHHN)(H)3 H(CCHHN) H(CCHHN) 74.8611 32.462 3 74.8611 1053.809 3 74.8611 1053.809 3 98.0429 567.870 9 98.1713 676.898 29 98.1713 676.898 29 270 951 951 0:SPD5_SP-NON_SP-NON C H H 4:4:1:1:1: 5: 5: N-4:P-4:H-1:H-1:H-1: C-5: C-5: C(NCCH)(PO3)(H)3 H(CHHNP) H(CHHNP) C(NCCH)(PO3)(H)3 H(CHHNP) H(CHHNP) 108.6893 1.784 3 108.6893 3.184 3 108.6893 3.184 3 98.0429 567.870 9 98.1713 676.898 29 98.1713 676.898 29 270 951 951 0:SPD5_SP-NON_SP-NON C H H 4:4:1:1:1: 5: 5: P-4:P-4:H-1:H-1:H-1: C-5: C-5: C(PNiCC)2(H)3 H(CHHPP) H(CHHPP) C(PNiCC)2(H)3 H(CHHPP) H(CHHPP) 110.5783 1.633 3 110.5783 2.667 3 110.5783 2.667 3 98.0429 567.870 9 98.1713 676.898 29 98.1713 676.898 29 270 951 951 0:SPD5_SP-NON_SP-NON C H H 4:4:4:1:1: 5: 5: P-4:C-4:C-4:H-1:H-1: C-5: C-5: C(PCNS)(CH3)2(H)2 H(CCCHP) H(CCCHP) C(PCNS)(CH3)2(H)2 H(CCCHP) H(CCCHP) 164.3950 0.000 1 164.3950 0.000 1 164.3950 0.000 1 164.3950 0.000 1 98.1713 676.898 29 98.1713 676.898 29 270 951 951 0:SPD5_SP-NON_SP-NON C H H 5:2:1:1:1: 5: 5: C-5:O-2:H-1:H-1:H-1: C-5: C-5: C(CH3O)(OH)(H)3 H(CCHHO) H(CCHHO) C(CH3O)(OH)(H)3 H(CCHHO) H(CCHHO) 94.3453 6.264 6 94.3453 39.236 6 94.3453 39.236 6 94.3453 39.236 6 98.1713 676.898 29 98.1713 676.898 29 270 951 956 0:SPD5_SP-NON_SP2 C H N 3:1:1:1:1: 5: 7:3:5: N-3:H-1:H-1:H-1:H-1: C-5: C[3]-7:C[6a]-3:C-5: C(NC[6a]C[3])(H)4 H(CH3N) N(C[3]H[3]2H4)(C[6a]C[6a]2)(CH4) C(NC[6a]C[3])(H)4 H(CH3N) N(C[3]H[3]2H4)(C[6a]C[6a]2)(CH4) 115.6457 9.305 4 115.6457 86.580 4 115.6457 86.580 4 115.6457 86.580 4 115.6457 86.580 4 115.6457 86.580 4 270 951 992 0:SPD5_SP-NON_SP3 C H P 3:4:4:2:1: 5: 3:5:2:1: C[6a]-3:P-4:C-4:O-2:H-1: C-5: C[6a]-3:C-5:O-2:O-1: C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) H(CC[6a]COP) P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) C(C[6a]C[6a]2)(PC[6a]OO)(CH3)(OH)(H) H(CC[6a]COP) P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O) 1.2303 0.000 1 1.2303 0.000 1 1.2303 0.000 1 1.2303 0.000 1 68.2783 2715.540 6 68.2783 2715.540 6 270 951 992 0:SPD5_SP-NON_SP3 C H P 4:4:1:1:1: 5: 5:2:1:1: N-4:P-4:H-1:H-1:H-1: C-5: C-5:O-2:O-1:O-1: C(NCCH)(PO3)(H)3 H(CHHNP) P(CH3N)(OH)(O)2 C(NCCH)(PO3)(H)3 H(CHHNP) P(CH3N)(OH)(O)2 73.1565 61.587 3 73.1565 3792.908 3 73.1565 3792.908 3 73.1565 3792.908 3 68.2783 2715.540 6 68.2783 2715.540 6 270 951 992 0:SPD5_SP-NON_SP3 C H P 4:4:4:1:1: 5: 5:4:2:2: P-4:C-4:C-4:H-1:H-1: C-5: C-5:C-4:S-2:N-2: C(PCNS)(CH3)2(H)2 H(CCCHP) P(CCCHH)(CCCH)(SRu)(NP) C(PCNS)(CH3)2(H)2 H(CCCHP) P(CCCHH)(CCCH)(SRu)(NP) 94.4851 7.174 2 94.4851 51.467 2 94.4851 51.467 2 94.4851 51.467 2 68.2783 2715.540 6 68.2783 2715.540 6 278 70 856 0:SP2_SP-NON_SP2 Ge[6] P N[6] 3:3:1: 3: 3:3:3: N[6]-3:N[6]-3:P-1: Ge[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(P) P(Ge[6]N[6]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(P){2|C<4>,5|C<3>} P(Ge[6]N[6]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 93.1652 0.428 2 93.1652 0.183 2 93.1652 0.183 2 93.1652 0.183 2 93.1652 0.183 2 93.1652 0.183 2 278 217 278 0:SP2_SP2_SP2 Ge[6] N[6,6a] Ge[6] 3:3:3: 3:3:3: 3:3:3: N[6,6a]-3:Ge[6]-3:N[6]-3: C[6,6a]-3:Ge[6]-3:C[6a]-3: N[6,6a]-3:Ge[6]-3:N[6]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si) N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]Ge[6]N[6])(C[6a]C[6a]H) Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si) Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si){1|Si<4>,1|H<1>,7|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]Ge[6]N[6])(C[6a]C[6a]H){2|Si<4>,2|C<3>,2|H<1>,2|N<3>} Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si){1|Si<4>,1|H<1>,7|C<3>} 84.2873 1.181 2 84.2873 1.395 2 84.2873 1.395 2 84.2873 1.395 2 84.2873 1.395 2 84.2873 1.395 2 278 217 474 0:SP2_SP2_SP3 Ge[6] N[6,6a] C[5] 3:4:3: 3:3:3: 3:3:3:1: N[6,6a]-3:C[5]-4:N[6]-3: C[6,6a]-3:Ge[6]-3:C[6a]-3: Ge[6]-3:C[5]-3:C[5]-3:H-1: Ge[6](N[6,6a]C[6,6a]C[6a])(C[5]C[5]2H)(N[6]C[6]Si) N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]C[5]N[6])(C[6a]C[6a]H) C[5](Ge[6]N[6,6a]N[6])(C[5]C[5]H)2(H) Ge[6](N[6,6a]C[6,6a]C[6a])(C[5]C[5]2H)(N[6]C[6]Si){3|H<1>,6|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]C[5]N[6])(C[6a]C[6a]H){2|Si<4>,3|H<1>,4|C<3>} C[5](Ge[6]N[6,6a]N[6])(C[5]C[5]H)2(H){1|Si<4>,2|H<1>,3|C<3>} 93.5418 0.000 1 93.5418 0.000 1 93.5418 0.000 1 93.5418 0.000 1 93.5418 0.000 1 93.5418 0.000 1 278 217 490 0:SP2_SP2_SP3 Ge[6] N[6,6a] C 3:3:4: 3:3:3: 3:4:4:4: N[6,6a]-3:N[6]-3:C-4: C[6,6a]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:C-4:C-4:C-4: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC3) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C) C(Ge[6]N[6,6a]N[6])(CH3)3 Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC3){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C){2|Si<4>,2|C<3>,2|H<1>} C(Ge[6]N[6,6a]N[6])(CH3)3 98.2796 0.000 1 98.2796 0.000 1 98.2796 0.000 1 98.2796 0.000 1 98.2796 0.000 1 98.2796 0.000 1 278 217 790 0:SP2_SP-NON_SP2 Ge[6] N[6,6a] Cl 3:3:1: 3:3:3: 3: N[6,6a]-3:N[6,6]-3:Cl-1: C[6,6a]-3:Ge[6]-3:C[6a]-3: Ge[6]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(Cl) N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]Cl)(C[6a]C[6a]H) Cl(Ge[6]N[6,6a]N[6,6]) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(Cl){1|N<2>,2|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]Cl)(C[6a]C[6a]H){2|H<1>,3|C<3>} Cl(Ge[6]N[6,6a]N[6,6]) 93.4031 0.170 2 93.4031 0.029 2 93.4031 0.029 2 93.4031 0.029 2 93.4031 0.029 2 93.4031 0.029 2 278 217 856 6:SP2_SP2_SP2 Ge[6,6] N[6,6,6a] N[6] 3:3:3: 3:3:3: 3:3:4: N[6,6,6a]-3:N[6]-3:N[6]-3: C[6,6a]-3:C[6,6a]-3:Ge[6,6]-3: Ge[6,6]-3:C[6]-3:Si-4: Ge[6,6](N[6,6,6a]C[6,6a]2)(N[6]C[6]Si)2 N[6,6,6a](C[6,6a]C[6a]C[6])2(Ge[6,6]N[6]2) N[6](Ge[6,6]N[6,6,6a]N[6])(C[6]C[6a]C[6])(SiC3) Ge[6,6](N[6,6,6a]C[6,6a]2)(N[6]C[6]Si)2{6|C<3>} N[6,6,6a](C[6,6a]C[6a]C[6])2(Ge[6,6]N[6]2){2|Si<4>,3|C<3>,4|H<1>} N[6](Ge[6,6]N[6,6,6a]N[6])(C[6]C[6a]C[6])(SiC3){1|Si<4>,1|H<1>,5|C<3>} 89.7921 4.481 2 89.7921 20.079 2 89.7921 20.079 2 89.7921 20.079 2 89.7921 20.079 2 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6,6] 3:3:1: 3:3:3: 3:3:3: N[6,6a]-3:N[6,6]-3:Cl-1: C[6,6a]-3:Ge[6]-3:C[6a]-3: C[6,6]-3:Ge[6]-3:C[6]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(Cl) N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]Cl)(C[6a]C[6a]H) N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]Cl)(C[6]C[6]H) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(Cl){1|N<2>,2|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]Cl)(C[6a]C[6a]H){2|H<1>,3|C<3>} N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]Cl)(C[6]C[6]H){2|H<1>,3|C<3>} 89.4931 0.000 1 89.4931 0.000 1 89.4931 0.000 1 89.4931 0.000 1 88.5981 1.602 2 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6,6] 3:3:3: 3:3:3: 3:3:3: N[6,6a]-3:N[6,6]-3:N-3: C[6,6a]-3:Ge[6]-3:C[6a]-3: C[6,6]-3:Ge[6]-3:C[6]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(NC[6a]2) N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]N)(C[6a]C[6a]H) N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]N)(C[6]C[6]H) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(NC[6a]2){1|N<2>,2|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]N)(C[6a]C[6a]H){2|H<1>,3|C<3>} N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]N)(C[6]C[6]H){2|H<1>,3|C<3>} 87.7030 0.000 1 87.7030 0.000 1 87.7030 0.000 1 87.7030 0.000 1 88.5981 1.602 2 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6] 3:3:2: 3:3:3: 3:3:4: N[6,6a]-3:N[6]-3:C-2: C[6,6a]-3:C[6a]-3:Ge[6]-3: C[6]-3:Ge[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C) N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C){2|Si<4>,2|C<3>,2|H<1>} N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3){1|Si<4>,4|C<3>} 87.7329 0.000 1 87.7329 0.000 1 87.7329 0.000 1 86.8642 0.779 3 87.0136 0.404 9 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6] 3:3:2: 3:3:3: 3:3:4: N[6,6a]-3:N[6]-3:Se-2: C[6,6a]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:C[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(SeGe[6]) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]Se) N[6](Ge[6]N[6,6a]Se)(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(SeGe[6]){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]Se){2|Si<4>,2|C<3>,2|H<1>} N[6](Ge[6]N[6,6a]Se)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} 86.4299 0.653 2 86.4299 0.426 2 86.4299 0.426 2 86.8642 0.779 3 87.0136 0.404 9 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6] 3:3:3: 3:3:3: 3:3:4: N[6,6a]-3:Ge[6]-3:N[6]-3: C[6,6a]-3:Ge[6]-3:C[6a]-3: Ge[6]-3:C[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si) N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]Ge[6]N[6])(C[6a]C[6a]H) N[6](Ge[6]N[6,6a]Ge[6])(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si){1|Si<4>,1|H<1>,7|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]Ge[6]N[6])(C[6a]C[6a]H){2|Si<4>,2|C<3>,2|H<1>,2|N<3>} N[6](Ge[6]N[6,6a]Ge[6])(C[6]C[6a]C[6])(SiC3){1|Si<4>,2|N<3>,4|C<3>} 86.9205 0.135 2 86.9205 0.018 2 86.9205 0.018 2 87.1053 0.084 4 87.0136 0.404 9 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6] 3:3:3: 3:3:3: 3:3:4: N[6,6a]-3:N[6]-3:N-3: C[6,6a]-3:C[6a]-3:Ge[6]-3: C[6]-3:Ge[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(NC[6a]N) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]N) N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]N)(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(NC[6a]N){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]N){2|Si<4>,2|C<3>,2|H<1>} N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]N)(SiC3){1|Si<4>,4|C<3>} 87.2902 0.312 2 87.2902 0.097 2 87.2902 0.097 2 87.1053 0.084 4 87.0136 0.404 9 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6] 3:3:4: 3:3:3: 3:3:4: N[6,6a]-3:N[6]-3:C-4: C[6,6a]-3:C[6a]-3:Ge[6]-3: C[6]-3:Ge[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC3) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C) N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC3){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C){2|Si<4>,2|C<3>,2|H<1>} N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3){1|Si<4>,4|C<3>} 87.8672 0.000 1 87.8672 0.000 1 87.8672 0.000 1 87.8672 0.000 1 87.0136 0.404 9 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP2 Ge[6] N[6,6a] N[6] 3:4:3: 3:3:3: 3:3:4: N[6,6a]-3:C[5]-4:N[6]-3: C[6,6a]-3:Ge[6]-3:C[6a]-3: Ge[6]-3:C[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(C[5]C[5]2H)(N[6]C[6]Si) N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]C[5]N[6])(C[6a]C[6a]H) N[6](Ge[6]N[6,6a]C[5])(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(C[5]C[5]2H)(N[6]C[6]Si){3|H<1>,6|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]C[5]N[6])(C[6a]C[6a]H){2|Si<4>,3|H<1>,4|C<3>} N[6](Ge[6]N[6,6a]C[5])(C[6]C[6a]C[6])(SiC3){1|Si<4>,1|H<1>,6|C<3>} 86.2415 0.000 1 86.2415 0.000 1 86.2415 0.000 1 86.2415 0.000 1 87.0136 0.404 9 87.6848 3.293 13 278 217 856 6:SP2_SP2_SP3 Ge[6] N[6,6a] N[6] 3:4:3: 3:3:3: 3:3:4: N[6,6a]-3:Ge[6]-4:N[6]-3: C[6,6a]-3:Ge[6]-3:C[6a]-3: Ge[6]-3:C[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6]N[6]Fe)(N[6]C[6]Si) N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]Ge[6]N[6])(C[6a]C[6a]H) N[6](Ge[6]N[6,6a]Ge[6])(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6]N[6]Fe)(N[6]C[6]Si){1|Si<4>,1|H<1>,7|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(Ge[6]Ge[6]N[6])(C[6a]C[6a]H){1|Fe<5>,2|Si<4>,2|C<3>,2|H<1>,2|N<3>} N[6](Ge[6]N[6,6a]Ge[6])(C[6]C[6a]C[6])(SiC3){1|Fe<5>,1|Si<4>,2|N<3>,4|C<3>} 87.2703 0.000 1 87.2703 0.000 1 87.2703 0.000 1 87.2703 0.000 1 87.2703 0.000 1 87.2703 0.000 1 278 217 921 0:SP2_SP2_SP3 Ge[6] N[6,6a] Se 3:3:2: 3:3:3: 3:3: N[6,6a]-3:N[6]-3:Se-2: C[6,6a]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:Ge[6]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(SeGe[6]) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]Se) Se(Ge[6]N[6,6a]N[6])2 Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(SeGe[6]){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]Se){2|Si<4>,2|C<3>,2|H<1>} Se(Ge[6]N[6,6a]N[6])2 93.2824 3.238 2 93.2824 10.483 2 93.2824 10.483 2 93.2824 10.483 2 93.2824 10.483 2 93.2824 10.483 2 278 217 956 0:SP2_SP2_SP2 Ge[6] N[6,6a] N 3:3:3: 3:3:3: 3:3:3: N[6,6a]-3:N[6,6]-3:N-3: C[6,6a]-3:Ge[6]-3:C[6a]-3: Ge[6]-3:C[6a]-3:C[6a]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(NC[6a]2) N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]N)(C[6a]C[6a]H) N(Ge[6]N[6,6a]N[6,6])(C[6a]C[6a]N[6a])2 Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(NC[6a]2){1|N<2>,2|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]N[6])(Ge[6]N[6,6]N)(C[6a]C[6a]H){2|H<1>,3|C<3>} N(Ge[6]N[6,6a]N[6,6])(C[6a]C[6a]N[6a])2 96.7243 0.000 1 96.7243 0.000 1 96.7243 0.000 1 100.7544 12.300 3 100.7544 12.300 3 100.7544 12.300 3 278 217 956 0:SP2_SP2_SP2 Ge[6] N[6,6a] N 3:3:3: 3:3:3: 3:3:3: N[6,6a]-3:N[6]-3:N-3: C[6,6a]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:C[6a]-3:N-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(NC[6a]N) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]N) N(Ge[6]N[6,6a]N[6])(C[6a]C[6a]2)(NC[6a]Ge[6]) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(NC[6a]N){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]N){2|Si<4>,2|C<3>,2|H<1>} N(Ge[6]N[6,6a]N[6])(C[6a]C[6a]2)(NC[6a]Ge[6]) 102.7695 0.487 2 102.7695 0.237 2 102.7695 0.237 2 100.7544 12.300 3 100.7544 12.300 3 100.7544 12.300 3 278 217 983 0:SP2_SP1_SP2 Ge[6] N[6,6a] C 3:3:2: 3:3:3: 3:2: N[6,6a]-3:N[6]-3:C-2: C[6,6a]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:C-2: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC) N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C) C(Ge[6]N[6,6a]N[6])(CC[6a]) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC){1|H<1>,4|C<3>} N[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6a]H)(Ge[6]N[6]C){2|Si<4>,2|C<3>,2|H<1>} C(Ge[6]N[6,6a]N[6])(CC[6a]) 93.7957 0.000 1 93.7957 0.000 1 93.7957 0.000 1 93.7957 0.000 1 93.7957 0.000 1 93.7957 0.000 1 278 254 254 6:SP2_SP3_SP3 Ge[6] Ge[6] Ge[6] 4:4:4: 3:2:2:2: 