0 B10R0.71 BrCCCCCCCCCBr D50565 [0,0,0,0,0,0|2,0,0]=2 1 B10R0.71 C=CCCCCCCCCBr B53284 [0,0,0,0,0,0|2,0,1]=3 2 B10R0.71 CCCCCCCCN=[N+]=[N-] A1810 [0,0,0,0,0,0|4,0,0]=4 3 B10R0.71 ClCCCCCCCCCCl D50566 [0,0,0,0,0,0|2,0,0]=2 4 B10R0.71 OCCCCCCCCCBr B50608 [0,0,0,0,0,0|1,1,0]=2 5 B10R0.71 OCCOCCCCCCCl C61799 [0,0,0,0,0,0|2,1,0]=3 6 B9R0.45 BrCCCCCCCCBr D60579 [1,0,0,0,0,0|2,0,0]=3 7 B9R0.45 C#CCCCCCCCO N50499 [1,0,0,0,0,0|0,1,2]=4 8 B9R0.45 C=CCCCCCCCCl C50527 [1,0,0,0,0,0|1,0,2]=4 9 B9R0.45 CCCCCCCCC[Mg+] N31713 [1,0,0,0,0,0|1,0,0]=2 10 B9R0.45 CCCCCCCCNC M50621 [1,0,0,0,0,0|2,0,0]=3 11 B9R0.45 CCCCCCCN=[N+]=[N-] A1944 [1,0,0,0,0,0|3,0,0]=4 12 B9R0.45 CCCCCCCNCC E50620 [1,0,0,0,0,0|2,0,0]=3 13 B9R0.45 OCCCCCCCCBr B47189 [1,0,0,0,0,0|1,1,0]=3 14 B9R0.45 OCCCCCCCCCl C47190 [1,0,0,0,0,0|1,1,0]=3 15 B9R0.45 OCCCCCCCCO X39448 [1,0,0,0,0,0|0,2,0]=3 16 B11R0.3 BrCCCCCCCCCCBr D39629 [0,1,0,0,0,0|2,0,0]=3 17 B11R0.3 C=CCCCCCCCCCBr B55096 [0,1,0,0,0,0|2,0,0]=3 18 B11R0.3 C=CCCCCCCCCCC D56327 [0,1,0,0,0,0|2,0,0]=3 19 B11R0.3 C=CCCCCCCCCCO U55141 [0,1,0,0,0,0|1,1,0]=3 20 B11R0.3 CCCCCCCCCCCO U67607 [0,1,0,0,0,0|1,1,0]=3 21 B11R0.3 ClCCCCCCCCCCCl D39630 [0,1,0,0,0,0|2,0,0]=3 22 B11R0.3 OCCCCCCCCCCBr B53359 [0,1,0,0,0,0|1,1,0]=3 23 B11R0.148 NCCCCCCCCC(=O)O A50593 [0,1,0,0,0,0|1,1,1]=4 24 B11R0.148 O=C(O)CCCCCCCCBr B38107 [0,1,0,0,0,0|1,1,1]=4 25 B11R0.148 O=C(O)CCCCCCCCO H68316 [0,1,0,0,0,0|0,2,1]=4 26 B11R1.4 NCCCCCN1CCCC1 P52261 [0,0,0,1,0,0|3,0,0]=4 27 B11R1.4 OCCCCO[C@@H]1CCCO1 T47162 [0,0,0,1,0,0|1,2,0]=4 28 B11R1.28 BrCCCO[C@@H]1CCCCO1 B47142 [0,0,0,1,0,0|2,1,0]=4 29 B8R0.4 BrCCCCCCCBr D43869 [2,0,0,0,0,0|2,0,0]=4 30 B8R0.4 CCCCCCCNC M47212 [2,0,0,0,0,0|1,0,0]=3 31 B8R0.4 COCCCCCCBr B43941 [2,0,0,0,0,0|2,0,0]=4 32 B8R0.4 OCCCCCCCBr B43940 [2,0,0,0,0,0|1,1,0]=4 33 B10R0.4 CCCCCCCCB(O)O O4860 [1,1,0,0,0,0|1,1,0]=4 34 B10R0.4 CCCCCCCCC(C)=O D53335 [1,1,0,0,0,0|0,1,1]=4 35 B12R0.5 C#CCCCCCCCCCCO D56304 [0,2,0,0,0,0|1,1,0]=4 36 B12R0.5 CCCCCCCCCCCCO D64921 [0,2,0,0,0,0|1,1,0]=4 37 B12R0.5 CCCCCCCCCCN=[N+]=[N-] A1900 [0,2,0,0,0,0|2,0,0]=4 38 B12R0.5 CCOCCCCCCCCCO E64231 [0,2,0,0,0,0|0,2,0]=4 39 B12R0.5 OCCCCCCCCCCCBr B55158 [0,2,0,0,0,0|1,1,0]=4 40 B12R0.5 OCCCCCCCCCCCO U55159 [0,2,0,0,0,0|0,2,0]=4 41 B12R0.234 CCCCCCCCCCB(O)O D53367 [0,2,0,0,0,0|1,1,0]=4 42 B12R0.234 NCCCCCCCCCC(=O)O A53349 [0,2,0,0,0,0|1,1,0]=4 43 B12R0.234 O=C(O)CCCCCCCCCBr B53316 [0,2,0,0,0,0|1,1,0]=4 44 B12R0.111 CCCCCC[C@@H](CBr)CCCC B56346 [0,2,0,0,0,0|2,0,0]=4 45 B10R1.17 BrCCOC1CCCCC1 B47143 [1,0,0,1,0,0|2,0,0]=4 46 B10R1.17 CCCCC1CCNCC1 B0923 [1,0,0,1,0,0|2,0,0]=4 47 B10R1.17 COCC[C@H]1CCCCN1 M49583 [1,0,0,1,0,0|2,0,0]=4 48 B10R1.17 ClCCCN1CCCCC1 C47153 [1,0,0,1,0,0|2,0,0]=4 49 B10R1.17 OCCCC1CCNCC1 P13257 [1,0,0,1,0,0|1,1,0]=4 50 B10R1.17 OCCCN1CCCCC1 P16239 [1,0,0,1,0,0|1,1,0]=4 51 B10R1.20 OC[C@@H]1CCCC[C@H]1CO C47157 [1,0,0,1,0,0|0,2,0]=4 52 B10R1.20 OC[C@H]1CCCC[C@@H]1CO C47158 [1,0,0,1,0,0|0,2,0]=4 53 B10R1.85 ClCCN1CCCCCC1 C47152 [1,0,0,1,0,0|2,0,0]=4 54 B10R1.85 ClCCN1CCCCCC1 C65016 [1,0,0,1,0,0|2,0,0]=4 55 B10R1.85 OCCN1CCCCCC1 A47168 [1,0,0,1,0,0|1,1,0]=4 56 B12R1.8 BrCCCCO[C@@H]1CCCCO1 B50561 [0,1,0,1,0,0|1,1,0]=4 57 B12R1.1 CCCCCC1CCC(O)CC1 P55142 [0,1,0,1,0,0|2,0,0]=4