3:2:2:2: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-3:O[6]-2:O-2:O-2: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2 Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2{1|Ge<3>,1|N<4>,6|O<2>} Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} 88.0439 0.000 1 88.0439 0.000 1 88.0439 0.000 1 88.0439 0.000 1 85.4531 6.296 3 85.4531 6.296 3 278 254 254 6:SP2_SP3_SP3 Ge[6] Ge[6] Ge[6] 4:4:4: 3:2:2:2: 3:2:2:4: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-3:O[6]-2:O-2:O-2: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2 Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])2{1|Ge<3>,1|N<4>,6|O<2>} Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} 83.0344 0.000 1 83.0344 0.000 1 83.0344 0.000 1 84.1577 2.524 2 85.4531 6.296 3 85.4531 6.296 3 278 254 254 6:SP2_SP3_SP3 Ge[6] Ge[6] Ge[6] 4:4:4: 3:2:2:2: 3:2:2:4: Ge[6]-4:Ge[6]-4:Ge[6]-4: Ge[6]-3:O[6]-2:O[6]-2:O-2: Ge[6]-3:O[6]-2:O-2:N-4: Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]) Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3) Ge[6](Ge[6]O[6]2O)(Ge[6]O[6]NO)(Ge[6]O[6]OO){3|Ge<4>} Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])2(OC[6a]){1|Ge<3>,2|N<4>,8|O<2>} Ge[6](Ge[6]Ge[6]2)(O[6]Ge[6])(OC[6a])(NH3){1|Ge<3>,7|O<2>} 85.2810 0.000 1 85.2810 0.000 1 85.2810 0.000 1 84.1577 2.524 2 85.4531 6.296 3 85.4531 6.296 3 278 278 643 0:SP2_SP2_SP2 Ge[6] Ge[6] C[6a] 3:3:3: 3:3:3: 3:3:3: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6]-3:C[6a]-3:C[6a]-3: Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H) Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H) C[6a](Ge[6]Ge[6]C[6])(C[6a]C[6a]C)2 Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>} Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>} C[6a](Ge[6]Ge[6]C[6])(C[6a]C[6a]C)2{3|H<1>,4|C<3>} 137.1300 0.000 1 137.1300 0.000 1 137.1300 0.000 1 137.1300 0.000 1 137.1300 0.000 1 137.1300 0.000 1 278 278 762 6:SP2_SP2_SP2 Ge[6] Ge[6] C[6] 3:3:3: 3:3:3: 3:3:1: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6]-3:C[6]-3:H-1: Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H) Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H) C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H) Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>} Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>} C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>} 101.3410 0.000 1 101.3410 0.000 1 101.3410 0.000 1 101.3410 0.000 1 101.3410 0.000 1 101.3410 0.000 1 278 278 856 0:SP2_SP2_SP2 Ge[6] Ge[6] N[6] 3:3:3: 3:3:3: 3:3:4: N[6,6a]-3:Ge[6]-3:N[6]-3: N[6,6a]-3:Ge[6]-3:N[6]-3: Ge[6]-3:C[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si) Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si) N[6](Ge[6]N[6,6a]Ge[6])(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si){1|Si<4>,1|H<1>,7|C<3>} Ge[6](N[6,6a]C[6,6a]C[6a])(Ge[6]N[6,6a]N[6])(N[6]C[6]Si){1|Si<4>,1|H<1>,7|C<3>} N[6](Ge[6]N[6,6a]Ge[6])(C[6]C[6a]C[6])(SiC3){1|Si<4>,2|N<3>,4|C<3>} 102.7405 0.074 2 102.7405 0.006 2 102.7405 0.006 2 102.7405 0.006 2 102.7405 0.006 2 102.7405 0.006 2 278 474 856 0:SP2_SP2_SP3 Ge[6] C[5] N[6] 3:3:4: 3:3:3:1: 3:3:3: N[6]-3:N[6]-3:C[5]-4: Ge[6]-3:C[5]-3:C[5]-3:H-1: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(C[5]C[5]2H) C[5](Ge[6]N[6]2)(C[5]C[5]H)2(H) N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(C[5]C[5]2H){2|C<4>,2|H<1>,7|C<3>} C[5](Ge[6]N[6]2)(C[5]C[5]H)2(H){2|H<1>,4|C<3>} N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,2|H<1>,6|C<3>} 99.5494 0.216 2 99.5494 0.047 2 99.5494 0.047 2 99.5494 0.047 2 99.0903 0.656 3 99.0903 0.656 3 278 474 856 0:SP2_SP2_SP3 Ge[6] C[5] N[6] 3:4:3: 3:3:3:1: 3:3:4: N[6,6a]-3:C[5]-4:N[6]-3: Ge[6]-3:C[5]-3:C[5]-3:H-1: Ge[6]-3:C[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(C[5]C[5]2H)(N[6]C[6]Si) C[5](Ge[6]N[6,6a]N[6])(C[5]C[5]H)2(H) N[6](Ge[6]N[6,6a]C[5])(C[6]C[6a]C[6])(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(C[5]C[5]2H)(N[6]C[6]Si){3|H<1>,6|C<3>} C[5](Ge[6]N[6,6a]N[6])(C[5]C[5]H)2(H){1|Si<4>,2|H<1>,3|C<3>} N[6](Ge[6]N[6,6a]C[5])(C[6]C[6a]C[6])(SiC3){1|Si<4>,1|H<1>,6|C<3>} 98.1720 0.000 1 98.1720 0.000 1 98.1720 0.000 1 98.1720 0.000 1 99.0903 0.656 3 99.0903 0.656 3 278 478 856 6:SP2_SP2_SP3 Ge[3x6] C[4,6,6] N[3x6] 4:3:3: 3:3:3:4: 3:3:3: C[4,6,6]-4:N[3x6]-3:N[6,6]-3: Ge[3x6]-3:Ge[4,6,6]-3:C[6a]-3:P[4]-4: Ge[3x6]-3:C[3x6]-3:C[6]-3: Ge[3x6](C[4,6,6]Ge[4,6,6]C[6a]P[4])(N[3x6]C[3x6]C[6])(N[6,6]P[6,6]Si) C[4,6,6](Ge[3x6]N[3x6]N[6,6])(Ge[4,6,6]C[3x6]N[4])(C[6a]C[6a]N[6a])(P[4]N[4]CC) N[3x6](Ge[3x6]C[4,6,6]N[6,6])(C[3x6]C[3x6]C[6])(C[6]C[6]C) Ge[3x6](C[4,6,6]Ge[4,6,6]C[6a]P[4])(N[3x6]C[3x6]C[6])(N[6,6]P[6,6]Si){1|N<2>,1|N<3>,4|C<3>,5|C<4>} C[4,6,6](Ge[3x6]N[3x6]N[6,6])(Ge[4,6,6]C[3x6]N[4])(C[6a]C[6a]N[6a])(P[4]N[4]CC){2|Si<4>,1|P<4>,2|H<1>,4|C<3>} N[3x6](Ge[3x6]C[4,6,6]N[6,6])(C[3x6]C[3x6]C[6])(C[6]C[6]C){1|Ge<3>,1|Si<4>,2|C<3>,2|P<4>,3|H<1>} 98.4161 0.000 1 98.4161 0.000 1 98.4161 0.000 1 98.4161 0.000 1 98.4161 0.000 1 98.4161 0.000 1 278 478 856 6:SP2_SP3_SP3 Ge[3x6] C[4,6,6] N[6,6] 4:3:3: 3:3:3:4: 3:4:4: C[4,6,6]-4:N[3x6]-3:N[6,6]-3: Ge[3x6]-3:Ge[4,6,6]-3:C[6a]-3:P[4]-4: Ge[3x6]-3:P[6,6]-4:Si-4: Ge[3x6](C[4,6,6]Ge[4,6,6]C[6a]P[4])(N[3x6]C[3x6]C[6])(N[6,6]P[6,6]Si) C[4,6,6](Ge[3x6]N[3x6]N[6,6])(Ge[4,6,6]C[3x6]N[4])(C[6a]C[6a]N[6a])(P[4]N[4]CC) N[6,6](Ge[3x6]C[4,6,6]N[3x6])(P[6,6]C[3x6]CC)(SiC3) Ge[3x6](C[4,6,6]Ge[4,6,6]C[6a]P[4])(N[3x6]C[3x6]C[6])(N[6,6]P[6,6]Si){1|N<2>,1|N<3>,4|C<3>,5|C<4>} C[4,6,6](Ge[3x6]N[3x6]N[6,6])(Ge[4,6,6]C[3x6]N[4])(C[6a]C[6a]N[6a])(P[4]N[4]CC){2|Si<4>,1|P<4>,2|H<1>,4|C<3>} N[6,6](Ge[3x6]C[4,6,6]N[3x6])(P[6,6]C[3x6]CC)(SiC3){1|Ge<3>,1|H<1>,1|P<4>,3|C<3>} 99.3680 0.000 1 99.3680 0.000 1 99.3680 0.000 1 99.3680 0.000 1 99.3680 0.000 1 99.3680 0.000 1 278 490 849 0:SP2_SP3_SP3 Ge[6] C P[6] 4:4:4: 3:4:1:1: 3:3:4:3: P[6]-4:P[6]-4:C-4: Ge[6]-3:P-4:H-1:H-1: C[6a]-3:C[6a]-3:C[6]-4:Ge[6]-3: Ge[6](P[6]C[6a]2C[6])2(CHHP) C(Ge[6]P[6]2)(PC[6a]2B)(H)2 P[6](C[6a]C[6a]2)2(C[6]B[6]HH)(Ge[6]P[6]C) Ge[6](P[6]C[6a]2C[6])2(CHHP){1|B<4>,4|H<1>,8|C<3>} C(Ge[6]P[6]2)(PC[6a]2B)(H)2 P[6](C[6a]C[6a]2)2(C[6]B[6]HH)(Ge[6]P[6]C){1|C<4>,4|H<1>,8|C<3>} 96.2303 2.446 2 96.2303 5.983 2 96.2303 5.983 2 96.2303 5.983 2 96.2303 5.983 2 96.2303 5.983 2 278 490 856 0:SP2_SP2_SP3 Ge[6] C N[6] 3:3:4: 3:4:4:4: 3:3:4: N[6,6a]-3:N[6]-3:C-4: Ge[6]-3:C-4:C-4:C-4: C[6]-3:Ge[6]-3:Si-4: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC3) C(Ge[6]N[6,6a]N[6])(CH3)3 N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC3){1|H<1>,4|C<3>} C(Ge[6]N[6,6a]N[6])(CH3)3 N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3){1|Si<4>,4|C<3>} 106.0040 0.000 1 106.0040 0.000 1 106.0040 0.000 1 106.0040 0.000 1 106.0040 0.000 1 106.0040 0.000 1 278 542 542 6:SP2_SP2_SP2 Ge[6] N[5,6] N[5,6] 3:3:1: 4:3:3: 4:3:3: N[5,6]-3:N[5,6]-3:Cl-1: C[5]-4:C[5,6]-3:Ge[6]-3: C[5]-4:C[5,6]-3:Ge[6]-3: Ge[6](N[5,6]C[5,6]C[5])2(Cl) N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[6]O[5])(Ge[6]N[5,6]Cl) N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[6]O[5])(Ge[6]N[5,6]Cl) Ge[6](N[5,6]C[5,6]C[5])2(Cl){2|C<4>,2|H<1>,2|O<2>,3|C<3>} N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[6]O[5])(Ge[6]N[5,6]Cl){2|C<4>,2|H<1>,3|C<3>} N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[6]O[5])(Ge[6]N[5,6]Cl){2|C<4>,2|H<1>,3|C<3>} 87.1139 0.000 1 87.1139 0.000 1 87.1139 0.000 1 87.1139 0.000 1 87.4016 0.166 2 87.4016 0.166 2 278 542 542 6:SP2_SP2_SP2 Ge[6] N[5,6] N[5,6] 3:3:3: 3:4:3: 3:4:3: N[5,6]-3:N[5,6]-3:O[5]-3: Ge[6]-3:C[5]-4:C[5,6]-3: Ge[6]-3:C[5]-4:C[5,6]-3: Ge[6](N[5,6]C[5,6]C[5])2(O[5]C[5]2) N[5,6](Ge[6]N[5,6]O[5])(C[5]C[6a]C[5]H)(C[5,6]C[6]O[5]) N[5,6](Ge[6]N[5,6]O[5])(C[5]C[6a]C[5]H)(C[5,6]C[6]O[5]) Ge[6](N[5,6]C[5,6]C[5])2(O[5]C[5]2){2|O<2>,3|C<3>,4|C<4>,6|H<1>} N[5,6](Ge[6]N[5,6]O[5])(C[5]C[6a]C[5]H)(C[5,6]C[6]O[5]){2|H<1>,3|C<3>,4|C<4>} N[5,6](Ge[6]N[5,6]O[5])(C[5]C[6a]C[5]H)(C[5,6]C[6]O[5]){2|H<1>,3|C<3>,4|C<4>} 87.6893 0.000 1 87.6893 0.000 1 87.6893 0.000 1 87.6893 0.000 1 87.4016 0.166 2 87.4016 0.166 2 278 542 790 0:SP2_SP-NON_SP2 Ge[6] N[5,6] Cl 3:3:1: 4:3:3: 3: N[5,6]-3:N[5,6]-3:Cl-1: C[5]-4:C[5,6]-3:Ge[6]-3: Ge[6]-3: Ge[6](N[5,6]C[5,6]C[5])2(Cl) N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[6]O[5])(Ge[6]N[5,6]Cl) Cl(Ge[6]N[5,6]2) Ge[6](N[5,6]C[5,6]C[5])2(Cl){2|C<4>,2|H<1>,2|O<2>,3|C<3>} N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[6]O[5])(Ge[6]N[5,6]Cl){2|C<4>,2|H<1>,3|C<3>} Cl(Ge[6]N[5,6]2) 94.0151 1.211 2 94.0151 1.466 2 94.0151 1.466 2 94.0151 1.466 2 94.0151 1.466 2 94.0151 1.466 2 278 542 916 0:SP2_SP2_SP3 Ge[6] N[5,6] O[5] 3:3:3: 3:4:3: 3:4:4: N[5,6]-3:N[5,6]-3:O[5]-3: Ge[6]-3:C[5]-4:C[5,6]-3: Ge[6]-3:C[5]-4:C[5]-4: Ge[6](N[5,6]C[5,6]C[5])2(O[5]C[5]2) N[5,6](Ge[6]N[5,6]O[5])(C[5]C[6a]C[5]H)(C[5,6]C[6]O[5]) O[5](Ge[6]N[5,6]2)(C[5]C[5]HH)2 Ge[6](N[5,6]C[5,6]C[5])2(O[5]C[5]2){2|O<2>,3|C<3>,4|C<4>,6|H<1>} N[5,6](Ge[6]N[5,6]O[5])(C[5]C[6a]C[5]H)(C[5,6]C[6]O[5]){2|H<1>,3|C<3>,4|C<4>} O[5](Ge[6]N[5,6]2)(C[5]C[5]HH)2{2|C<3>,2|C<4>,4|H<1>} 91.1205 4.303 2 91.1205 18.518 2 91.1205 18.518 2 91.1205 18.518 2 91.1205 18.518 2 91.1205 18.518 2 278 622 790 0:SP2_SP-NON_SP2 Ge[6] O[6] Cl 3:2:1: 3:3: 3: N[6]-3:O[6]-2:Cl-1: Ge[6]-3:C[6]-3: Ge[6]-3: Ge[6](N[6]C[6a]C[6])(O[6]C[6])(Cl) O[6](Ge[6]N[6]Cl)(C[6]C[6]C) Cl(Ge[6]N[6]O[6]) Ge[6](N[6]C[6a]C[6])(O[6]C[6])(Cl){2|C<4>,3|C<3>} O[6](Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<3>} Cl(Ge[6]N[6]O[6]) 93.6121 0.000 1 93.6121 0.000 1 93.6121 0.000 1 93.6121 0.000 1 93.6121 0.000 1 93.6121 0.000 1 278 622 856 6:SP2_SP2_SP2 Ge[6] O[6] N[6] 3:2:1: 3:3: 3:3:3: N[6]-3:O[6]-2:Cl-1: Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])(O[6]C[6])(Cl) O[6](Ge[6]N[6]Cl)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]O[6]Cl)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])(O[6]C[6])(Cl){2|C<4>,3|C<3>} O[6](Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<3>} N[6](C[6a]C[6a]2)(Ge[6]O[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,3|C<3>} 90.0080 0.000 1 90.0080 0.000 1 90.0080 0.000 1 90.0080 0.000 1 90.0080 0.000 1 90.0080 0.000 1 278 643 643 0:SP2_SP2_SP2 Ge[6] C[6,6a] C[6a] 3:3:3: 3:3:3: 3:3:3: C[6,6a]-3:C[6,6a]-3:C[6a]-3: Ge[6]-3:C[6,6a]-3:C[6a]-3: Ge[6]-3:C[6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2) C[6,6a](Ge[6]C[6,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) C[6a](Ge[6]C[6,6a]2)(C[6a]C[6a]C)2 Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,7|C<3>} C[6,6a](Ge[6]C[6,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){3|H<1>,5|C<3>} C[6a](Ge[6]C[6,6a]2)(C[6a]C[6a]C)2{2|H<1>,5|C<3>} 126.3560 4.707 2 126.3560 22.151 2 126.3560 22.151 2 126.3560 22.151 2 126.3560 22.151 2 126.3560 22.151 2 278 643 643 6:SP2_SP2_SP2 Ge[6] C[6,6a] C[6,6a] 3:3:3: 3:3:3: 3:3:3: C[6,6a]-3:C[6,6a]-3:C[6a]-3: Ge[6]-3:C[6,6a]-3:C[6a]-3: Ge[6]-3:C[6,6a]-3:C[6a]-3: Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2) C[6,6a](Ge[6]C[6,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) C[6,6a](Ge[6]C[6,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H) Ge[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,7|C<3>} C[6,6a](Ge[6]C[6,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){3|H<1>,5|C<3>} C[6,6a](Ge[6]C[6,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6a]C[6a]H){3|H<1>,5|C<3>} 107.1030 0.000 1 107.1030 0.000 1 107.1030 0.000 1 107.1030 0.000 1 107.1030 0.000 1 107.1030 0.000 1 278 643 762 0:SP2_SP2_SP2 Ge[6] C[6a] C[6] 3:3:3: 3:3:3: 3:3:1: C[6a]-3:C[6]-3:C[6]-3: C[6a]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:C[6]-3:H-1: Ge[6](C[6a]C[6a]2)(C[6]C[6]H)2 C[6a](C[6a]C[6a]C)2(Ge[6]C[6]2) C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H) Ge[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<4>,2|H<1>,3|C<3>} C[6a](C[6a]C[6a]C)2(Ge[6]C[6]2){3|C<3>,4|H<1>} C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>} 127.0850 2.089 2 127.0850 4.363 2 127.0850 4.363 2 120.3133 139.748 3 120.5462 79.680 5 120.5462 79.680 5 278 643 762 0:SP2_SP2_SP2 Ge[6] C[6a] C[6] 3:3:3: 3:3:3: 3:3:1: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6]-3:C[6a]-3:C[6a]-3: Ge[6]-3:C[6]-3:H-1: Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H) C[6a](Ge[6]Ge[6]C[6])(C[6a]C[6a]C)2 C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H) Ge[6](Ge[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>} C[6a](Ge[6]Ge[6]C[6])(C[6a]C[6a]C)2{3|H<1>,4|C<3>} C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>} 106.7700 0.000 1 106.7700 0.000 1 106.7700 0.000 1 120.3133 139.748 3 120.5462 79.680 5 120.5462 79.680 5 278 643 762 0:SP2_SP2_SP2 Ge[6] C[6a] C[6] 3:3:3: 3:3:3: 3:3:3: C[6]-3:C[6]-3:C[6a]-3: C[6a]-3:C[6a]-3:Ge[6]-3: C[6]-3:Ge[6]-3:C[6a]-3: Ge[6](C[6]C[6a]C[6])2(C[6a]C[6a]2) C[6a](C[6a]C[6a]C)2(Ge[6]C[6]2) C[6](C[6]C[6a]Ge[6])(Ge[6]C[6a]C[6])(C[6a]C[6a]2) Ge[6](C[6]C[6a]C[6])2(C[6a]C[6a]2){1|Ge<3>,2|C<4>,8|C<3>} C[6a](C[6a]C[6a]C)2(Ge[6]C[6]2){2|H<1>,5|C<3>} C[6](C[6]C[6a]Ge[6])(Ge[6]C[6a]C[6])(C[6a]C[6a]2){2|H<1>,9|C<3>} 120.8955 6.230 2 120.8955 38.817 2 120.8955 38.817 2 120.8955 38.817 2 120.5462 79.680 5 120.5462 79.680 5 278 658 658 6:SP2_SP3_SP3 Ge[6] Si[6] Si[6] 4:4:3: 4:3:4:4: 4:3:4:4: Si[6]-4:Si[6]-4:C-3: Si[6]-4:Ge[6]-3:C-4:C-4: Si[6]-4:Ge[6]-3:C-4:C-4: Ge[6](Si[6]Si[6]CC)2(CC[6]O) Si[6](Si[6]Ge[6]CC)(Ge[6]Si[6]C)(CH3)2 Si[6](Si[6]Ge[6]CC)(Ge[6]Si[6]C)(CH3)2 Ge[6](Si[6]Si[6]CC)2(CC[6]O){1|Ge<4>,4|C<4>} Si[6](Si[6]Ge[6]CC)(Ge[6]Si[6]C)(CH3)2{3|Si<4>,2|C<4>} Si[6](Si[6]Ge[6]CC)(Ge[6]Si[6]C)(CH3)2{3|Si<4>,2|C<4>} 123.3910 0.000 1 123.3910 0.000 1 123.3910 0.000 1 123.3910 0.000 1 123.3910 0.000 1 123.3910 0.000 1 278 658 930 0:SP2_SP2_SP3 Ge[6] Si[6] C 4:4:3: 4:3:4:4: 3:3:2: Si[6]-4:Si[6]-4:C-3: Si[6]-4:Ge[6]-3:C-4:C-4: Ge[6]-3:C[6]-3:O-2: Ge[6](Si[6]Si[6]CC)2(CC[6]O) Si[6](Si[6]Ge[6]CC)(Ge[6]Si[6]C)(CH3)2 C(Ge[6]Si[6]2)(C[6]C[6]2)(OSi) Ge[6](Si[6]Si[6]CC)2(CC[6]O){1|Ge<4>,4|C<4>} Si[6](Si[6]Ge[6]CC)(Ge[6]Si[6]C)(CH3)2{3|Si<4>,2|C<4>} C(Ge[6]Si[6]2)(C[6]C[6]2)(OSi) 114.1505 3.458 2 114.1505 11.961 2 114.1505 11.961 2 114.1505 11.961 2 114.1505 11.961 2 114.1505 11.961 2 278 762 762 6:SP2_SP2_SP2 Ge[6] C[6] C[6] 3:3:3: 3:3:1: 3:3:1: C[6a]-3:C[6]-3:C[6]-3: Ge[6]-3:C[6]-3:H-1: Ge[6]-3:C[6]-3:H-1: Ge[6](C[6a]C[6a]2)(C[6]C[6]H)2 C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H) C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H) Ge[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<4>,2|H<1>,3|C<3>} C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>} C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>} 105.8090 0.000 1 105.8090 0.000 1 105.8090 0.000 1 105.8090 0.000 1 110.6435 46.745 2 110.6435 46.745 2 278 762 762 6:SP2_SP2_SP2 Ge[6] C[6] C[6] 3:3:3: 3:3:3: 3:3:3: C[6]-3:C[6]-3:C[6a]-3: C[6]-3:Ge[6]-3:C[6a]-3: C[6]-3:Ge[6]-3:C[6a]-3: Ge[6](C[6]C[6a]C[6])2(C[6a]C[6a]2) C[6](C[6]C[6a]Ge[6])(Ge[6]C[6a]C[6])(C[6a]C[6a]2) C[6](C[6]C[6a]Ge[6])(Ge[6]C[6a]C[6])(C[6a]C[6a]2) Ge[6](C[6]C[6a]C[6])2(C[6a]C[6a]2){1|Ge<3>,2|C<4>,8|C<3>} C[6](C[6]C[6a]Ge[6])(Ge[6]C[6a]C[6])(C[6a]C[6a]2){2|H<1>,9|C<3>} C[6](C[6]C[6a]Ge[6])(Ge[6]C[6a]C[6])(C[6a]C[6a]2){2|H<1>,9|C<3>} 115.4780 0.000 1 115.4780 0.000 1 115.4780 0.000 1 115.4780 0.000 1 110.6435 46.745 2 110.6435 46.745 2 278 762 856 6:SP2_SP2_SP2 Ge[3x6] C[6,6] N[6,6] 3:3:3: 3:3:1: 3:3:3: N[6,6]-3:N[6,6]-3:C[6,6]-3: C[6,6]-3:Ge[3x6]-3:H-1: Ge[3x6]-3:C[6,6]-3:C[6a]-3: Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H) C[6,6](C[6,6]C[3x6]C[6a])(Ge[3x6]N[6,6]2)(H) N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2) Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H){2|C<4>,6|C<3>} C[6,6](C[6,6]C[3x6]C[6a])(Ge[3x6]N[6,6]2)(H){1|H<1>,6|C<3>} N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>} 87.9308 4.405 2 87.9308 19.405 2 87.9308 19.405 2 88.3861 7.637 4 88.3861 7.637 4 88.3861 7.637 4 278 762 856 6:SP2_SP2_SP2 Ge[3x6] C[6,6] N[6,6] 3:3:3: 3:3:1: 3:3:3: N[6,6]-3:N[6,6]-3:C[6,6]-3: Ge[3x6]-3:C[6,6]-3:H-1: Ge[3x6]-3:C[6,6]-3:C[6a]-3: Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H) C[6,6](Ge[3x6]N[6,6]2)(C[6,6]C[3x6]H)(H) N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2) Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H){1|H<1>,2|C<4>,5|C<3>} C[6,6](Ge[3x6]N[6,6]2)(C[6,6]C[3x6]H)(H){1|H<1>,4|C<3>} N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>} 88.8414 1.636 2 88.8414 2.677 2 88.8414 2.677 2 88.3861 7.637 4 88.3861 7.637 4 88.3861 7.637 4 278 790 818 0:SP2_SP-NON_SP2 Ge[6] Cl C[5,6] 3:3:1: 3: 3:3:3: C[5,6]-3:C[5,6]-3:Cl-1: Ge[6]-3: N[5,6]-3:Ge[6]-3:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(Cl) Cl(Ge[6]C[5,6]2) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Cl)(N[5]C[6a]C[5]) Ge[6](C[5,6]N[5,6]N[5])2(Cl){1|C<4>,6|C<3>} Cl(Ge[6]C[5,6]2) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Cl)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} 91.1290 0.935 2 91.1290 0.873 2 91.1290 0.873 2 90.5411 1.247 4 90.5411 1.247 4 90.5411 1.247 4 278 790 818 0:SP2_SP-NON_SP2 Ge[6] Cl C[5,6] 3:3:1: 3: 3:3:3: C[5,6]-3:N[6]-3:Cl-1: Ge[6]-3: N[5,6]-3:N[5]-3:Ge[6]-3: Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(Cl) Cl(Ge[6]C[5,6]N[6]) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]Cl) Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(Cl){1|C<4>,2|H<1>,5|C<3>} Cl(Ge[6]C[5,6]N[6]) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]Cl){1|C<4>,3|C<3>,4|H<1>} 89.9532 1.219 2 89.9532 1.486 2 89.9532 1.486 2 90.5411 1.247 4 90.5411 1.247 4 90.5411 1.247 4 278 790 849 0:SP2_SP-NON_SP3 Ge[6] Cl P[6] 4:3:1: 3: 3:3:3:3: P[6]-4:N[6]-3:Cl-1: Ge[6]-3: C[6,6a]-3:C[6a]-3:C[6a]-3:Ge[6]-3: Ge[6](P[6]C[6,6a]C[6a]2)(N[6]C[6a]C[6])(Cl) Cl(Ge[6]N[6]P[6]) P[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)2(Ge[6]N[6]Cl) Ge[6](P[6]C[6,6a]C[6a]2)(N[6]C[6a]C[6])(Cl){2|H<1>,8|C<3>} Cl(Ge[6]N[6]P[6]) P[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)2(Ge[6]N[6]Cl){1|C<4>,5|H<1>,7|C<3>} 90.4935 0.000 1 90.4935 0.000 1 90.4935 0.000 1 90.4935 0.000 1 90.4935 0.000 1 90.4935 0.000 1 278 790 856 0:SP2_SP-NON_SP2 Ge[6] Cl N[6,6] 3:3:1: 3: 3:3:3: N[6,6a]-3:N[6,6]-3:Cl-1: Ge[6]-3: C[6,6]-3:Ge[6]-3:C[6]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(Cl) Cl(Ge[6]N[6,6a]N[6,6]) N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]Cl)(C[6]C[6]H) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(Cl){1|N<2>,2|H<1>,4|C<3>} Cl(Ge[6]N[6,6a]N[6,6]) N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]Cl)(C[6]C[6]H){2|H<1>,3|C<3>} 94.1102 1.621 2 94.1102 2.628 2 94.1102 2.628 2 94.1102 2.628 2 94.1102 2.628 2 94.9099 3.243 17 278 790 856 0:SP2_SP-NON_SP2 Ge[6] Cl N[6] 3:2:1: 3: 3:3:3: N[6]-3:O[6]-2:Cl-1: Ge[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])(O[6]C[6])(Cl) Cl(Ge[6]N[6]O[6]) N[6](C[6a]C[6a]2)(Ge[6]O[6]Cl)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])(O[6]C[6])(Cl){2|C<4>,3|C<3>} Cl(Ge[6]N[6]O[6]) N[6](C[6a]C[6a]2)(Ge[6]O[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,3|C<3>} 95.5324 0.000 1 95.5324 0.000 1 95.5324 0.000 1 95.5324 0.000 1 95.0166 3.415 15 94.9099 3.243 17 278 790 856 0:SP2_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1: 3: 3:3:3: N[6]-3:N[6]-3:Cl-1: Ge[6]-3: C[6,6]-3:C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(Cl) Cl(Ge[6]N[6]2) N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]Cl) Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(Cl){1|C<4>,6|C<3>} Cl(Ge[6]N[6]2) N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]Cl){2|H<1>,4|C<3>,4|C<4>} 93.9218 0.000 1 93.9218 0.000 1 93.9218 0.000 1 94.5353 1.486 10 95.0166 3.415 15 94.9099 3.243 17 278 790 856 0:SP2_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1: 3: 3:3:3: N[6]-3:N[6]-3:Cl-1: Ge[6]-3: C[6]-3:C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(Cl) Cl(Ge[6]N[6]2) N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]Cl) Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(Cl){1|C<4>,6|C<3>} Cl(Ge[6]N[6]2) N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]Cl){3|C<4>,6|C<3>} 95.5996 0.000 1 95.5996 0.000 1 95.5996 0.000 1 94.5353 1.486 10 95.0166 3.415 15 94.9099 3.243 17 278 790 856 0:SP2_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1: 3: 3:3:3: N[6]-3:N[6]-3:Cl-1: Ge[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(Cl) Cl(Ge[6]N[6]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(Cl){2|C<4>,5|C<3>} Cl(Ge[6]N[6]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 94.4789 1.301 8 94.4789 1.692 8 94.4789 1.692 8 94.5353 1.486 10 95.0166 3.415 15 94.9099 3.243 17 278 790 856 0:SP2_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1: 3: 3:3:4: C[5,6]-3:N[6]-3:Cl-1: Ge[6]-3: Ge[6]-3:C[6a]-3:C[6]-4: Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(Cl) Cl(Ge[6]C[5,6]N[6]) N[6](Ge[6]C[5,6]Cl)(C[6a]C[6a]2)(C[6]C[6]HH) Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(Cl){1|C<4>,2|H<1>,5|C<3>} Cl(Ge[6]C[5,6]N[6]) N[6](Ge[6]C[5,6]Cl)(C[6a]C[6a]2)(C[6]C[6]HH){2|C<3>,2|C<4>,2|H<1>,2|N<3>} 98.6724 0.564 2 98.6724 0.318 2 98.6724 0.318 2 96.0907 9.078 4 95.0166 3.415 15 94.9099 3.243 17 278 790 856 0:SP2_SP-NON_SP2 Ge[6] Cl N[6] 3:3:1: 3: 3:3:4: N[6]-3:N[6]-3:Cl-1: Ge[6]-3: S[6]-3:Ge[6]-3:Si-4: Ge[6](N[6]Ge[6]S)(N[6]S[6]Si)(Cl) Cl(Ge[6]N[6]2) N[6](S[6]C[6a]N[6])(Ge[6]N[6]Cl)(SiC3) Ge[6](N[6]Ge[6]S)(N[6]S[6]Si)(Cl){1|Cl<1>,1|C<3>,1|N<3>} Cl(Ge[6]N[6]2) N[6](S[6]C[6a]N[6])(Ge[6]N[6]Cl)(SiC3){1|Ge<3>,1|Si<4>,1|S<3>,2|C<3>} 93.5091 0.506 2 93.5091 0.256 2 93.5091 0.256 2 96.0907 9.078 4 95.0166 3.415 15 94.9099 3.243 17 278 790 856 0:SP2_SP-NON_SP3 Ge[6] Cl N[6] 3:3:1: 3: 3:3:3: N[6]-3:N[6]-3:Cl-1: Ge[6]-3: Ge[6]-3:Ge[6]-3:S-3: Ge[6](N[6]Ge[6]S)(N[6]S[6]Si)(Cl) Cl(Ge[6]N[6]2) N[6](Ge[6]N[6]Cl)2(SC[6a]N) Ge[6](N[6]Ge[6]S)(N[6]S[6]Si)(Cl){1|Cl<1>,1|C<3>,1|N<3>} Cl(Ge[6]N[6]2) N[6](Ge[6]N[6]Cl)2(SC[6a]N){2|Si<4>,1|S<3>} 96.0416 1.736 2 96.0416 3.013 2 96.0416 3.013 2 96.0416 3.013 2 97.0136 4.341 3 97.0136 4.341 3 278 790 856 0:SP2_SP-NON_SP3 Ge[6] Cl N[6] 4:3:1: 3: 4:3:3: P[6]-4:N[6]-3:Cl-1: Ge[6]-3: C[6]-4:C[6a]-3:Ge[6]-3: Ge[6](P[6]C[6,6a]C[6a]2)(N[6]C[6a]C[6])(Cl) Cl(Ge[6]N[6]P[6]) N[6](C[6]C[6,6a]HH)(C[6a]C[6a]2)(Ge[6]P[6]Cl) Ge[6](P[6]C[6,6a]C[6a]2)(N[6]C[6a]C[6])(Cl){2|H<1>,8|C<3>} Cl(Ge[6]N[6]P[6]) N[6](C[6]C[6,6a]HH)(C[6a]C[6a]2)(Ge[6]P[6]Cl){2|C<4>,6|C<3>} 98.9577 0.000 1 98.9577 0.000 1 98.9577 0.000 1 98.9577 0.000 1 97.0136 4.341 3 97.0136 4.341 3 278 818 818 6:SP2_SP2_SP2 Ge[6] C[5,6] C[5,6] 3:3:1: 3:3:3: 3:3:3: C[5,6]-3:C[5,6]-3:Cl-1: N[5,6]-3:Ge[6]-3:N[5]-3: N[5,6]-3:Ge[6]-3:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(Cl) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Cl)(N[5]C[6a]C[5]) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Cl)(N[5]C[6a]C[5]) Ge[6](C[5,6]N[5,6]N[5])2(Cl){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Cl)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Cl)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} 85.2100 0.000 1 85.2100 0.000 1 85.2100 0.000 1 85.2100 0.000 1 85.3615 0.458 4 85.3615 0.458 4 278 818 818 6:SP2_SP2_SP2 Ge[6] C[5,6] C[5,6] 3:3:2: 3:3:3: 3:3:3: C[5,6]-3:C[5,6]-3:N-2: N[5,6]-3:N[5]-3:Ge[6]-3: N[5,6]-3:N[5]-3:Ge[6]-3: Ge[6](C[5,6]N[5,6]N[5])2(NN) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]C[5,6]N) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]C[5,6]N) Ge[6](C[5,6]N[5,6]N[5])2(NN){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]C[5,6]N){2|C<3>,2|N<3>,4|H<1>} C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]C[5,6]N){2|C<3>,2|N<3>,4|H<1>} 84.4938 0.000 1 84.4938 0.000 1 84.4938 0.000 1 85.2819 1.242 2 85.3615 0.458 4 85.3615 0.458 4 278 818 818 6:SP2_SP2_SP2 Ge[6] C[5,6] C[5,6] 3:3:2: 3:3:3: 3:3:3: C[5,6]-3:C[5,6]-3:Se-2: N[5,6]-3:Ge[6]-3:N[5]-3: N[5,6]-3:Ge[6]-3:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(SeGa) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Se)(N[5]C[6a]C[5]) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Se)(N[5]C[6a]C[5]) Ge[6](C[5,6]N[5,6]N[5])2(SeGa){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Se)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Se)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} 86.0701 0.000 1 86.0701 0.000 1 86.0701 0.000 1 85.2819 1.242 2 85.3615 0.458 4 85.3615 0.458 4 278 818 818 6:SP2_SP2_SP2 Ge[6] C[5,6] C[5,6] 3:3:4: 3:3:3: 3:3:3: C[5,6]-3:C[5,6]-3:Ga-4: N[5,6]-3:Ge[6]-3:N[5]-3: N[5,6]-3:Ge[6]-3:N[5]-3: Ge[6](C[5,6]N[5,6]N[5])2(GaCl3) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Ga)(N[5]C[6a]C[5]) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Ga)(N[5]C[6a]C[5]) Ge[6](C[5,6]N[5,6]N[5])2(GaCl3){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Ga)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Ga)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} 85.6723 0.000 1 85.6723 0.000 1 85.6723 0.000 1 85.6723 0.000 1 85.3615 0.458 4 85.3615 0.458 4 278 818 856 6:SP2_SP2_SP2 Ge[6] C[5,6] N[6] 3:3:1: 3:3:3: 3:3:4: C[5,6]-3:N[6]-3:Cl-1: N[5,6]-3:N[5]-3:Ge[6]-3: Ge[6]-3:C[6a]-3:C[6]-4: Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(Cl) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]Cl) N[6](Ge[6]C[5,6]Cl)(C[6a]C[6a]2)(C[6]C[6]HH) Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(Cl){1|C<4>,2|H<1>,5|C<3>} C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]Cl){1|C<4>,3|C<3>,4|H<1>} N[6](Ge[6]C[5,6]Cl)(C[6a]C[6a]2)(C[6]C[6]HH){2|C<3>,2|C<4>,2|H<1>,2|N<3>} 88.0589 0.300 2 88.0589 0.090 2 88.0589 0.090 2 88.0589 0.090 2 87.8071 0.235 3 87.8071 0.235 3 278 818 856 6:SP2_SP2_SP2 Ge[6] C[5,6] N[6] 3:3:2: 3:3:3: 3:3:4: C[5,6]-3:N[6]-3:O-2: N[5,6]-3:N[5]-3:Ge[6]-3: Ge[6]-3:C[6a]-3:C[6]-4: Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(OC) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]O) N[6](Ge[6]C[5,6]O)(C[6a]C[6a]2)(C[6]C[6]HH) Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(OC){1|C<4>,2|H<1>,5|C<3>} C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]O){1|C<4>,3|C<3>,4|H<1>} N[6](Ge[6]C[5,6]O)(C[6a]C[6a]2)(C[6]C[6]HH){2|C<3>,2|C<4>,2|H<1>,2|N<3>} 87.3035 0.000 1 87.3035 0.000 1 87.3035 0.000 1 87.3035 0.000 1 87.8071 0.235 3 87.8071 0.235 3 278 818 893 0:SP2_SP2_SP2 Ge[6] C[5,6] O 3:3:2: 3:3:3: 3:4: C[5,6]-3:N[6]-3:O-2: N[5,6]-3:N[5]-3:Ge[6]-3: Ge[6]-3:C-4: Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(OC) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]O) O(Ge[6]C[5,6]N[6])(CC3) Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(OC){1|C<4>,2|H<1>,5|C<3>} C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]N[6]O){1|C<4>,3|C<3>,4|H<1>} O(Ge[6]C[5,6]N[6])(CC3) 87.7111 0.000 1 87.7111 0.000 1 87.7111 0.000 1 87.7111 0.000 1 87.7111 0.000 1 87.7111 0.000 1 278 818 921 0:SP2_SP2_SP3 Ge[6] C[5,6] Se 3:3:2: 3:3:3: 3:4: C[5,6]-3:C[5,6]-3:Se-2: N[5,6]-3:Ge[6]-3:N[5]-3: Ge[6]-3:Ga-4: Ge[6](C[5,6]N[5,6]N[5])2(SeGa) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Se)(N[5]C[6a]C[5]) Se(Ge[6]C[5,6]2)(GaCl3) Ge[6](C[5,6]N[5,6]N[5])2(SeGa){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Se)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} Se(Ge[6]C[5,6]2)(GaCl3) 101.7053 2.947 2 101.7053 8.684 2 101.7053 8.684 2 101.7053 8.684 2 101.7053 8.684 2 101.7053 8.684 2 278 818 941 0:SP2_SP2_SP2 Ge[6] C[5,6] N 3:3:2: 3:3:3: 3:2: C[5,6]-3:C[5,6]-3:N-2: N[5,6]-3:N[5]-3:Ge[6]-3: Ge[6]-3:N-2: Ge[6](C[5,6]N[5,6]N[5])2(NN) C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]C[5,6]N) N(Ge[6]C[5,6]2)(NN) Ge[6](C[5,6]N[5,6]N[5])2(NN){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(Ge[6]C[5,6]N){2|C<3>,2|N<3>,4|H<1>} N(Ge[6]C[5,6]2)(NN) 89.2643 0.168 2 89.2643 0.028 2 89.2643 0.028 2 89.2643 0.028 2 89.2643 0.028 2 89.2643 0.028 2 278 818 984 0:SP2_SP-NON_SP2 Ge[6] C[5,6] Ga 3:3:4: 3:3:3: 3:1:1:1: C[5,6]-3:C[5,6]-3:Ga-4: N[5,6]-3:Ge[6]-3:N[5]-3: Ge[6]-3:Cl-1:Cl-1:Cl-1: Ge[6](C[5,6]N[5,6]N[5])2(GaCl3) C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Ga)(N[5]C[6a]C[5]) Ga(Ge[6]C[5,6]2)(Cl)3 Ge[6](C[5,6]N[5,6]N[5])2(GaCl3){1|C<4>,6|C<3>} C[5,6](N[5,6]C[5]C[6])(Ge[6]C[5,6]Ga)(N[5]C[6a]C[5]){2|C<3>,2|N<3>,4|H<1>} Ga(Ge[6]C[5,6]2)(Cl)3 90.3069 0.739 2 90.3069 0.545 2 90.3069 0.545 2 90.3069 0.545 2 90.3069 0.545 2 90.3069 0.545 2 278 849 849 6:SP2_SP3_SP3 Ge[6] P[6] P[6] 4:4:4: 3:3:4:3: 3:3:4:3: P[6]-4:P[6]-4:C-4: C[6a]-3:C[6a]-3:C[6]-4:Ge[6]-3: C[6a]-3:C[6a]-3:C[6]-4:Ge[6]-3: Ge[6](P[6]C[6a]2C[6])2(CHHP) P[6](C[6a]C[6a]2)2(C[6]B[6]HH)(Ge[6]P[6]C) P[6](C[6a]C[6a]2)2(C[6]B[6]HH)(Ge[6]P[6]C) Ge[6](P[6]C[6a]2C[6])2(CHHP){1|B<4>,4|H<1>,8|C<3>} P[6](C[6a]C[6a]2)2(C[6]B[6]HH)(Ge[6]P[6]C){1|C<4>,4|H<1>,8|C<3>} P[6](C[6a]C[6a]2)2(C[6]B[6]HH)(Ge[6]P[6]C){1|C<4>,4|H<1>,8|C<3>} 90.0281 0.000 1 90.0281 0.000 1 90.0281 0.000 1 90.0281 0.000 1 90.0281 0.000 1 90.0281 0.000 1 278 849 856 6:SP2_SP3_SP3 Ge[6] P[6] N[6] 4:3:1: 3:3:3:3: 4:3:3: P[6]-4:N[6]-3:Cl-1: C[6,6a]-3:C[6a]-3:C[6a]-3:Ge[6]-3: C[6]-4:C[6a]-3:Ge[6]-3: Ge[6](P[6]C[6,6a]C[6a]2)(N[6]C[6a]C[6])(Cl) P[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)2(Ge[6]N[6]Cl) N[6](C[6]C[6,6a]HH)(C[6a]C[6a]2)(Ge[6]P[6]Cl) Ge[6](P[6]C[6,6a]C[6a]2)(N[6]C[6a]C[6])(Cl){2|H<1>,8|C<3>} P[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)2(Ge[6]N[6]Cl){1|C<4>,5|H<1>,7|C<3>} N[6](C[6]C[6,6a]HH)(C[6a]C[6a]2)(Ge[6]P[6]Cl){2|C<4>,6|C<3>} 84.3913 0.000 1 84.3913 0.000 1 84.3913 0.000 1 84.3913 0.000 1 84.3913 0.000 1 84.3913 0.000 1 278 856 856 0:SP2_SP2_SP2 Ge[6,6] N[6] N[6] 3:3:3: 3:3:4: 3:3:4: N[6,6,6a]-3:N[6]-3:N[6]-3: Ge[6,6]-3:C[6]-3:Si-4: Ge[6,6]-3:C[6]-3:Si-4: Ge[6,6](N[6,6,6a]C[6,6a]2)(N[6]C[6]Si)2 N[6](Ge[6,6]N[6,6,6a]N[6])(C[6]C[6a]C[6])(SiC3) N[6](Ge[6,6]N[6,6,6a]N[6])(C[6]C[6a]C[6])(SiC3) Ge[6,6](N[6,6,6a]C[6,6a]2)(N[6]C[6]Si)2{6|C<3>} N[6](Ge[6,6]N[6,6,6a]N[6])(C[6]C[6a]C[6])(SiC3){1|Si<4>,1|H<1>,5|C<3>} N[6](Ge[6,6]N[6,6,6a]N[6])(C[6]C[6a]C[6])(SiC3){1|Si<4>,1|H<1>,5|C<3>} 108.3070 0.000 1 108.3070 0.000 1 108.3070 0.000 1 108.3070 0.000 1 108.3070 0.000 1 108.3070 0.000 1 278 856 856 6:SP2_SP2_SP2 Ge[3x6] N[6,6] N[6,6] 3:3:3: 3:3:3: 3:3:3: N[6,6]-3:N[6,6]-3:C[6,6]-3: Ge[3x6]-3:C[6,6]-3:C[6a]-3: Ge[3x6]-3:C[6,6]-3:C[6a]-3: Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H) N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2) N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2) Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H){1|H<1>,2|C<4>,5|C<3>} N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>} N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>} 89.7032 0.000 1 89.3954 0.189 2 89.3954 0.189 2 89.3954 0.189 2 89.3954 0.189 2 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[3x6] N[6,6] N[6,6] 3:3:3: 3:3:3: 3:3:3: N[6,6]-3:N[6,6]-3:C[6,6]-3: Ge[3x6]-3:C[6,6]-3:C[6a]-3: Ge[3x6]-3:C[6,6]-3:C[6a]-3: Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H) N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2) N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2) Ge[3x6](N[6,6]C[6,6]C[6a])2(C[6,6]C[6,6]H){2|C<4>,6|C<3>} N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>} N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>} 89.0876 0.000 1 89.3954 0.189 2 89.3954 0.189 2 89.3954 0.189 2 89.3954 0.189 2 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:1: 3:3:3: 3:3:3: N[6]-3:N[6]-3:Cl-1: C[6,6]-3:C[6a]-3:Ge[6]-3: C[6]-3:C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(Cl) N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]Cl) N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]Cl) Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(Cl){1|C<4>,6|C<3>} N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]Cl){2|H<1>,4|C<3>,4|C<4>} N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]Cl){3|C<4>,6|C<3>} 91.2283 0.000 1 91.2283 0.000 1 91.2283 0.000 1 90.9118 0.207 7 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:1: 3:3:3: 3:3:3: N[6]-3:N[6]-3:Cl-1: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(Cl) N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(Cl){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.7645 0.508 4 90.7645 0.258 4 90.7645 0.258 4 90.9118 0.207 7 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:1: 3:3:3: 3:3:3: N[6]-3:N[6]-3:H-1: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(H) N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(H){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.6974 0.000 1 90.6974 0.000 1 90.6974 0.000 1 90.9118 0.207 7 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:1: 3:3:3: 3:3:3: N[6]-3:N[6]-3:P-1: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(P) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(P){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 91.3986 0.000 1 91.3986 0.000 1 91.3986 0.000 1 90.9118 0.207 7 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:C-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(CC) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(CC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 91.2966 0.000 1 91.2966 0.000 1 91.2966 0.000 1 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(NN) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(NN){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.8783 0.180 3 90.8783 0.032 3 90.8783 0.032 3 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:O-2: C[6,6]-3:C[6a]-3:Ge[6]-3: C[6]-3:C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(OH) N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]O) N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]O) Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(OH){1|C<4>,6|C<3>} N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]O){2|H<1>,4|C<3>,4|C<4>} N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]O){3|C<4>,6|C<3>} 89.4347 0.000 1 89.4347 0.000 1 89.4347 0.000 1 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(OB) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(OB){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.0797 0.000 1 90.0797 0.000 1 89.6817 1.170 12 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(OB[6a]) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(OB[6a]){3|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){2|C<4>,2|H<1>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){2|C<4>,2|H<1>,4|C<3>} 90.5974 0.927 2 90.5974 0.859 2 89.6817 1.170 12 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(OC) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(OC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 89.1917 1.253 5 89.1917 1.570 5 89.6817 1.170 12 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(OC[6a]) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(OC[6a]){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 89.3226 0.000 1 89.3226 0.000 1 89.6817 1.170 12 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(OP) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(OP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 89.8748 1.107 3 89.8748 1.226 3 89.6817 1.170 12 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:Se-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(SeP) N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(SeP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 88.3306 0.341 3 88.3306 0.116 3 88.3306 0.116 3 89.7269 1.346 20 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: Ge[5]-3:N[6]-3:N[6]-3: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6](Ge[5]C[5]N[5])(N[6]C[6a]C[6])2 N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](Ge[5]C[5]N[5])(N[6]C[6a]C[6])2{3|C<4>,8|C<3>} N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<3>,2|C<4>,5|C<3>} N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<3>,2|C<4>,5|C<3>} 88.6705 0.000 1 88.6705 0.000 1 88.6705 0.000 1 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:C-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(CCC) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(CCC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 91.0584 0.424 4 91.0584 0.180 4 90.8578 0.210 6 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:C-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(CCP) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(CCP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.5698 0.000 1 90.5698 0.000 1 90.8578 0.210 6 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:C-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(CSiN) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(CSiN){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.3436 0.000 1 90.3436 0.000 1 90.8578 0.210 6 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-3: C[6,6]-3:C[6a]-3:Ge[6]-3: C[6]-3:C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(NHH) N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]N) N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]N) Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(NHH){1|C<4>,6|C<3>} N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]N){2|H<1>,4|C<3>,4|C<4>} N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]N){3|C<4>,6|C<3>} 89.3185 0.000 1 89.3185 0.000 1 89.3185 0.000 1 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(NCC) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(NCC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 88.0190 0.000 1 88.0190 0.000 1 89.5454 3.207 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(NC[6a]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(NC[6a]2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 92.0325 0.000 1 92.0325 0.000 1 89.5454 3.207 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(NC[6a]H) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(NC[6a]H){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 88.2274 0.000 1 88.2274 0.000 1 89.5454 3.207 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(NHH) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(NHH){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 88.6038 0.000 1 88.6038 0.000 1 89.5454 3.207 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(NSiN) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(NSiN){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.8443 0.000 1 90.8443 0.000 1 89.5454 3.207 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PC[6]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PC[6]2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 88.0443 0.000 1 88.0443 0.000 1 88.5866 0.878 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PC[6a]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PC[6a]2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 88.1926 0.000 1 88.1926 0.000 1 88.5866 0.878 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PHP) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PHP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 87.9158 0.000 1 87.9158 0.000 1 88.5866 0.878 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PSi2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PSi2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 90.2032 0.000 1 90.2032 0.000 1 88.5866 0.878 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(PSiH) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(PSiH){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} 88.5772 0.000 1 88.5772 0.000 1 88.5866 0.878 5 89.6553 1.936 18 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP2 Ge[6] N[6] N[6] 3:3:4: 3:3:3: 3:3:3: N[6]-3:N[6]-3:C[5]-4: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6]-3:C[6a]-3:C[6]-3: Ge[6](N[6]C[6a]C[6])2(C[5]C[5]2H) N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C) N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C) Ge[6](N[6]C[6a]C[6])2(C[5]C[5]2H){2|C<4>,2|H<1>,7|C<3>} N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,2|H<1>,6|C<3>} N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,2|H<1>,6|C<3>} 86.2600 0.000 1 86.2600 0.000 1 86.2600 0.000 1 86.2600 0.000 1 89.8038 1.809 46 89.7868 1.743 48 278 856 856 6:SP2_SP2_SP3 Ge[3x6] N[3x6] N[6,6] 4:3:3: 3:3:3: 3:4:4: C[4,6,6]-4:N[3x6]-3:N[6,6]-3: Ge[3x6]-3:C[3x6]-3:C[6]-3: Ge[3x6]-3:P[6,6]-4:Si-4: Ge[3x6](C[4,6,6]Ge[4,6,6]C[6a]P[4])(N[3x6]C[3x6]C[6])(N[6,6]P[6,6]Si) N[3x6](Ge[3x6]C[4,6,6]N[6,6])(C[3x6]C[3x6]C[6])(C[6]C[6]C) N[6,6](Ge[3x6]C[4,6,6]N[3x6])(P[6,6]C[3x6]CC)(SiC3) Ge[3x6](C[4,6,6]Ge[4,6,6]C[6a]P[4])(N[3x6]C[3x6]C[6])(N[6,6]P[6,6]Si){1|N<2>,1|N<3>,4|C<3>,5|C<4>} N[3x6](Ge[3x6]C[4,6,6]N[6,6])(C[3x6]C[3x6]C[6])(C[6]C[6]C){1|Ge<3>,1|Si<4>,2|C<3>,2|P<4>,3|H<1>} N[6,6](Ge[3x6]C[4,6,6]N[3x6])(P[6,6]C[3x6]CC)(SiC3){1|Ge<3>,1|H<1>,1|P<4>,3|C<3>} 92.6658 0.000 1 92.6658 0.000 1 92.6658 0.000 1 92.6658 0.000 1 92.6658 0.000 1 93.4221 0.675 3 278 856 856 6:SP2_SP2_SP3 Ge[6] N[6] N[6] 3:3:1: 3:3:4: 3:3:3: N[6]-3:N[6]-3:Cl-1: S[6]-3:Ge[6]-3:Si-4: Ge[6]-3:Ge[6]-3:S-3: Ge[6](N[6]Ge[6]S)(N[6]S[6]Si)(Cl) N[6](S[6]C[6a]N[6])(Ge[6]N[6]Cl)(SiC3) N[6](Ge[6]N[6]Cl)2(SC[6a]N) Ge[6](N[6]Ge[6]S)(N[6]S[6]Si)(Cl){1|Cl<1>,1|C<3>,1|N<3>} N[6](S[6]C[6a]N[6])(Ge[6]N[6]Cl)(SiC3){1|Ge<3>,1|Si<4>,1|S<3>,2|C<3>} N[6](Ge[6]N[6]Cl)2(SC[6a]N){2|Si<4>,1|S<3>} 93.8003 0.702 2 93.8003 0.492 2 93.8003 0.492 2 93.8003 0.492 2 93.8003 0.492 2 93.4221 0.675 3 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:1: N[6]-3:N[6]-3:O-2: C[6,6]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:H-1: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(OH) N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]O) O(Ge[6]N[6]2)(H) Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(OH){1|C<4>,6|C<3>} N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]O){2|H<1>,4|C<3>,4|C<4>} O(Ge[6]N[6]2)(H) 93.8651 0.000 1 93.8651 0.000 1 93.8651 0.000 1 94.5751 1.008 2 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:1: N[6]-3:N[6]-3:O-2: C[6]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:H-1: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(OH) N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]O) O(Ge[6]N[6]2)(H) Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(OH){1|C<4>,6|C<3>} N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]O){3|C<4>,6|C<3>} O(Ge[6]N[6]2)(H) 95.2851 0.000 1 95.2851 0.000 1 95.2851 0.000 1 94.5751 1.008 2 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: B[6a]-3:Ge[6]-3: Ge[6](N[6]C[6a]C[6])2(OB[6a]) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(B[6a]O[6a]2)(Ge[6]N[6]2) Ge[6](N[6]C[6a]C[6])2(OB[6a]){3|C<4>,4|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){2|C<4>,2|H<1>,4|C<3>} O(B[6a]O[6a]2)(Ge[6]N[6]2) 91.8125 0.891 4 91.8125 0.794 4 91.8125 0.794 4 91.6869 7.438 13 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6a]C[6])2(OC[6a]) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(C[6a]C[6a]2)(Ge[6]N[6]2) Ge[6](N[6]C[6a]C[6])2(OC[6a]){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(C[6a]C[6a]2)(Ge[6]N[6]2) 93.5509 0.000 1 93.5509 0.000 1 93.5509 0.000 1 91.6869 7.438 13 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:B-3: Ge[6](N[6]C[6a]C[6])2(OB) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(BC[6a]O) Ge[6](N[6]C[6a]C[6])2(OB){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(BC[6a]O) 91.3752 0.985 2 91.3752 0.969 2 91.3752 0.969 2 91.6869 7.438 13 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-3: Ge[6](N[6]C[6a]C[6])2(OC) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(CC[6a]O) Ge[6](N[6]C[6a]C[6])2(OC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(CC[6a]O) 89.0595 0.527 2 89.0595 0.278 2 88.8203 0.199 4 91.6869 7.438 13 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-3: Ge[6](N[6]C[6a]C[6])2(OC) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(CHO) Ge[6](N[6]C[6a]C[6])2(OC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(CHO) 88.5811 0.302 2 88.5811 0.091 2 88.8203 0.199 4 91.6869 7.438 13 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:P-3: Ge[6](N[6]C[6a]C[6])2(OP) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(PC[6a]2) Ge[6](N[6]C[6a]C[6])2(OP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(PC[6a]2) 96.5484 1.198 2 96.5484 1.434 2 96.5484 1.434 2 91.6869 7.438 13 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:4: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-4: Ge[6](N[6]C[6a]C[6])2(OC) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(CCCH) Ge[6](N[6]C[6a]C[6])2(OC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(CCCH) 95.3662 1.042 2 95.3662 1.086 2 95.9952 1.191 6 94.0888 9.245 10 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:4: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-4: Ge[6](N[6]C[6a]C[6])2(OC) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(CC[5a]CH) Ge[6](N[6]C[6a]C[6])2(OC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(CC[5a]CH) 95.7920 1.274 2 95.7920 1.623 2 95.9952 1.191 6 94.0888 9.245 10 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:4: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-4: Ge[6](N[6]C[6a]C[6])2(OC) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(CC[6a]CH) Ge[6](N[6]C[6a]C[6])2(OC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(CC[6a]CH) 96.8276 0.994 2 96.8276 0.989 2 95.9952 1.191 6 94.0888 9.245 10 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:4: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:P-4: Ge[6](N[6]C[6a]C[6])2(OP) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(PC[6a]2O) Ge[6](N[6]C[6a]C[6])2(OP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(PC[6a]2O) 92.8347 3.388 2 92.8347 11.477 2 91.2292 7.577 4 94.0888 9.245 10 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:3: 3:4: N[6]-3:N[6]-3:O-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:P-4: Ge[6](N[6]C[6a]C[6])2(OP) N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C) O(Ge[6]N[6]2)(PC[6a]2S) Ge[6](N[6]C[6a]C[6])2(OP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} O(Ge[6]N[6]2)(PC[6a]2S) 89.6235 0.971 2 89.6235 0.943 2 91.2292 7.577 4 94.0888 9.245 10 93.1624 10.586 26 93.1624 10.586 26 278 856 893 0:SP2_SP2_SP2 Ge[6] N[6] O 3:3:2: 3:3:4: 3:4: C[5,6]-3:N[6]-3:O-2: Ge[6]-3:C[6a]-3:C[6]-4: Ge[6]-3:C-4: Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(OC) N[6](Ge[6]C[5,6]O)(C[6a]C[6a]2)(C[6]C[6]HH) O(Ge[6]C[5,6]N[6])(CC3) Ge[6](C[5,6]N[5,6]N[5])(N[6]C[6a]C[6])(OC){1|C<4>,2|H<1>,5|C<3>} N[6](Ge[6]C[5,6]O)(C[6a]C[6a]2)(C[6]C[6]HH){2|C<3>,2|C<4>,2|H<1>,2|N<3>} O(Ge[6]C[5,6]N[6])(CC3) 100.2550 0.000 1 100.2550 0.000 1 100.2550 0.000 1 100.2550 0.000 1 93.1624 10.586 26 93.1624 10.586 26 278 856 921 0:SP2_SP2_SP3 Ge[6] N[6] Se 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:Se-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:P-3: Ge[6](N[6]C[6a]C[6])2(SeP) N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C) Se(Ge[6]N[6]2)(PC[6]2) Ge[6](N[6]C[6a]C[6])2(SeP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} Se(Ge[6]N[6]2)(PC[6]2) 98.8208 2.594 2 98.8208 6.729 2 98.8387 4.132 4 98.8387 4.132 4 97.9045 6.299 8 97.9045 6.299 8 278 856 921 0:SP2_SP2_SP3 Ge[6] N[6] Se 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:Se-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:P-3: Ge[6](N[6]C[6a]C[6])2(SeP) N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C) Se(Ge[6]N[6]2)(PC[6a]2) Ge[6](N[6]C[6a]C[6])2(SeP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} Se(Ge[6]N[6]2)(PC[6a]2) 98.8567 2.381 2 98.8567 5.667 2 98.8387 4.132 4 98.8387 4.132 4 97.9045 6.299 8 97.9045 6.299 8 278 856 921 0:SP2_SP2_SP3 Ge[6] N[6] Se 3:3:2: 3:3:3: 3:4: N[6]-3:N[6]-3:Se-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:P-4: Ge[6](N[6]C[6a]C[6])2(SeP) N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C) Se(Ge[6]N[6]2)(PC[6]2Se) Ge[6](N[6]C[6a]C[6])2(SeP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} Se(Ge[6]N[6]2)(PC[6]2Se) 94.5221 0.453 2 94.5221 0.205 2 94.5221 0.205 2 94.5221 0.205 2 97.9045 6.299 8 97.9045 6.299 8 278 856 921 0:SP2_SP2_SP3 Ge[6] N[6] Se 3:3:2: 3:3:4: 3:3: N[6,6a]-3:N[6]-3:Se-2: Ge[6]-3:C[6]-3:Si-4: Ge[6]-3:Ge[6]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(SeGe[6]) N[6](Ge[6]N[6,6a]Se)(C[6]C[6a]C[6])(SiC3) Se(Ge[6]N[6,6a]N[6])2 Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(SeGe[6]){1|H<1>,4|C<3>} N[6](Ge[6]N[6,6a]Se)(C[6]C[6a]C[6])(SiC3){1|Si<4>,4|C<3>} Se(Ge[6]N[6,6a]N[6])2 99.4184 0.729 2 99.4184 0.531 2 99.4184 0.531 2 99.4184 0.531 2 97.9045 6.299 8 97.9045 6.299 8 278 856 930 0:SP2_SP2_SP2 Ge[6] N[6] C 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:C-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-3:C-3: Ge[6](N[6]C[6a]C[6])2(CCC) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) C(Ge[6]N[6]2)(CCH)(COO) Ge[6](N[6]C[6a]C[6])2(CCC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} C(Ge[6]N[6]2)(CCH)(COO) 92.9729 1.031 6 92.9729 1.064 6 94.8317 13.101 8 94.8317 13.101 8 95.9876 12.468 12 95.9876 12.468 12 278 856 930 0:SP2_SP2_SP2 Ge[6] N[6] C 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:C-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-3:C-3: Ge[6](N[6]C[6a]C[6])2(CCC) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) C(Ge[6]N[6]2)(CHH)(COO) Ge[6](N[6]C[6a]C[6])2(CCC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} C(Ge[6]N[6]2)(CHH)(COO) 100.4081 1.862 2 100.4081 3.469 2 94.8317 13.101 8 94.8317 13.101 8 95.9876 12.468 12 95.9876 12.468 12 278 856 930 0:SP2_SP2_SP2 Ge[6] N[6] C 3:3:3: 3:3:3: 3:4:2: N[6]-3:N[6]-3:C-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-4:P-2: Ge[6](N[6]C[6a]C[6])2(CCP) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) C(Ge[6]N[6]2)(CC3)(PH) Ge[6](N[6]C[6a]C[6])2(CCP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} C(Ge[6]N[6]2)(CC3)(PH) 98.5909 3.605 2 98.5909 12.996 2 98.5909 12.996 2 98.2994 4.456 4 95.9876 12.468 12 95.9876 12.468 12 278 856 930 0:SP2_SP2_SP2 Ge[6] N[6] C 3:3:3: 3:3:3: 3:4:2: N[6]-3:N[6]-3:C-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:Si-4:N-2: Ge[6](N[6]C[6a]C[6])2(CSiN) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) C(Ge[6]N[6]2)(SiC3)(NN) Ge[6](N[6]C[6a]C[6])2(CSiN){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} C(Ge[6]N[6]2)(SiC3)(NN) 98.0079 0.184 2 98.0079 0.034 2 98.0079 0.034 2 98.2994 4.456 4 95.9876 12.468 12 95.9876 12.468 12 278 856 939 0:SP2_SP2_SP2 Ge[6] N[6] Ge[5] 3:3:3: 3:3:3: 3:3:3: Ge[5]-3:N[6]-3:N[6]-3: Ge[6]-3:C[6a]-3:C[6]-3: N[5]-3:Ge[6]-3:C[5]-3: Ge[6](Ge[5]C[5]N[5])(N[6]C[6a]C[6])2 N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C) Ge[5](N[5]C[6a]C[5])(Ge[6]N[6]2)(C[5]C[5]C) Ge[6](Ge[5]C[5]N[5])(N[6]C[6a]C[6])2{3|C<4>,8|C<3>} N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<3>,2|C<4>,5|C<3>} Ge[5](N[5]C[6a]C[5])(Ge[6]N[6]2)(C[5]C[5]C){1|C<4>,1|H<1>,6|C<3>} 102.9015 1.991 2 102.9015 3.962 2 102.9015 3.962 2 102.9015 3.962 2 102.9015 3.962 2 102.9015 3.962 2 278 856 941 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:2: 3:3:3: 3:2: N[6]-3:N[6]-3:N-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:N-2: Ge[6](N[6]C[6a]C[6])2(NN) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N(Ge[6]N[6]2)(NN) Ge[6](N[6]C[6a]C[6])2(NN){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(Ge[6]N[6]2)(NN) 90.8732 0.528 6 90.8732 0.279 6 90.8732 0.279 6 90.8732 0.279 6 90.8732 0.279 6 90.8732 0.279 6 278 856 945 0:SP2_SP2_SP3 Ge[6] N[6] P 3:3:3: 3:3:3: 3:3:1: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:P-3:H-1: Ge[6](N[6]C[6a]C[6])2(PHP) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) P(Ge[6]N[6]2)(PGe[6]H)(H) Ge[6](N[6]C[6a]C[6])2(PHP){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} P(Ge[6]N[6]2)(PGe[6]H)(H) 98.5362 0.176 2 98.5362 0.031 2 98.5362 0.031 2 98.5362 0.031 2 99.2996 8.447 10 99.2996 8.447 10 278 856 945 0:SP2_SP2_SP3 Ge[6] N[6] P 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6a]C[6])2(PC[6a]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) P(C[6a]C[6a]2)2(Ge[6]N[6]2) Ge[6](N[6]C[6a]C[6])2(PC[6a]2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} P(C[6a]C[6a]2)2(Ge[6]N[6]2) 99.2720 0.041 2 99.2720 0.002 2 99.2720 0.002 2 99.2720 0.002 2 99.2996 8.447 10 99.2996 8.447 10 278 856 945 0:SP2_SP2_SP3 Ge[6] N[6] P 3:3:3: 3:3:3: 3:4:1: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:Si-4:H-1: Ge[6](N[6]C[6a]C[6])2(PSiH) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) P(Ge[6]N[6]2)(SiC3)(H) Ge[6](N[6]C[6a]C[6])2(PSiH){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} P(Ge[6]N[6]2)(SiC3)(H) 97.5592 4.228 2 97.5592 17.878 2 97.5592 17.878 2 97.5592 17.878 2 99.2996 8.447 10 99.2996 8.447 10 278 856 945 0:SP2_SP2_SP3 Ge[6] N[6] P 3:3:3: 3:3:3: 3:4:4: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:Si-4:Si-4: Ge[6](N[6]C[6a]C[6])2(PSi2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) P(Ge[6]N[6]2)(SiC3)2 Ge[6](N[6]C[6a]C[6])2(PSi2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} P(Ge[6]N[6]2)(SiC3)2 99.1980 6.027 2 99.1980 36.328 2 99.1980 36.328 2 99.1980 36.328 2 99.2996 8.447 10 99.2996 8.447 10 278 856 945 0:SP2_SP2_SP3 Ge[6] N[6] P 3:3:3: 3:3:3: 4:4:3: N[6]-3:N[6]-3:P-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6]-4:C[6]-4:Ge[6]-3: Ge[6](N[6]C[6a]C[6])2(PC[6]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C) P(C[6]C[6]2H)2(Ge[6]N[6]2) Ge[6](N[6]C[6a]C[6])2(PC[6]2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} P(C[6]C[6]2H)2(Ge[6]N[6]2) 101.9325 0.821 2 101.9325 0.674 2 101.9325 0.674 2 101.9325 0.674 2 99.2996 8.447 10 99.2996 8.447 10 278 856 951 0:SP2_SP-NON_SP2 Ge[6] N[6] H 3:3:1: 3:3:3: 3: N[6]-3:N[6]-3:H-1: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3: Ge[6](N[6]C[6a]C[6])2(H) N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C) H(Ge[6]N[6]2) Ge[6](N[6]C[6a]C[6])2(H){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} H(Ge[6]N[6]2) 90.9939 0.809 2 90.9939 0.654 2 90.9939 0.654 2 90.9939 0.654 2 90.9939 0.654 2 90.9939 0.654 2 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6,6] N 3:3:3: 3:3:3: 3:3:3: N[6,6a]-3:N[6,6]-3:N-3: C[6,6]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C[6a]-3:C[6a]-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(NC[6a]2) N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]N)(C[6]C[6]H) N(Ge[6]N[6,6a]N[6,6])(C[6a]C[6a]N[6a])2 Ge[6](N[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6]C[6])(NC[6a]2){1|N<2>,2|H<1>,4|C<3>} N[6,6](C[6,6]C[6]N[6])(Ge[6]N[6,6a]N)(C[6]C[6]H){2|H<1>,3|C<3>} N(Ge[6]N[6,6a]N[6,6])(C[6a]C[6a]N[6a])2 91.3908 0.000 1 91.3908 0.000 1 91.3908 0.000 1 91.3908 0.000 1 91.3908 0.000 1 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:3: 3:1:1: N[6]-3:N[6]-3:N-3: C[6,6]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:H-1:H-1: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(NHH) N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]N) N(Ge[6]N[6]2)(H)2 Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(NHH){1|C<4>,6|C<3>} N[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(Ge[6]N[6]N){2|H<1>,4|C<3>,4|C<4>} N(Ge[6]N[6]2)(H)2 95.0207 0.000 1 95.0207 0.000 1 95.0207 0.000 1 95.7889 0.795 4 98.3292 20.913 14 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:3: 3:1:1: N[6]-3:N[6]-3:N-3: C[6]-3:C[6a]-3:Ge[6]-3: Ge[6]-3:H-1:H-1: Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(NHH) N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]N) N(Ge[6]N[6]2)(H)2 Ge[6](N[6]C[6,6]C[6a])(N[6]C[6a]C[6])(NHH){1|C<4>,6|C<3>} N[6](C[6]C[6,6]C[6a])(C[6a]C[6a]2)(Ge[6]N[6]N){3|C<4>,6|C<3>} N(Ge[6]N[6]2)(H)2 97.0770 0.000 1 97.0770 0.000 1 97.0770 0.000 1 95.7889 0.795 4 98.3292 20.913 14 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:3: 3:1:1: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:H-1:H-1: Ge[6](N[6]C[6a]C[6])2(NHH) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N(Ge[6]N[6]2)(H)2 Ge[6](N[6]C[6a]C[6])2(NHH){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(Ge[6]N[6]2)(H)2 95.5290 0.022 2 95.5290 0.000 2 95.5290 0.000 2 95.7889 0.795 4 98.3292 20.913 14 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:3: 3:3:1: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:Ge[6]-3:H-1: Ge[6](N[6]C[6a]C[6])2(NC[6a]H) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N(C[6a]C[6a]2)(Ge[6]N[6]2)(H) Ge[6](N[6]C[6a]C[6])2(NC[6a]H){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(C[6a]C[6a]2)(Ge[6]N[6]2)(H) 92.9788 5.955 2 92.9788 35.467 2 92.9788 35.467 2 92.9788 35.467 2 98.3292 20.913 14 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:3: 3:3:3: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: C[6a]-3:C[6a]-3:Ge[6]-3: Ge[6](N[6]C[6a]C[6])2(NC[6a]2) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N(C[6a]C[6a]2)2(Ge[6]N[6]2) Ge[6](N[6]C[6a]C[6])2(NC[6a]2){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(C[6a]C[6a]2)2(Ge[6]N[6]2) 104.7120 0.065 2 104.7120 0.004 2 104.7120 0.004 2 104.7120 0.004 2 98.3292 20.913 14 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:3: 3:4:2: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:Si-4:N-2: Ge[6](N[6]C[6a]C[6])2(NSiN) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N(Ge[6]N[6]2)(SiC3)(NC) Ge[6](N[6]C[6a]C[6])2(NSiN){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(Ge[6]N[6]2)(SiC3)(NC) 97.5929 0.022 2 97.5929 0.000 2 97.5929 0.000 2 97.5929 0.000 2 98.3292 20.913 14 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:3: 3:4:4: N[6]-3:N[6]-3:N-3: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-4:C-4: Ge[6](N[6]C[6a]C[6])2(NCC) N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C) N(Ge[6]N[6]2)(CH3)2 Ge[6](N[6]C[6a]C[6])2(NCC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} N(Ge[6]N[6]2)(CH3)2 98.4230 2.005 2 98.4230 4.019 2 98.4230 4.019 2 98.4230 4.019 2 98.3292 20.913 14 97.8667 22.629 15 278 856 956 0:SP2_SP2_SP2 Ge[6] N[6] N 3:3:3: 3:3:4: 3:3:3: N[6,6a]-3:N[6]-3:N-3: C[6]-3:Ge[6]-3:Si-4: Ge[6]-3:C[6a]-3:N-3: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(NC[6a]N) N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]N)(SiC3) N(Ge[6]N[6,6a]N[6])(C[6a]C[6a]2)(NC[6a]Ge[6]) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(NC[6a]N){1|H<1>,4|C<3>} N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]N)(SiC3){1|Si<4>,4|C<3>} N(Ge[6]N[6,6a]N[6])(C[6a]C[6a]2)(NC[6a]Ge[6]) 103.0200 4.510 2 103.0200 20.339 2 103.0200 20.339 2 103.0200 20.339 2 98.3292 20.913 14 97.8667 22.629 15 278 856 983 0:SP2_SP1_SP2 Ge[6] N[6] C 3:3:2: 3:3:3: 3:2: N[6]-3:N[6]-3:C-2: C[6a]-3:Ge[6]-3:C[6]-3: Ge[6]-3:C-2: Ge[6](N[6]C[6a]C[6])2(CC) N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C) C(Ge[6]N[6]2)(CC[6a]) Ge[6](N[6]C[6a]C[6])2(CC){2|C<4>,5|C<3>} N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>} C(Ge[6]N[6]2)(CC[6a]) 93.3432 0.000 1 93.3432 0.000 1 93.3432 0.000 1 93.3432 0.000 1 95.5347 9.605 2 95.5347 9.605 2 278 856 983 0:SP2_SP1_SP2 Ge[6] N[6] C 3:3:2: 3:3:4: 3:2: N[6,6a]-3:N[6]-3:C-2: C[6]-3:Ge[6]-3:Si-4: Ge[6]-3:C-2: Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC) N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3) C(Ge[6]N[6,6a]N[6])(CC[6a]) Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC){1|H<1>,4|C<3>} N[6](C[6]C[6a]C[6])(Ge[6]N[6,6a]C)(SiC3){1|Si<4>,4|C<3>} C(Ge[6]N[6,6a]N[6])(CC[6a]) 97.7262 0.000 1 97.7262 0.000 1 97.7262 0.000 1 97.7262 0.000 1 95.5347 9.605 2 95.5347 9.605 2 282 286 286 6:SP3_SP3_SP3 As[6] S[6] S[6] 2:2:1: 3:2: 3:2: S[6]-2:S[6]-2:S-1: As[6]-3:S[6]-2: As[6]-3:S[6]-2: As[6](S[6]S[6])2(S) S[6](As[6]S[6]S)(S[6]S[6]) S[6](As[6]S[6]S)(S[6]S[6]) As[6](S[6]S[6])2(S){1|S<2>} S[6](As[6]S[6]S)(S[6]S[6]){1|S<2>} S[6](As[6]S[6]S)(S[6]S[6]){1|S<2>} 94.7932 0.000 1 94.7932 0.000 1 94.7932 0.000 1 94.7932 0.000 1 100.1065 6.656 15 100.1065 6.656 15 282 286 286 6:SP3_SP3_SP3 As[6] S[6] S[6] 2:2:1: 3:3: 3:3: S[6]-2:S[6]-2:S-1: As[6]-3:As[6]-3: As[6]-3:As[6]-3: As[6](S[6]As[6])2(S) S[6](As[6]S[6]S)2 S[6](As[6]S[6]S)2 As[6](S[6]As[6])2(S){1|S<2>,2|S<1>} S[6](As[6]S[6]S)2{1|As<3>} S[6](As[6]S[6]S)2{1|As<3>} 100.1176 1.556 12 100.1176 2.421 12 100.1176 2.421 12 100.1176 2.421 12 100.1065 6.656 15 100.1065 6.656 15 282 286 286 6:SP3_SP3_SP3 As[6] S[6] S[6] 2:2:1: 4:3: 4:3: S[6]-2:S[6]-2:S-1: In[4,6]-4:As[6]-3: In[4,6]-4:As[6]-3: As[6](S[6]In[4,6])2(S) S[6](In[4,6]S[4]2S[6])(As[6]S[6]S) S[6](In[4,6]S[4]2S[6])(As[6]S[6]S) As[6](S[6]In[4,6])2(S){2|S<3>,3|S<2>} S[6](In[4,6]S[4]2S[6])(As[6]S[6]S){1|As<3>,1|In<4>} S[6](In[4,6]S[4]2S[6])(As[6]S[6]S){2|Co<5>,2|In<4>} 106.2260 0.000 1 106.2260 0.000 1 106.2260 0.000 1 106.2260 0.000 1 100.1065 6.656 15 100.1065 6.656 15 282 286 286 6:SP3_SP3_SP3 As[6] S[6] S[6] 2:2:2: 3:2: 3:2: S[6]-2:S[6]-2:S-2: As[6]-3:S[6]-2: As[6]-3:S[6]-2: As[6](S[6]S[6])2(SMn) S[6](As[6]S[6]S)(S[6]As[6]) S[6](As[6]S[6]S)(S[6]As[6]) As[6](S[6]S[6])2(SMn){1|As<3>} S[6](As[6]S[6]S)(S[6]As[6]){2|S<2>} S[6](As[6]S[6]S)(S[6]As[6]){2|S<2>} 99.1674 0.000 1 99.1674 0.000 1 99.1674 0.000 1 99.1674 0.000 1 100.1065 6.656 15 100.1065 6.656 15 282 286 977 0:SP3_SP-NON_SP3 As[6] S[6] S 2:2:1: 3:2: 3: S[6]-2:S[6]-2:S-1: As[6]-3:S[6]-2: As[6]-3: As[6](S[6]S[6])2(S) S[6](As[6]S[6]S)(S[6]S[6]) S(As[6]S[6]2) As[6](S[6]S[6])2(S){1|S<2>} S[6](As[6]S[6]S)(S[6]S[6]){1|S<2>} S(As[6]S[6]2) 97.8267 6.453 2 97.8267 41.647 2 97.8267 41.647 2 97.8267 41.647 2 100.0851 5.050 28 100.0851 5.050 28 282 286 977 0:SP3_SP-NON_SP3 As[6] S[6] S 2:2:1: 3:3: 3: S[6]-2:S[6]-2:S-1: As[6]-3:As[6]-3: As[6]-3: As[6](S[6]As[6])2(S) S[6](As[6]S[6]S)2 S(As[6]S[6]2) As[6](S[6]As[6])2(S){1|S<2>,2|S<1>} S[6](As[6]S[6]S)2{1|As<3>} S(As[6]S[6]2) 100.4494 1.741 24 100.4494 3.032 24 100.4494 3.032 24 100.4494 3.032 24 100.0851 5.050 28 100.0851 5.050 28 282 286 977 0:SP3_SP-NON_SP3 As[6] S[6] S 2:2:1: 4:3: 3: S[6]-2:S[6]-2:S-1: In[4,6]-4:As[6]-3: As[6]-3: As[6](S[6]In[4,6])2(S) S[6](In[4,6]S[4]2S[6])(As[6]S[6]S) S(As[6]S[6]2) As[6](S[6]In[4,6])2(S){2|S<3>,3|S<2>} S[6](In[4,6]S[4]2S[6])(As[6]S[6]S){1|As<3>,1|In<4>} S(As[6]S[6]2) 96.8243 0.000 1 97.9719 2.634 2 97.9719 2.634 2 97.9719 2.634 2 100.0851 5.050 28 100.0851 5.050 28 282 286 977 0:SP3_SP-NON_SP3 As[6] S[6] S 2:2:1: 4:3: 3: S[6]-2:S[6]-2:S-1: In[4,6]-4:As[6]-3: As[6]-3: As[6](S[6]In[4,6])2(S) S[6](In[4,6]S[4]2S[6])(As[6]S[6]S) S(As[6]S[6]2) As[6](S[6]In[4,6])2(S){2|S<3>,3|S<2>} S[6](In[4,6]S[4]2S[6])(As[6]S[6]S){2|Co<5>,2|In<4>} S(As[6]S[6]2) 99.1195 0.000 1 97.9719 2.634 2 97.9719 2.634 2 97.9719 2.634 2 100.0851 5.050 28 100.0851 5.050 28 282 430 975 0:SP3_SP-NON_SP3 As[6] Se Se[6] 2:2:1: 3: 3:2: Se[6]-2:Se[6]-2:Se-1: As[6]-3: As[6]-3:Se[6]-2: As[6](Se[6]Se[6])2(Se) Se(As[6]Se[6]2) Se[6](As[6]Se[6]Se)(Se[6]As[6]) As[6](Se[6]Se[6])2(Se){1|As<3>} Se(As[6]Se[6]2) Se[6](As[6]Se[6]Se)(Se[6]As[6]){1|Se<1>,1|Se<2>} 95.7318 2.338 8 95.7318 5.464 8 95.7318 5.464 8 95.7318 5.464 8 96.3749 6.206 10 96.3749 6.206 10 282 430 975 0:SP3_SP-NON_SP3 As[6] Se Se[6] 2:2:1: 3: 3:3: Se[6]-2:Se[6]-2:Se-1: As[6]-3: As[6]-3:As[6]-3: As[6](Se[6]As[6])2(Se) Se(As[6]Se[6]2) Se[6](As[6]Se[6]Se)2 As[6](Se[6]As[6])2(Se){3|Se<2>} Se(As[6]Se[6]2) Se[6](As[6]Se[6]Se)2{1|As<3>} 98.9477 1.027 2 98.9477 1.055 2 98.9477 1.055 2 98.9477 1.055 2 96.3749 6.206 10 96.3749 6.206 10 282 466 466 0:SP3_SP3_SP3 As[4x6] C[3x6] C[3x6] 4:4:4: 3:4:3:1: 3:4:3:1: C[3x6]-4:C[3x6]-4:P[4x6]-4: As[4x6]-3:C[6,6]-4:C[6,6]-3:H-1: As[4x6]-3:C[6,6]-4:C[6,6]-3:H-1: As[4x6](C[3x6]C[6,6]2H)2(P[4x6]C[3x6]2W) C[3x6](As[4x6]C[3x6]P[4x6])(C[6,6]C[6,6]HH)(C[6,6]C[6,6]H)(H) C[3x6](As[4x6]C[3x6]P[4x6])(C[6,6]C[6,6]HH)(C[6,6]C[6,6]H)(H) As[4x6](C[3x6]C[6,6]2H)2(P[4x6]C[3x6]2W){2|C<3>,2|C<4>,8|H<1>} C[3x6](As[4x6]C[3x6]P[4x6])(C[6,6]C[6,6]HH)(C[6,6]C[6,6]H)(H){1|C<3>,1|W<6>,3|C<4>,4|H<1>} C[3x6](As[4x6]C[3x6]P[4x6])(C[6,6]C[6,6]HH)(C[6,6]C[6,6]H)(H){1|C<3>,1|W<6>,3|C<4>,4|H<1>} 109.4880 0.000 1 109.4880 0.000 1 109.4880 0.000 1 109.4880 0.000 1 109.4880 0.000 1 105.2350 36.176 2 282 466 466 0:SP3_SP3_SP3 As[6,6] C[6] C[6] 4:4:4: 3:3:1:1: 3:3:1:1: P[6,6]-4:C[6]-4:C[6]-4: As[6,6]-3:C[6]-3:H-1:H-1: As[6,6]-3:C[6]-3:H-1:H-1: As[6,6](P[6,6]C[6]2W)(C[6]C[6]HH)2 C[6](As[6,6]P[6,6]C[6])(C[6]C[6]C)(H)2 C[6](As[6,6]P[6,6]C[6])(C[6]C[6]C)(H)2 As[6,6](P[6,6]C[6]2W)(C[6]C[6]HH)2{2|C<3>,2|C<4>,4|H<1>} C[6](As[6,6]P[6,6]C[6])(C[6]C[6]C)(H)2{1|C<3>,1|W<6>,2|H<1>,3|C<4>} C[6](As[6,6]P[6,6]C[6])(C[6]C[6]C)(H)2{1|C<3>,1|W<6>,2|H<1>,3|C<4>} 100.9820 0.000 1 100.9820 0.000 1 100.9820 0.000 1 100.9820 0.000 1 100.9820 0.000 1 105.2350 36.176 2 282 466 466 6:SP3_SP3_SP3 As[3x6] C[6,6] C[6,6] 4:4:2: 3:3:1:1: 3:3:1:1: C[6,6]-4:C[6,6]-4:O[6,6]-2: As[3x6]-3:As[3x6]-3:H-1:H-1: As[3x6]-3:As[3x6]-3:H-1:H-1: As[3x6](C[6,6]As[3x6]HH)2(O[6,6]As[3x6]) C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2 C[6,6](As[3x6]C[6,6]O[6,6])2(H)2 As[3x6](C[6,6]As[3x6]HH)2(O[6,6]As[3x6]){1|C<4>,2|O<2>} C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2{2|As<3>,2|H<1>} C[6,6](As[3x6]C[6,6]O[6,6])2(H)2{2|As<3>,4|H<1>} 99.4726 1.025 6 99.4726 1.052 6 99.4726 1.052 6 99.4726 1.052 6 99.4726 1.052 6 99.4726 1.052 6 282 466 622 6:SP3_SP3_SP3 As[3x6] C[6,6] O[6,6] 4:2:2: 3:3:1:1: 3:3: C[6,6]-4:O[6,6]-2:O[6,6]-2: As[3x6]-3:As[3x6]-3:H-1:H-1: As[3x6]-3:As[3x6]-3: As[3x6](C[6,6]As[3x6]HH)(O[6,6]As[3x6])2 C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2 O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2) As[3x6](C[6,6]As[3x6]HH)(O[6,6]As[3x6])2{1|O<2>,2|C<4>} C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2{2|As<3>,2|H<1>} O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2){2|As<3>,6|H<1>} 100.4047 0.433 6 100.4047 0.188 6 99.8567 0.709 12 99.8567 0.709 12 100.2595 0.783 24 100.2595 0.783 24 282 466 622 6:SP3_SP3_SP3 As[3x6] C[6,6] O[6,6] 4:2:2: 3:3:1:1: 3:3: C[6,6]-4:O[6,6]-2:O[6,6]-2: As[3x6]-3:As[3x6]-3:H-1:H-1: As[3x6]-3:As[3x6]-3: As[3x6](C[6,6]As[3x6]HH)(O[6,6]As[3x6])2 C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2 O[6,6](As[3x6]C[6,6]O[6,6])2 As[3x6](C[6,6]As[3x6]HH)(O[6,6]As[3x6])2{1|O<2>,2|C<4>} C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2{2|As<3>,2|H<1>} O[6,6](As[3x6]C[6,6]O[6,6])2{2|As<3>,4|H<1>} 99.3087 0.807 6 99.3087 0.652 6 99.8567 0.709 12 99.8567 0.709 12 100.2595 0.783 24 100.2595 0.783 24 282 466 622 6:SP3_SP3_SP3 As[3x6] C[6,6] O[6,6] 4:4:2: 3:3:1:1: 3:3: C[6,6]-4:C[6,6]-4:O[6,6]-2: As[3x6]-3:As[3x6]-3:H-1:H-1: As[3x6]-3:As[3x6]-3: As[3x6](C[6,6]As[3x6]HH)2(O[6,6]As[3x6]) C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2 O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2) As[3x6](C[6,6]As[3x6]HH)2(O[6,6]As[3x6]){1|C<4>,2|O<2>} C[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]O[6,6]2)(H)2{2|As<3>,2|H<1>} O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2){2|As<3>,6|H<1>} 100.2907 0.709 6 100.2907 0.502 6 100.6624 0.574 12 100.6624 0.574 12 100.2595 0.783 24 100.2595 0.783 24 282 466 622 6:SP3_SP3_SP3 As[3x6] C[6,6] O[6,6] 4:4:2: 3:3:1:1: 3:3: C[6,6]-4:C[6,6]-4:O[6,6]-2: As[3x6]-3:As[3x6]-3:H-1:H-1: As[3x6]-3:As[3x6]-3: As[3x6](C[6,6]As[3x6]HH)2(O[6,6]As[3x6]) C[6,6](As[3x6]C[6,6]O[6,6])2(H)2 O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2) As[3x6](C[6,6]As[3x6]HH)2(O[6,6]As[3x6]){1|C<4>,2|O<2>} C[6,6](As[3x6]C[6,6]O[6,6])2(H)2{2|As<3>,4|H<1>} O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2){2|As<3>,6|H<1>} 101.0340 0.655 6 101.0340 0.429 6 100.6624 0.574 12 100.6624 0.574 12 100.2595 0.783 24 100.2595 0.783 24 282 490 762 0:SP2_SP2_SP3 As[6] C C[6] 3:3:4: 3:1:1:1: 3:3:1: C[6]-3:C[6]-3:C-4: As[6]-3:H-1:H-1:H-1: C[6]-3:As[6]-3:H-1: As[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3) C(As[6]C[6]2)(H)3 C[6](C[6]As[6]C[6a])(As[6]C[6]C)(H) As[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|As<3>,1|H<1>,3|C<3>} C(As[6]C[6]2)(H)3 C[6](C[6]As[6]C[6a])(As[6]C[6]C)(H){1|C<4>,4|C<3>} 96.8593 1.058 6 96.8593 1.119 6 96.8593 1.119 6 96.8593 1.119 6 98.9960 4.205 34 98.9960 4.205 34 282 490 762 0:SP2_SP2_SP3 As[6] C C[6] 3:3:4: 3:1:1:1: 3:3:3: C[6]-3:C[6]-3:C-4: As[6]-3:H-1:H-1:H-1: As[6]-3:C[6]-3:C-3: As[6](C[6]C[6]C)2(CH3) C(As[6]C[6]2)(H)3 C[6](As[6]C[6]C)(C[6]As[6]C)(COO) As[6](C[6]C[6]C)2(CH3){1|As<3>,2|C<3>} C(As[6]C[6]2)(H)3 C[6](As[6]C[6]C)(C[6]As[6]C)(COO){1|C<4>,2|C<3>} 99.6015 2.080 10 99.4420 3.624 22 99.4420 3.624 22 99.4538 3.700 28 98.9960 4.205 34 98.9960 4.205 34 282 490 762 0:SP2_SP2_SP3 As[6] C C[6] 3:3:4: 3:1:1:1: 3:3:3: C[6]-3:C[6]-3:C-4: As[6]-3:H-1:H-1:H-1: As[6]-3:C[6]-3:C-3: As[6](C[6]C[6]C)2(CH3) C(As[6]C[6]2)(H)3 C[6](As[6]C[6]C)(C[6]As[6]C)(COO) As[6](C[6]C[6]C)2(CH3){1|As<4>,2|C<3>} C(As[6]C[6]2)(H)3 C[6](As[6]C[6]C)(C[6]As[6]C)(COO){1|Pt<4>,1|C<4>,2|C<3>} 99.3090 1.826 12 99.4420 3.624 22 99.4420 3.624 22 99.4538 3.700 28 98.9960 4.205 34 98.9960 4.205 34 282 490 762 0:SP2_SP2_SP3 As[6] C C[6] 3:3:4: 3:1:1:1: 3:3:3: C[6]-3:C[6]-3:C-4: As[6]-3:H-1:H-1:H-1: C[6a]-3:As[6]-3:C[6]-3: As[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3) C(As[6]C[6]2)(H)3 C[6](C[6a]C[6a]2)(As[6]C[6]C)(C[6]As[6]H) As[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|As<3>,1|H<1>,3|C<3>} C(As[6]C[6]2)(H)3 C[6](C[6a]C[6a]2)(As[6]C[6]C)(C[6]As[6]H){1|C<4>,3|C<3>,3|H<1>} 99.4972 2.181 6 99.4972 4.755 6 99.4972 4.755 6 99.4538 3.700 28 98.9960 4.205 34 98.9960 4.205 34 282 622 622 6:SP3_SP3_SP3 As[3x6] O[6,6] O[6,6] 2:2:2: 3:3: 3:3: O[6,6]-2:O[6,6]-2:O[6,6]-2: As[3x6]-3:As[3x6]-3: As[3x6]-3:As[3x6]-3: As[3x6](O[6,6]As[3x6])3 O[6,6](As[3x6]O[6,6]2)2 O[6,6](As[3x6]O[6,6]2)2 As[3x6](O[6,6]As[3x6])3{3|O<2>} O[6,6](As[3x6]O[6,6]2)2{2|As<3>} O[6,6](As[3x6]O[6,6]2)2{2|As<3>} 96.9378 1.319 29 96.9378 1.740 29 96.9378 1.740 29 96.9378 1.740 29 97.5714 4.486 44 97.8218 4.526 50 282 622 622 6:SP3_SP3_SP3 As[3x6] O[6,6] O[6,6] 2:2:2: 4:3: 4:3: O[6,6]-2:O[6,6]-2:O[6,6]-2: C[6,6]-4:As[3x6]-3: C[6,6]-4:As[3x6]-3: As[3x6](O[6,6]C[6,6])3 O[6,6](C[6,6]C[3x6]HH)(As[3x6]O[6,6]2) O[6,6](C[6,6]C[3x6]HH)(As[3x6]O[6,6]2) As[3x6](O[6,6]C[6,6])3{1|C<4>,6|H<1>} O[6,6](C[6,6]C[3x6]HH)(As[3x6]O[6,6]2){3|C<4>} O[6,6](C[6,6]C[3x6]HH)(As[3x6]O[6,6]2){3|C<4>} 96.6758 0.688 9 96.6758 0.474 9 96.6758 0.474 9 96.6758 0.474 9 97.5714 4.486 44 97.8218 4.526 50 282 622 622 6:SP3_SP3_SP3 As[3x6] O[6,6] O[6,6] 4:2:2: 3:3: 3:3: C[6,6]-4:O[6,6]-2:O[6,6]-2: As[3x6]-3:As[3x6]-3: As[3x6]-3:As[3x6]-3: As[3x6](C[6,6]As[3x6]HH)(O[6,6]As[3x6])2 O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2) O[6,6](As[3x6]C[6,6]O[6,6])2 As[3x6](C[6,6]As[3x6]HH)(O[6,6]As[3x6])2{1|O<2>,2|C<4>} O[6,6](As[3x6]C[6,6]O[6,6])(As[3x6]C[6,6]2){2|As<3>,6|H<1>} O[6,6](As[3x6]C[6,6]O[6,6])2{2|As<3>,4|H<1>} 101.9770 1.010 6 101.9770 1.021 6 101.9770 1.021 6 101.9770 1.021 6 97.5714 4.486 44 97.8218 4.526 50 282 622 622 6:SP3_SP3_SP3 As[6] O[6] O[6] 2:2:4: 3:3: 3:3: O[6]-2:O[6]-2:O-4: As[6]-3:As[6]-3: As[6]-3:As[6]-3: As[6](O[6]As[6])2(OCuMo2) O[6](As[6]O[6]O)2 O[6](As[6]O[6]O)2 As[6](O[6]As[6])2(OCuMo2){1|O<2>,2|O<4>} O[6](As[6]O[6]O)2{1|As<3>} O[6](As[6]O[6]O)2{1|As<3>} 100.0482 0.770 3 100.0482 0.593 3 99.6579 1.169 6 99.6579 1.169 6 99.6579 1.169 6 97.8218 4.526 50 282 622 622 6:SP3_SP3_SP3 As[6] O[6] O[6] 2:2:4: 3:3: 3:3: O[6]-2:O[6]-2:O-4: As[6]-3:As[6]-3: As[6]-3:As[6]-3: As[6](O[6]As[6])2(OMo2Zn) O[6](As[6]O[6]O)2 O[6](As[6]O[6]O)2 As[6](O[6]As[6])2(OMo2Zn){1|O<2>,2|O<4>} O[6](As[6]O[6]O)2{1|As<3>} O[6](As[6]O[6]O)2{1|As<3>} 99.2676 1.369 3 99.2676 1.873 3 99.6579 1.169 6 99.6579 1.169 6 99.6579 1.169 6 97.8218 4.526 50 282 643 856 0:SP2_SP2_SP2 As[6,6] C[6a] N[6,6] 3:3:3: 3:3:3: 3:3:4: N[6,6]-3:N[6,6]-3:C[6a]-3: As[6,6]-3:C[6a]-3:C[6a]-3: As[6,6]-3:P[4,6,6]-3:C-4: As[6,6](N[6,6]P[4,6,6]C)2(C[6a]C[6a]2) C[6a](As[6,6]N[6,6]2)(C[6a]C[6a]H)2 N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3) As[6,6](N[6,6]P[4,6,6]C)2(C[6a]C[6a]2){2|C<3>,2|H<1>,2|N<3>} C[6a](As[6,6]N[6,6]2)(C[6a]C[6a]H)2{1|C<3>,2|C<4>,2|H<1>,2|P<3>} N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3){1|P<3>,2|C<3>,3|C<4>} 99.8663 0.000 1 99.8663 0.000 1 99.8663 0.000 1 99.8663 0.000 1 99.8663 0.000 1 99.8663 0.000 1 282 643 856 0:SP2_SP2_SP3 As[6,6] C[6a] N[6,6] 3:3:3: 3:3:3: 3:3:4: N[6,6]-3:N[6,6]-3:C[6a]-3: As[6,6]-3:C[6a]-3:C[6a]-3: As[6,6]-3:P[4,6,6]-3:C-4: As[6,6](N[6,6]P[4,6,6]C)2(C[6a]C[6a]2) C[6a](As[6,6]N[6,6]2)(C[6a]C[6a]H)2 N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3) As[6,6](N[6,6]P[4,6,6]C)2(C[6a]C[6a]2){2|C<3>,2|H<1>,2|N<3>} C[6a](As[6,6]N[6,6]2)(C[6a]C[6a]H)2{1|C<3>,2|C<4>,2|H<1>,2|P<3>} N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3){1|P<3>,2|C<3>,3|C<4>} 101.3610 0.000 1 101.3610 0.000 1 101.3610 0.000 1 101.3610 0.000 1 101.3610 0.000 1 101.3610 0.000 1 282 762 762 6:SP2_SP2_SP2 As[6] C[6] C[6] 3:3:4: 3:3:3: 3:3:1: C[6]-3:C[6]-3:C-4: C[6a]-3:As[6]-3:C[6]-3: C[6]-3:As[6]-3:H-1: As[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3) C[6](C[6a]C[6a]2)(As[6]C[6]C)(C[6]As[6]H) C[6](C[6]As[6]C[6a])(As[6]C[6]C)(H) As[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|As<3>,1|H<1>,3|C<3>} C[6](C[6a]C[6a]2)(As[6]C[6]C)(C[6]As[6]H){1|C<4>,3|C<3>,3|H<1>} C[6](C[6]As[6]C[6a])(As[6]C[6]C)(H){1|C<4>,4|C<3>} 97.8366 1.882 6 97.8366 3.543 6 97.8366 3.543 6 97.8366 3.543 6 97.4611 4.662 17 97.4611 4.662 17 282 762 762 6:SP2_SP2_SP2 As[6] C[6] C[6] 3:3:4: 3:3:3: 3:3:3: C[6]-3:C[6]-3:C-4: As[6]-3:C[6]-3:C-3: As[6]-3:C[6]-3:C-3: As[6](C[6]C[6]C)2(CH3) C[6](As[6]C[6]C)(C[6]As[6]C)(COO) C[6](As[6]C[6]C)(C[6]As[6]C)(COO) As[6](C[6]C[6]C)2(CH3){1|As<3>,2|C<3>} C[6](As[6]C[6]C)(C[6]As[6]C)(COO){1|C<4>,2|C<3>} C[6](As[6]C[6]C)(C[6]As[6]C)(COO){1|C<4>,2|C<3>} 96.5573 2.653 5 97.2562 5.557 11 97.2562 5.557 11 97.2562 5.557 11 97.4611 4.662 17 97.4611 4.662 17 282 762 762 6:SP2_SP2_SP2 As[6] C[6] C[6] 3:3:4: 3:3:3: 3:3:3: C[6]-3:C[6]-3:C-4: As[6]-3:C[6]-3:C-3: As[6]-3:C[6]-3:C-3: As[6](C[6]C[6]C)2(CH3) C[6](As[6]C[6]C)(C[6]As[6]C)(COO) C[6](As[6]C[6]C)(C[6]As[6]C)(COO) As[6](C[6]C[6]C)2(CH3){1|As<4>,2|C<3>} C[6](As[6]C[6]C)(C[6]As[6]C)(COO){1|Pt<4>,1|C<4>,2|C<3>} C[6](As[6]C[6]C)(C[6]As[6]C)(COO){1|Pt<4>,1|C<4>,2|C<3>} 97.8387 2.142 6 97.2562 5.557 11 97.2562 5.557 11 97.2562 5.557 11 97.4611 4.662 17 97.4611 4.662 17 282 790 856 0:SP3_SP-NON_SP2 As[6] Cl N[6] 3:3:1: 3: 3:3:2: N[6]-3:N[6]-3:Cl-1: As[6]-3: As[6]-3:C[6a]-3:As[6]-2: As[6](N[6]As[6]C[6a])2(Cl) Cl(As[6]N[6]2) N[6](As[6]N[6]Cl)(C[6a]C[6a]2)(As[6]N[6]) As[6](N[6]As[6]C[6a])2(Cl){1|Cl<1>,1|N<3>,4|C<3>} Cl(As[6]N[6]2) N[6](As[6]N[6]Cl)(C[6a]C[6a]2)(As[6]N[6]){1|As<3>,2|C<4>,4|C<3>} 97.6065 1.787 2 97.6065 3.192 2 97.6065 3.192 2 97.6065 3.192 2 100.2182 5.626 18 100.2182 5.626 18 282 790 856 0:SP3_SP-NON_SP2 As[6] Cl N[6] 3:3:1: 3: 3:3:3: N[6]-3:N[6]-3:Cl-1: As[6]-3: As[6]-3:As[6]-3:C[6a]-3: As[6](N[6]As[6]C[6a])2(Cl) Cl(As[6]N[6]2) N[6](As[6]N[6]Cl)2(C[6a]C[6a]2) As[6](N[6]As[6]C[6a])2(Cl){1|Cl<1>,1|N<3>,4|C<3>} Cl(As[6]N[6]2) N[6](As[6]N[6]Cl)2(C[6a]C[6a]2){1|As<2>,2|C<4>,4|C<3>} 103.4390 1.065 2 100.7296 5.606 14 100.7296 5.606 14 100.7296 5.606 14 100.2182 5.626 18 100.2182 5.626 18 282 790 856 0:SP3_SP-NON_SP2 As[6] Cl N[6] 3:3:1: 3: 3:3:3: N[6]-3:N[6]-3:Cl-1: As[6]-3: As[6]-3:As[6]-3:C[6a]-3: As[6](N[6]As[6]C[6a])2(Cl) Cl(As[6]N[6]2) N[6](As[6]N[6]Cl)2(C[6a]C[6a]2) As[6](N[6]As[6]C[6a])2(Cl){2|Cl<1>,1|N<3>,4|C<3>} Cl(As[6]N[6]2) N[6](As[6]N[6]Cl)2(C[6a]C[6a]2){1|As<3>,2|C<4>,4|C<3>} 100.2781 2.228 12 100.7296 5.606 14 100.7296 5.606 14 100.7296 5.606 14 100.2182 5.626 18 100.2182 5.626 18 282 790 856 0:SP3_SP-NON_SP2 As[6] Cl N[6] 3:3:1: 3: 3:3:4: N[6]-3:N[6]-3:Cl-1: As[6]-3: C[6,6a]-3:As[6]-3:C-4: As[6](N[6]C[6,6a]C)2(Cl) Cl(As[6]N[6]2) N[6](C[6,6a]C[6,6a,6a]C[6a])(As[6]N[6]Cl)(CCCH) As[6](N[6]C[6,6a]C)2(Cl){3|C<3>} Cl(As[6]N[6]2) N[6](C[6,6a]C[6,6a,6a]C[6a])(As[6]N[6]Cl)(CCCH){1|C<4>,1|H<1>,3|C<3>} 99.2501 0.634 2 99.2501 0.402 2 99.2501 0.402 2 99.2501 0.402 2 100.2182 5.626 18 100.2182 5.626 18 282 856 856 6:SP2_SP2_SP2 As[6] N[6] N[6] 3:3:2: 3:3:3: 3:3:3: N[6]-3:N[6]-3:As-2: As[6]-3:C[6a]-3:C[6]-3: As[6]-3:C[6a]-3:C[6]-3: As[6](N[6]C[6a]C[6])2(AsAs) N[6](As[6]N[6]As)(C[6a]C[6a]2)(C[6]C[6]H) N[6](As[6]N[6]As)(C[6a]C[6a]2)(C[6]C[6]H) As[6](N[6]C[6a]C[6])2(AsAs){2|H<1>,5|C<3>} N[6](As[6]N[6]As)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,5|C<3>} N[6](As[6]N[6]As)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,5|C<3>} 88.1458 0.000 1 88.1458 0.000 1 88.1458 0.000 1 88.1458 0.000 1 88.1458 0.000 1 88.1458 0.000 1 282 856 856 6:SP2_SP2_SP3 As[6,6] N[6,6] N[6,6] 3:3:3: 3:3:4: 3:3:4: N[6,6]-3:N[6,6]-3:C[6a]-3: As[6,6]-3:P[4,6,6]-3:C-4: As[6,6]-3:P[4,6,6]-3:C-4: As[6,6](N[6,6]P[4,6,6]C)2(C[6a]C[6a]2) N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3) N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3) As[6,6](N[6,6]P[4,6,6]C)2(C[6a]C[6a]2){2|C<3>,2|H<1>,2|N<3>} N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3){1|P<3>,2|C<3>,3|C<4>} N[6,6](As[6,6]N[6,6]C[6a])(P[4,6,6]N[4,6]2)(CC3){1|P<3>,2|C<3>,3|C<4>} 100.9980 0.000 1 100.9980 0.000 1 100.9980 0.000 1 100.9980 0.000 1 100.9980 0.000 1 100.9980 0.000 1 282 856 856 6:SP3_SP2_SP2 As[3x6] N[3x6] N[3x6] 3:3:3: 3:3:3: 3:3:3: N[3x6]-3:N[3x6]-3:N[3x6]-3: C[3x6]-3:As[3x6]-3:C[6]-3: C[3x6]-3:As[3x6]-3:C[6]-3: As[3x6](N[3x6]C[3x6]C[6])3 N[3x6](C[3x6]P[3x6]C[6])(As[3x6]N[3x6]2)(C[6]C[6]H) N[3x6](C[3x6]P[3x6]C[6])(As[3x6]N[3x6]2)(C[6]C[6]H) As[3x6](N[3x6]C[3x6]C[6])3{1|P<3>,3|H<1>,6|C<3>} N[3x6](C[3x6]P[3x6]C[6])(As[3x6]N[3x6]2)(C[6]C[6]H){2|H<1>,5|C<3>} N[3x6](C[3x6]P[3x6]C[6])(As[3x6]N[3x6]2)(C[6]C[6]H){2|H<1>,5|C<3>} 91.7177 0.697 3 91.7177 0.485 3 91.7177 0.485 3 91.7177 0.485 3 91.7177 0.485 3 97.4091 13.980 12 282 856 856 6:SP3_SP2_SP2 As[6] N[6] N[6] 3:3:1: 3:3:2: 3:3:3: N[6]-3:N[6]-3:Cl-1: As[6]-3:C[6a]-3:As[6]-2: As[6]-3:As[6]-3:C[6a]-3: As[6](N[6]As[6]C[6a])2(Cl) N[6](As[6]N[6]Cl)(C[6a]C[6a]2)(As[6]N[6]) N[6](As[6]N[6]Cl)2(C[6a]C[6a]2) As[6](N[6]As[6]C[6a])2(Cl){1|Cl<1>,1|N<3>,4|C<3>} N[6](As[6]N[6]Cl)(C[6a]C[6a]2)(As[6]N[6]){1|As<3>,2|C<4>,4|C<3>} N[6](As[6]N[6]Cl)2(C[6a]C[6a]2){1|As<2>,2|C<4>,4|C<3>} 98.7833 0.487 2 98.7833 0.237 2 98.7833 0.237 2 98.7833 0.237 2 99.3063 2.905 9 97.4091 13.980 12 282 856 856 6:SP3_SP2_SP2 As[6] N[6] N[6] 3:3:1: 3:3:3: 3:3:3: N[6]-3:N[6]-3:Cl-1: As[6]-3:As[6]-3:C[6a]-3: As[6]-3:As[6]-3:C[6a]-3: As[6](N[6]As[6]C[6a])2(Cl) N[6](As[6]N[6]Cl)2(C[6a]C[6a]2) N[6](As[6]N[6]Cl)2(C[6a]C[6a]2) As[6](N[6]As[6]C[6a])2(Cl){2|Cl<1>,1|N<3>,4|C<3>} N[6](As[6]N[6]Cl)2(C[6a]C[6a]2){1|As<3>,2|C<4>,4|C<3>} N[6](As[6]N[6]Cl)2(C[6a]C[6a]2){1|As<3>,2|C<4>,4|C<3>} 100.0966 1.005 6 100.0966 1.010 6 100.0966 1.010 6 100.0966 1.010 6 99.3063 2.905 9 97.4091 13.980 12 282 856 856 6:SP3_SP2_SP2 As[6] N[6] N[6] 3:3:1: 3:3:4: 3:3:4: N[6]-3:N[6]-3:Cl-1: C[6,6a]-3:As[6]-3:C-4: C[6,6a]-3:As[6]-3:C-4: As[6](N[6]C[6,6a]C)2(Cl) N[6](C[6,6a]C[6,6a,6a]C[6a])(As[6]N[6]Cl)(CCCH) N[6](C[6,6a]C[6,6a,6a]C[6a])(As[6]N[6]Cl)(CCCH) As[6](N[6]C[6,6a]C)2(Cl){3|C<3>} N[6](C[6,6a]C[6,6a,6a]C[6a])(As[6]N[6]Cl)(CCCH){1|C<4>,1|H<1>,3|C<3>} N[6](C[6,6a]C[6,6a,6a]C[6a])(As[6]N[6]Cl)(CCCH){1|C<4>,1|H<1>,3|C<3>} 95.6103 0.000 1 95.6103 0.000 1 95.6103 0.000 1 95.6103 0.000 1 99.3063 2.905 9 97.4091 13.980 12 282 856 990 0:SP2_SP2_SP2 As[6] N[6] As 3:3:2: 3:3:3: 3:3: N[6]-3:N[6]-3:As-2: As[6]-3:C[6a]-3:C[6]-3: As[6]-3:As-3: As[6](N[6]C[6a]C[6])2(AsAs) N[6](As[6]N[6]As)(C[6a]C[6a]2)(C[6]C[6]H) As(As[6]N[6]2)(AsNN) As[6](N[6]C[6a]C[6])2(AsAs){2|H<1>,5|C<3>} N[6](As[6]N[6]As)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,5|C<3>} As(As[6]N[6]2)(AsNN) 101.3956 8.864 2 101.3956 78.562 2 101.3956 78.562 2 101.3956 78.562 2 101.3956 78.562 2 101.3956 78.562 2 282 921 975 0:SP3_SP3_SP3 As[6] Se Se[6] 2:2:2: 3:3: 3:3: Se[6]-2:Se[6]-2:Se-2: As[6]-3:As-3: As[6]-3:As[6]-3: As[6](Se[6]As[6])2(SeAs) Se(As[6]Se[6]2)(AsSe2) Se[6](As[6]Se[6]Se)2 As[6](Se[6]As[6])2(SeAs){1|Se<1>,2|Se<2>} Se(As[6]Se[6]2)(AsSe2) Se[6](As[6]Se[6]Se)2{1|As<3>} 97.3049 8.367 4 97.3049 70.010 4 97.3049 70.010 4 97.3049 70.010 4 97.3049 70.010 4 97.3049 70.010 4 282 975 975 6:SP3_SP3_SP3 As[6] Se[6] Se[6] 2:2:1: 3:2: 3:2: Se[6]-2:Se[6]-2:Se-1: As[6]-3:Se[6]-2: As[6]-3:Se[6]-2: As[6](Se[6]Se[6])2(Se) Se[6](As[6]Se[6]Se)(Se[6]As[6]) Se[6](As[6]Se[6]Se)(Se[6]As[6]) As[6](Se[6]Se[6])2(Se){1|As<3>} Se[6](As[6]Se[6]Se)(Se[6]As[6]){1|Se<1>,1|Se<2>} Se[6](As[6]Se[6]Se)(Se[6]As[6]){1|Se<1>,1|Se<2>} 99.9970 0.879 4 99.9970 0.772 4 99.9970 0.772 4 99.9970 0.772 4 100.2992 1.686 7 100.2992 1.686 7 282 975 975 6:SP3_SP3_SP3 As[6] Se[6] Se[6] 2:2:1: 3:3: 3:3: Se[6]-2:Se[6]-2:Se-1: As[6]-3:As[6]-3: As[6]-3:As[6]-3: As[6](Se[6]As[6])2(Se) Se[6](As[6]Se[6]Se)2 Se[6](As[6]Se[6]Se)2 As[6](Se[6]As[6])2(Se){3|Se<2>} Se[6](As[6]Se[6]Se)2{1|As<3>} Se[6](As[6]Se[6]Se)2{1|As<3>} 101.9860 0.000 1 101.9860 0.000 1 101.9860 0.000 1 101.9860 0.000 1 100.2992 1.686 7 100.2992 1.686 7 282 975 975 6:SP3_SP3_SP3 As[6] Se[6] Se[6] 2:2:2: 3:3: 3:3: Se[6]-2:Se[6]-2:Se-2: As[6]-3:As[6]-3: As[6]-3:As[6]-3: As[6](Se[6]As[6])2(SeAs) Se[6](As[6]Se[6]Se)2 Se[6](As[6]Se[6]Se)2 As[6](Se[6]As[6])2(SeAs){1|Se<1>,2|Se<2>} Se[6](As[6]Se[6]Se)2{1|As<3>} Se[6](As[6]Se[6]Se)2{1|As<3>} 100.0603 2.115 2 100.0603 4.474 2 100.0603 4.474 2 100.0603 4.474 2 100.2992 1.686 7 100.2992 1.686 7 286 14 643 6:SP2_SP2_SP3 S[6] P[6] C[6,6a] 3:3: 2:2:3: 3:3:2: C[6,6a]-3:P[6]-3: S[6]-2:S[6]-2:N-3: C[6,6a,6a]-3:C[6a]-3:S[6]-2: S[6](C[6,6a]C[6,6a,6a]C[6a])(P[6]S[6]N) P[6](S[6]C[6,6a])2(NCC) C[6,6a](C[6,6a,6a]C[6a,6a]C[6,6a])(C[6a]C[6a]H)(S[6]P[6]) S[6](C[6,6a]C[6,6a,6a]C[6a])(P[6]S[6]N){1|H<1>,3|C<3>} P[6](S[6]C[6,6a])2(NCC){3|C<3>} C[6,6a](C[6,6a,6a]C[6a,6a]C[6,6a])(C[6a]C[6a]H)(S[6]P[6]){1|H<1>,1|N<3>,1|S<2>,3|C<3>} 100.3242 1.065 2 100.3242 1.134 2 100.3242 1.134 2 103.2286 11.734 4 103.2286 11.734 4 103.2286 11.734 4 286 14 643 6:SP2_SP2_SP3 S[6] P[6] C[6,6a] 3:3: 2:2:3: 3:3:2: C[6,6a]-3:P[6]-3: S[6]-2:S[6]-2:P[6]-3: C[6,6a,6a]-3:C[6a]-3:S[6]-2: S[6](C[6,6a]C[6,6a,6a]C[6a])(P[6]P[6]S[6]) P[6](S[6]C[6,6a])2(P[6]S[6]2) C[6,6a](C[6,6a,6a]C[6a,6a]C[6,6a])(C[6a]C[6a]H)(S[6]P[6]) S[6](C[6,6a]C[6,6a,6a]C[6a])(P[6]P[6]S[6]){1|H<1>,2|S<2>,3|C<3>} P[6](S[6]C[6,6a])2(P[6]S[6]2){5|C<3>} C[6,6a](C[6,6a,6a]C[6a,6a]C[6,6a])(C[6a]C[6a]H)(S[6]P[6]){1|H<1>,1|P<3>,1|S<2>,3|C<3>} 106.1330 0.571 2 106.1330 0.326 2 106.1330 0.326 2 103.2286 11.734 4 103.2286 11.734 4 103.2286 11.734 4 286 98 466 6:SP3_SP3_SP3 S[6] As[5,6] C[6] 3:4: 2:2:2: 4:2:1:1: As[5,6]-3:C[6]-4: O[5,6]-2:S[5]-2:S[6]-2: C[6]-4:S[6]-2:H-1:H-1: S[6](As[5,6]O[5,6]S[5])(C[6]C[6]HH) As[5,6](O[5,6]C[5,6])(S[5]C[5])(S[6]C[6]) C[6](C[6]C[5,6]HO)(S[6]As[5,6])(H)2 S[6](As[5,6]O[5,6]S[5])(C[6]C[6]HH){1|H<1>,1|O<2>,2|C<4>} As[5,6](O[5,6]C[5,6])(S[5]C[5])(S[6]C[6]){1|C<4>,5|H<1>} C[6](C[6]C[5,6]HO)(S[6]As[5,6])(H)2{1|C<4>,1|H<1>,1|O<2>,1|S<2>} 99.2680 0.000 1 99.2680 0.000 1 99.2680 0.000 1 99.2680 0.000 1 99.2680 0.000 1 99.2680 0.000 1 286 206 762 6:SP2_SP1_SP2 S[6] C[6] C[6] 3:2: 4:2: 3:2:2: C[6]-3:C[6]-2: C[6]-4:S[6]-2: C[5a]-3:S[6]-2:S[6]-2: S[6](C[6]C[5a]S[6])(C[6]C[6]) C[6](C[6]C[6]HH)(S[6]C[6]) C[6](C[5a]S[5a]2)(S[6]C[6])2 S[6](C[6]C[5a]S[6])(C[6]C[6]){1|C<4>,2|H<1>,2|S<2>} C[6](C[6]C[6]HH)(S[6]C[6]){1|C<3>,1|S<2>,2|H<1>} C[6](C[5a]S[5a]2)(S[6]C[6])2{1|C<4>,2|C<3>,2|H<1>} 102.1640 0.000 1 102.1640 0.000 1 102.1640 0.000 1 102.1640 0.000 1 102.1640 0.000 1 102.1640 0.000 1 286 206 818 6:SP2_SP1_SP2 S[6] C[6] C[5,6] 3:2: 2:2: 3:2:2: C[5,6]-3:C[6]-2: S[6]-2:C[6]-2: C[5,6]-3:S[5]-2:S[6]-2: S[6](C[5,6]C[5,6]S[5])(C[6]C[6]) C[6](S[6]C[5,6])(C[6]S[6]) C[5,6](C[5,6]S[5]S[6])(S[5]C[5])(S[6]C[6]) S[6](C[5,6]C[5,6]S[5])(C[6]C[6]){1|C<3>,2|S<2>} C[6](S[6]C[5,6])(C[6]S[6]){1|C<3>,1|S<2>} C[5,6](C[5,6]S[5]S[6])(S[5]C[5])(S[6]C[6]){1|C<2>,1|C<3>} 101.0555 2.742 17 101.0555 7.516 17 101.0555 7.516 17 101.0555 7.516 17 101.0555 7.516 17 101.0555 7.516 17 286 254 254 6:SP3_SP3_SP3 S[6,6] Ge[3x6] Ge[3x6] 4:4: 2:2:2:1: 2:2:2:1: Ge[3x6]-4:Ge[3x6]-4: S[6,6]-2:S[6,6]-2:S[6,6]-2:S-1: S[6,6]-2:S[6,6]-2:S[6,6]-2:S-1: S[6,6](Ge[3x6]S[6,6]2S)2 Ge[3x6](S[6,6]Ge[3x6])3(S) Ge[3x6](S[6,6]Ge[3x6])3(S) S[6,6](Ge[3x6]S[6,6]2S)2{2|Ge<4>} Ge[3x6](S[6,6]Ge[3x6])3(S){3|S<1>,3|S<2>} Ge[3x6](S[6,6]Ge[3x6])3(S){3|S<1>,3|S<2>} 107.2931 1.949 60 107.2931 3.798 60 107.2931 3.798 60 107.2931 3.798 60 107.2931 3.798 60 107.2931 3.798 60 286 282 282 6:SP3_SP3_SP3 S[6] As[6] As[6] 3:3: 2:2:1: 2:2:1: As[6]-3:As[6]-3: S[6]-2:S[6]-2:S-1: S[6]-2:S[6]-2:S-1: S[6](As[6]S[6]S)2 As[6](S[6]As[6])2(S) As[6](S[6]As[6])2(S) S[6](As[6]S[6]S)2{1|As<3>} As[6](S[6]As[6])2(S){1|S<2>,2|S<1>} As[6](S[6]As[6])2(S){1|S<2>,2|S<1>} 97.7788 2.463 12 97.7788 6.064 12 97.7788 6.064 12 97.7788 6.064 12 97.7788 6.064 12 97.7788 6.064 12 286 282 286 6:SP3_SP3_SP3 S[6] As[6] S[6] 3:2: 2:2:1: 2:2: As[6]-3:S[6]-2: S[6]-2:S[6]-2:S-1: S[6]-2:S[6]-2: S[6](As[6]S[6]S)(S[6]S[6]) As[6](S[6]S[6])2(S) S[6](S[6]As[6])(S[6]S[6]) S[6](As[6]S[6]S)(S[6]S[6]){1|S<2>} As[6](S[6]S[6])2(S){1|S<2>} S[6](S[6]As[6])(S[6]S[6]){1|S<1>,1|S<2>} 101.5593 5.719 2 101.5593 32.702 2 101.5593 32.702 2 101.5593 32.702 2 100.3623 12.866 4 100.3623 12.866 4 286 282 286 6:SP3_SP3_SP3 S[6] As[6] S[6] 3:2: 2:2:2: 3:2: As[6]-3:S[6]-2: S[6]-2:S[6]-2:S-2: As[6]-3:S[6]-2: S[6](As[6]S[6]S)(S[6]As[6]) As[6](S[6]S[6])2(SMn) S[6](As[6]S[6]S)(S[6]As[6]) S[6](As[6]S[6]S)(S[6]As[6]){2|S<2>} As[6](S[6]S[6])2(SMn){1|As<3>} S[6](As[6]S[6]S)(S[6]As[6]){2|S<2>} 99.1652 0.405 2 99.1652 0.164 2 99.1652 0.164 2 99.1652 0.164 2 100.3623 12.866 4 100.3623 12.866 4 286 286 286 6:SP3_SP3_SP3 S[6] S[6] S[6] 2:2: 2:2: 2:2: S[6]-2:S[6]-2: S[6]-2:S[6]-2: S[6]-2:S[6]-2: S[6](S[6]S[6])2 S[6](S[6]As[6])(S[6]S[6]) S[6](S[6]As[6])(S[6]S[6]) S[6](S[6]S[6])2{1|As<3>} S[6](S[6]As[6])(S[6]S[6]){1|S<1>,1|S<2>} S[6](S[6]As[6])(S[6]S[6]){1|S<1>,1|S<2>} 101.9630 0.000 1 101.9630 0.000 1 101.9630 0.000 1 101.9630 0.000 1 101.4724 11.527 6 101.4724 11.527 6 286 286 286 6:SP3_SP3_SP3 S[6] S[6] S[6] 2:2: 3:2: 2:2: S[6]-2:S[6]-2: As[6]-3:S[6]-2: S[6]-2:S[6]-2: S[6](S[6]As[6])(S[6]S[6]) S[6](As[6]S[6]S)(S[6]S[6]) S[6](S[6]S[6])2 S[6](S[6]As[6])(S[6]S[6]){1|S<1>,1|S<2>} S[6](As[6]S[6]S)(S[6]S[6]){1|S<2>} S[6](S[6]S[6])2{1|As<3>} 104.9960 1.913 2 104.9960 3.661 2 104.9960 3.661 2 104.9960 3.661 2 101.4724 11.527 6 101.4724 11.527 6 286 286 286 6:SP3_SP3_SP3 S[6] S[6] S[6] 2:2: 3:2: 3:2: S[6]-2:S[6]-2: N[6]-3:S[6]-2: N[6]-3:S[6]-2: S[6](S[6]N[6])2 S[6](N[6]P[6]C)(S[6]S[6]) S[6](N[6]P[6]C)(S[6]S[6]) S[6](S[6]N[6])2{1|P<4>,2|C<4>} S[6](N[6]P[6]C)(S[6]S[6]){1|C<3>,1|N<3>,1|O<1>} S[6](N[6]P[6]C)(S[6]S[6]){1|C<3>,1|N<3>,1|O<1>} 96.3914 0.000 1 96.3914 0.000 1 96.3914 0.000 1 96.3914 0.000 1 101.4724 11.527 6 101.4724 11.527 6 286 286 286 6:SP3_SP3_SP3 S[6] S[6] S[6] 2:2: 4:2: 2:2: S[6]-2:S[6]-2: C[5,6]-4:S[6]-2: S[6]-2:S[6]-2: S[6](S[6]C[5,6])(S[6]S[6]) S[6](C[5,6]C[5,6a]2C[5,6])(S[6]S[6]) S[6](S[6]C[5,6])(S[6]S[6]) S[6](S[6]C[5,6])(S[6]S[6]){1|C<4>,2|C<3>} S[6](C[5,6]C[5,6a]2C[5,6])(S[6]S[6]){1|S<2>,6|C<3>} S[6](S[6]C[5,6])(S[6]S[6]){1|C<4>,2|C<3>} 100.2440 0.257 2 100.2440 0.066 2 100.2440 0.066 2 100.2440 0.066 2 101.4724 11.527 6 101.4724 11.527 6 286 286 466 6:SP3_SP2_SP3 S[6] S[6] C[6] 4:2: 3:2: 4:2:2:1: C[6]-4:S[6]-2: C[6]-3:S[6]-2: C[6]-4:S[6]-2:S[6]-2:H-1: S[6](C[6]C[6]S[6]H)(S[6]C[6]) S[6](C[6]C[6]H)(S[6]C[6]) C[6](C[6]S[6]2H)(S[6]C[6])(S[6]S[6])(H) S[6](C[6]C[6]S[6]H)(S[6]C[6]){1|C<3>,2|H<1>,2|S<2>} S[6](C[6]C[6]H)(S[6]C[6]){1|C<4>,1|S<2>,2|H<1>} C[6](C[6]S[6]2H)(S[6]C[6])(S[6]S[6])(H){1|H<1>,1|S<2>,2|C<3>} 99.1926 0.000 1 99.1926 0.000 1 99.1926 0.000 1 99.1926 0.000 1 99.1926 0.000 1 99.1926 0.000 1 286 286 466 6:SP3_SP3_SP3 S[6,6] S[6,6] C[3x6] 4:2: 4:2: 3:3:2:4: C[3x6]-4:S[6,6]-2: C[3x6]-4:S[6,6]-2: C[6,6]-3:N[6,6]-3:S[6,6]-2:C-4: S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]) C[3x6](C[6,6]N[6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CCCH) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>} C[3x6](C[6,6]N[6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CCCH){1|C<4>,1|H<1>,1|O<1>} 98.8897 0.000 1 98.8897 0.000 1 98.4965 0.309 2 98.6163 0.302 9 98.6163 0.302 9 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6,6] S[6,6] C[3x6] 4:2: 4:2: 3:3:2:4: C[3x6]-4:S[6,6]-2: C[3x6]-4:S[6,6]-2: C[6,6]-3:N[6,6]-3:S[6,6]-2:C-4: S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]) C[3x6](C[6,6]N[6,6]O)(N[6,6]C[6,6]H)(S[6,6]S[6,6])(CC[5a]HO) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>} S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} C[3x6](C[6,6]N[6,6]O)(N[6,6]C[6,6]H)(S[6,6]S[6,6])(CC[5a]HO){1|O<1>,2|C<4>} 98.1032 0.000 1 98.1032 0.000 1 98.4965 0.309 2 98.6163 0.302 9 98.6163 0.302 9 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6,6] S[6,6] C[3x6] 4:2: 4:2: 3:3:2:4: C[3x6]-4:S[6,6]-2: C[5,3x6]-4:S[6,6]-2: C[6,6]-3:N[6,6]-3:S[6,6]-2:C-4: S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CC[6a]HO) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|H<1>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,2|C<4>} C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CC[6a]HO){1|O<1>,2|C<4>} 98.2742 0.000 1 98.2742 0.000 1 98.6505 0.345 7 98.6163 0.302 9 98.6163 0.302 9 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6,6] S[6,6] C[3x6] 4:2: 4:2: 3:3:2:4: C[3x6]-4:S[6,6]-2: C[5,3x6]-4:S[6,6]-2: C[6,6]-3:N[6,6]-3:S[6,6]-2:C-4: S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CH3) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|C<3>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,3|C<4>} C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CH3){1|O<1>,2|C<4>} 99.0427 0.155 4 98.9481 0.063 5 98.6505 0.345 7 98.6163 0.302 9 98.6163 0.302 9 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6,6] S[6,6] C[3x6] 4:2: 4:2: 3:3:2:4: C[3x6]-4:S[6,6]-2: C[5,3x6]-4:S[6,6]-2: C[6,6]-3:N[6,6]-3:S[6,6]-2:C-4: S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CH3) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|C<3>,1|N<3>,1|O<1>,2|H<1>,3|C<4>} C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CH3){1|O<1>,2|C<4>} 98.5701 0.000 1 98.9481 0.063 5 98.6505 0.345 7 98.6163 0.302 9 98.6163 0.302 9 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6,6] S[6,6] C[3x6] 4:2: 4:2: 3:3:2:4: C[3x6]-4:S[6,6]-2: C[5,3x6]-4:S[6,6]-2: C[6,6]-3:N[6,6]-3:S[6,6]-2:C-4: S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CHHO) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|C<4>,1|N<3>,1|O<1>,2|H<1>,3|C<3>} C[3x6](C[6,6]N[5,6,6]O)(N[6,6]C[6,6]C)(S[6,6]S[6,6])(CHHO){1|C<3>,1|C<4>,1|O<1>} 97.5389 0.000 1 97.5389 0.000 1 98.6505 0.345 7 98.6163 0.302 9 98.6163 0.302 9 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5x6] 4:2: 4:2: 3:4:2:2: C[5x6]-4:S[6,6]-2: C[5x6]-4:S[6,6]-2: C[4x6]-3:C[3x6]-4:S[6,6]-2:S[6,6]-2: S[6,6](C[5x6]C[3x6]C[4x6]S[6,6])(S[6,6]C[5x6]) S[6,6](C[5x6]C[3x6]C[4x6]S[6,6])(S[6,6]C[5x6]) C[5x6](C[4x6]C[3x6]C[4x6])(C[3x6]C[6,6]2H)(S[6,6]S[6,6])2 S[6,6](C[5x6]C[3x6]C[4x6]S[6,6])(S[6,6]C[5x6]){1|C<3>,1|H<1>,1|S<2>,4|C<4>} S[6,6](C[5x6]C[3x6]C[4x6]S[6,6])(S[6,6]C[5x6]){1|C<3>,1|H<1>,1|S<2>,4|C<4>} C[5x6](C[4x6]C[3x6]C[4x6])(C[3x6]C[6,6]2H)(S[6,6]S[6,6])2{4|C<4>,5|H<1>} 103.8792 1.608 4 103.8792 2.586 4 103.8792 2.586 4 103.8792 2.586 4 103.8792 2.586 4 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6] S[6] C[6] 4:2: 4:2: 4:2:1:1: C[6]-4:S[6]-2: C[5,6]-4:S[6]-2: C[5,6]-4:S[6]-2:H-1:H-1: S[6](C[6]C[5,6]HH)(S[6]C[5,6]) S[6](C[5,6]C[5,6]C[5]H)(S[6]C[6]) C[6](C[5,6]C[5,6]O[5]C)(S[6]S[6])(H)2 S[6](C[6]C[5,6]HH)(S[6]C[5,6]){1|H<1>,1|O<2>,3|C<4>} S[6](C[5,6]C[5,6]C[5]H)(S[6]C[6]){1|C<4>,1|N<3>,2|O<2>,4|H<1>} C[6](C[5,6]C[5,6]O[5]C)(S[6]S[6])(H)2{1|H<1>,1|O<2>,2|C<4>} 100.6980 0.000 1 100.6980 0.000 1 100.6980 0.000 1 98.5855 1.726 5 98.0404 2.342 7 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6] S[6] C[6] 4:2: 4:2: 4:2:1:1: C[6]-4:S[6]-2: C[6]-4:S[6]-2: C[5,6]-4:S[6]-2:H-1:H-1: S[6](C[6]C[5,6]HH)(S[6]C[6]) S[6](C[6]C[5,6]N[6a]H)(S[6]C[6]) C[6](C[5,6]C[5,6]O[5]H)(S[6]S[6])(H)2 S[6](C[6]C[5,6]HH)(S[6]C[6]){1|C<4>,1|N<3>,1|O<2>,2|H<1>} S[6](C[6]C[5,6]N[6a]H)(S[6]C[6]){1|C<4>,1|O<2>,2|C<3>,3|H<1>} C[6](C[5,6]C[5,6]O[5]H)(S[6]S[6])(H)2{1|H<1>,1|O<2>,2|C<4>} 97.6584 0.058 2 97.6584 0.003 2 97.6584 0.003 2 98.5855 1.726 5 98.0404 2.342 7 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6] S[6] C[6] 4:2: 4:2: 4:2:1:1: C[6]-4:S[6]-2: C[6]-4:S[6]-2: C[6]-4:S[6]-2:H-1:H-1: S[6](C[6]C[6]HH)(S[6]C[6]) S[6](C[6]C[6]HH)(S[6]C[6]) C[6](C[6]C[6]HN)(S[6]S[6])(H)2 S[6](C[6]C[6]HH)(S[6]C[6]){1|C<4>,1|N<3>,3|H<1>} S[6](C[6]C[6]HH)(S[6]C[6]){1|C<4>,1|N<3>,3|H<1>} C[6](C[6]C[6]HN)(S[6]S[6])(H)2{1|C<4>,1|H<1>,1|N<3>} 98.4564 0.828 2 98.4564 0.686 2 98.4564 0.686 2 98.5855 1.726 5 98.0404 2.342 7 99.4673 6.466 20 286 286 466 6:SP3_SP3_SP3 S[6] S[6] C[6] 4:2: 4:2: 4:3:2:1: C[6]-4:S[6]-2: C[6]-4:S[6]-2: C[5,6]-4:N[6a]-3:S[6]-2:H-1: S[6](C[6]C[5,6]N[6a]H)(S[6]C[6]) S[6](C[6]C[5,6]HH)(S[6]C[6]) C[6](C[5,6]C[5,6]O[5]H)(N[6a]C[6a]2)(S[6]S[6])(H) S[6](C[6]C[5,6]N[6a]H)(S[6]C[6]){1|C<4>,1|O<2>,2|C<3>,3|H<1>} S[6](C[6]C[5,6]HH)(S[6]C[6]){1|C<4>,1|N<3>,1|O<2>,2|H<1>} C[6](C[5,6]C[5,6]O[5]H)(N[6a]C[6a]2)(S[6]S[6])(H){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>} 96.6776 1.397 2 96.6776 1.951 2 96.6776 1.951 2 96.6776 1.951 2 98.0404 2.342 7 99.4673 6.466 20 286 286 474 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5,3x6] 4:2: 4:2: 3:3:2:4: C[5,3x6]-4:S[6,6]-2: C[3x6]-4:S[6,6]-2: N[5,6,6]-3:C[6,6]-3:S[6,6]-2:C[5]-4: S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) C[5,3x6](N[5,6,6]C[6,6]C[5])(C[6,6]N[6,6]O)(S[6,6]S[6,6])(C[5]C[5]HH) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|C<3>,1|N<3>,1|O<1>,2|H<1>,3|C<4>} S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} C[5,3x6](N[5,6,6]C[6,6]C[5])(C[6,6]N[6,6]O)(S[6,6]S[6,6])(C[5]C[5]HH){1|O<1>,1|O<2>,2|C<4>,3|H<1>} 97.2681 0.000 1 97.2681 0.000 1 96.7528 0.531 2 96.7528 0.531 2 97.3042 1.678 11 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5,3x6] 4:2: 4:2: 3:3:2:4: C[5,3x6]-4:S[6,6]-2: C[3x6]-4:S[6,6]-2: N[5,6,6]-3:C[6,6]-3:S[6,6]-2:C[5]-4: S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) C[5,3x6](N[5,6,6]C[6,6]C[5])(C[6,6]N[6,6]O)(S[6,6]S[6,6])(C[5]C[5]HO) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|H<1>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,2|C<4>} S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} C[5,3x6](N[5,6,6]C[6,6]C[5])(C[6,6]N[6,6]O)(S[6,6]S[6,6])(C[5]C[5]HO){1|C<3>,1|H<1>,1|O<1>,3|C<4>} 96.2376 0.000 1 96.2376 0.000 1 96.7528 0.531 2 96.7528 0.531 2 97.3042 1.678 11 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5,3x6] 4:2: 4:2: 3:3:4:2: C[5,3x6]-4:S[6,6]-2: C[3x6]-4:S[6,6]-2: N[5,6,6]-3:C[6,6]-3:C[5]-4:S[6,6]-2: S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) C[5,3x6](N[5,6,6]C[5,5]C[6,6])(C[6,6]N[6,6]O)(C[5]C[5,5]HO)(S[6,6]S[6,6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|C<3>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,3|C<4>} S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} C[5,3x6](N[5,6,6]C[5,5]C[6,6])(C[6,6]N[6,6]O)(C[5]C[5,5]HO)(S[6,6]S[6,6]){1|C<3>,1|H<1>,1|N<3>,1|O<1>,3|C<4>} 97.1547 0.000 1 96.0430 0.932 3 96.0430 0.932 3 97.1257 1.282 8 97.3042 1.678 11 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5,3x6] 4:2: 4:2: 3:3:4:2: C[5,3x6]-4:S[6,6]-2: C[3x6]-4:S[6,6]-2: N[5,6,6]-3:C[6,6]-3:C[5]-4:S[6,6]-2: S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) C[5,3x6](N[5,6,6]C[5,5]C[6,6])(C[6,6]N[6,6]O)(C[5]C[5,5]HO)(S[6,6]S[6,6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|C<3>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,3|C<4>} S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} C[5,3x6](N[5,6,6]C[5,5]C[6,6])(C[6,6]N[6,6]O)(C[5]C[5,5]HO)(S[6,6]S[6,6]){1|H<1>,1|N<3>,1|O<1>,2|C<3>,2|C<4>} 95.4871 0.106 2 96.0430 0.932 3 96.0430 0.932 3 97.1257 1.282 8 97.3042 1.678 11 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5,3x6] 4:2: 4:2: 3:3:4:2: C[5,3x6]-4:S[6,6]-2: C[5,3x6]-4:S[6,6]-2: N[5,6,6]-3:C[6,6]-3:C[5]-4:S[6,6]-2: S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]) C[5,3x6](N[5,6,6]C[5,6]C[6,6])(C[6,6]N[5,6,6]O)(C[5]C[5,6]HH)(S[6,6]S[6,6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|H<1>,3|C<4>} S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|H<1>,3|C<4>} C[5,3x6](N[5,6,6]C[5,6]C[6,6])(C[6,6]N[5,6,6]O)(C[5]C[5,6]HH)(S[6,6]S[6,6]){1|C<3>,1|O<1>,2|H<1>,3|C<4>} 97.5356 0.888 2 97.7753 0.371 5 97.7753 0.371 5 97.1257 1.282 8 97.3042 1.678 11 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5,3x6] 4:2: 4:2: 3:3:4:2: C[5,3x6]-4:S[6,6]-2: C[5,3x6]-4:S[6,6]-2: N[5,6,6]-3:C[6,6]-3:C[5]-4:S[6,6]-2: S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]) C[5,3x6](N[5,6,6]C[5,6]C[6,6])(C[6,6]N[5,6,6]O)(C[5]C[5,6]HH)(S[6,6]S[6,6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|H<1>,3|C<4>} S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|H<1>,3|C<4>} C[5,3x6](N[5,6,6]C[5,6]C[6,6])(C[6,6]N[5,6,6]O)(C[5]C[5,6]HH)(S[6,6]S[6,6]){1|O<1>,2|H<1>,4|C<4>} 97.9350 0.503 3 97.7753 0.371 5 97.7753 0.371 5 97.1257 1.282 8 97.3042 1.678 11 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6,6] S[6,6] C[5,3x6] 4:2: 4:2: 3:4:3:2: C[5,3x6]-4:S[6,6]-2: C[3x6]-4:S[6,6]-2: N[5,6,6]-3:C[5]-4:C[6,6]-3:S[6,6]-2: S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]) S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]) C[5,3x6](N[5,6,6]C[5,6a]C[6,6])(C[5]C[5,6a]HH)(C[6,6]N[6,6]O)(S[6,6]S[6,6]) S[6,6](C[5,3x6]N[5,6,6]C[6,6]C[5])(S[6,6]C[3x6]){1|C<4>,1|N<3>,1|O<1>,2|H<1>,3|C<3>} S[6,6](C[3x6]C[6,6]N[6,6]C)(S[6,6]C[5,3x6]){1|C<3>,1|N<3>,1|O<1>,2|C<4>} C[5,3x6](N[5,6,6]C[5,6a]C[6,6])(C[5]C[5,6a]HH)(C[6,6]N[6,6]O)(S[6,6]S[6,6]){1|O<1>,2|C<3>,2|C<4>} 99.8353 0.000 1 99.8353 0.000 1 99.8353 0.000 1 99.8353 0.000 1 97.3042 1.678 11 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6] S[6] C[5,6] 4:2: 2:2: 3:3:4:2: C[5,6]-4:S[6]-2: S[6]-2:S[6]-2: C[5,6a]-3:C[5,6a]-3:C[5,6]-4:S[6]-2: S[6](C[5,6]C[5,6a]2C[5,6])(S[6]S[6]) S[6](S[6]C[5,6])(S[6]S[6]) C[5,6](C[5,6a]C[5,6a]C[6a])2(C[5,6]C[5,6a]2S[6])(S[6]S[6]) S[6](C[5,6]C[5,6a]2C[5,6])(S[6]S[6]){1|S<2>,6|C<3>} S[6](S[6]C[5,6])(S[6]S[6]){1|C<4>,2|C<3>} C[5,6](C[5,6a]C[5,6a]C[6a])2(C[5,6]C[5,6a]2S[6])(S[6]S[6]){1|S<2>,2|H<1>,8|C<3>} 104.9045 0.192 2 104.9045 0.037 2 104.9045 0.037 2 104.9045 0.037 2 102.8531 12.643 3 98.4933 8.818 14 286 286 474 6:SP3_SP3_SP3 S[6] S[6] C[5,6] 4:2: 4:2: 4:4:2:1: C[5,6]-4:S[6]-2: C[6]-4:S[6]-2: C[5,6]-4:C[5]-4:S[6]-2:H-1: S[6](C[5,6]C[5,6]C[5]H)(S[6]C[6]) S[6](C[6]C[5,6]HH)(S[6]C[5,6]) C[5,6](C[5,6]C[5,6]HO)(C[5]N[6a]O[5]H)(S[6]S[6])(H) S[6](C[5,6]C[5,6]C[5]H)(S[6]C[6]){1|C<4>,1|N<3>,2|O<2>,4|H<1>} S[6](C[6]C[5,6]HH)(S[6]C[5,6]){1|H<1>,1|O<2>,3|C<4>} C[5,6](C[5,6]C[5,6]HO)(C[5]N[6a]O[5]H)(S[6]S[6])(H){2|C<3>,2|C<4>} 98.7504 0.000 1 98.7504 0.000 1 98.7504 0.000 1 98.7504 0.000 1 102.8531 12.643 3 98.4933 8.818 14