0 B8R0.6 COC(=O)CCCCCl CS-0098043 [0,0,0,0,0,0|2,0,0]=2 1 B8R0.6 COC(=O)CCCCN CS-0018002 [0,0,0,0,0,0|2,0,0]=2 2 B8R0.6 COCCCC(=O)OC CS-W011093 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.1 ClCCCCCCBr CS-W010503 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.3 COC(=O)CCCBr CS-W004701 [1,0,0,0,0,0|2,0,0]=3 5 B7R0.3 COC(=O)CCCCl CS-0001466 [1,0,0,0,0,0|2,0,0]=3 6 B7R0.4 C#CCCCC(=O)O CS-W009272 [1,0,0,0,0,0|1,0,2]=4 7 B7R0.4 CC(=O)OCCCCl CS-W017752 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.4 O=C(O)CCCCBr CS-W017172 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.4 O=C(O)CCCCCl CS-W022362 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.4 O=C([O-])CCCCO CS-0047732 [1,0,0,0,0,0|2,0,0]=3 11 B9R0.1 COC(=O)CCCC(C)=O CS-0090564 [0,1,0,0,0,0|1,0,1]=3 12 B9R0.34 CCCC(=O)CC(=O)OC CS-W005176 [0,1,0,0,0,0|1,0,1]=3 13 B9R0.34 CCOC(=O)CC(=O)CC CS-W019881 [0,1,0,0,0,0|1,0,1]=3 14 B9R0.34 CCOC(=O)CC(=O)CCl CS-D1440 [0,1,0,0,0,0|2,0,1]=4 15 B9R0.34 COCC(=O)CC(=O)OC CS-W007767 [0,1,0,0,0,0|2,0,1]=4 16 B9R0.46 COC(=O)CCCCCBr CS-W015176 [0,1,0,0,0,0|1,0,0]=2 17 B9R1.1 CCC1CCC(=O)CC1 CS-W011153 [0,0,0,1,0,0|0,0,0]=1 18 B9R1.1 CN[C@H]1CC[C@H](O)CC1 CS-W019271 [0,0,0,1,0,0|1,0,2]=4 19 B9R1.1 N#CC1CCC(=O)CC1 CS-D0281 [0,0,0,1,0,0|1,0,1]=3 20 B9R1.1 N[C@H]1CC[C@H](CO)CC1 CS-0011345 [0,0,0,1,0,0|2,0,1]=4 21 B9R1.5 NC1CCCCNC1=O CS-M1433 [0,0,0,1,0,0|2,0,0]=3 22 B9R1.11 CNC(=O)[C@@H]1CCCN1 CS-WAA0154 [0,0,0,1,0,0|2,0,0]=3 23 B9R1.11 COC(=O)C1=CCCC1 CS-D0999 [0,0,0,1,0,0|1,0,2]=4 24 B9R1.11 COC(=O)C1CCCN1 CS-W004744 [0,0,0,1,0,0|2,0,0]=3 25 B9R1.11 COC(=O)[C@@H]1CCCN1 CS-M0706 [0,0,0,1,0,0|2,0,0]=3 26 B9R1.11 [C@H]1(C(=O)OC)CCCN1 CS-W010818 [0,0,0,1,0,0|2,0,0]=3 27 B9R1.50 O=C1CCCCCCN1 CS-W022575 [0,0,0,1,0,0|1,0,0]=2 28 B9R1.89 OC[C@@H]1CCCCCN1 CS-B0632 [0,0,0,1,0,0|2,0,1]=4 29 B9R1.118 NCC1(N)CCCCC1 CS-0064736 [0,0,0,1,0,0|2,0,1]=4 30 B6R0.6 BrCCCCCBr CS-W019956 [2,0,0,0,0,0|2,0,0]=4 31 B6R0.6 C=CCCCCO CS-W013711 [2,0,0,0,0,0|1,0,1]=4 32 B6R0.6 OCCCCCO CS-W020635 [2,0,0,0,0,0|2,0,0]=4 33 B6R0.1 CCCC(Cl)CC CS-0102884 [2,0,0,0,0,0|1,0,1]=4 34 B6R0.1 CCOC(=O)CO CS-W019892 [2,0,0,0,0,0|2,0,0]=4 35 B6R0.1 COC(=O)CCBr CS-W008728 [2,0,0,0,0,0|2,0,0]=4 36 B6R0.4 CC(=O)NCCN CS-W013694 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.4 CC(=O)NCCO CS-W013689 [2,0,0,0,0,0|2,0,0]=4 38 B6R0.4 CCOCC(=O)O CS-0071579 [2,0,0,0,0,0|2,0,0]=4 39 B6R0.4 O=C(O)CCCBr CS-W016047 [2,0,0,0,0,0|2,0,0]=4 40 B8R0.1 CCCC[C@H](N)CCO CS-0063111 [1,1,0,0,0,0|1,0,1]=4 41 B8R0.4 BrCCCCCCCBr CS-W010166 [1,1,0,0,0,0|1,0,1]=4 42 B8R0.4 CCOCCOCCO CS-0015134 [1,1,0,0,0,0|2,0,0]=4 43 B8R0.4 OCCCCCCCBr CS-W008425 [1,1,0,0,0,0|1,0,1]=4 44 B8R0.7 CC(C)NCCCCO CS-M3069 [1,1,0,0,0,0|2,0,0]=4 45 B8R0.3 CCC[C@@H](N)C(=O)OC CS-M2701 [1,1,0,0,0,0|1,0,0]=3 46 B8R0.3 CCOC(=O)C(=O)CC CS-W005382 [1,1,0,0,0,0|1,0,1]=4 47 B8R0.19 CCC(=O)CC(=O)CC CS-W013466 [1,1,0,0,0,0|0,0,1]=3 48 B8R0.21 CCCCOS(C)(=O)=O CS-W018582 [1,1,0,0,0,0|2,0,0]=4 49 B10R0.3 CCOC(=O)CCCC(C)=O CS-W010896 [0,2,0,0,0,0|0,0,1]=3 50 B10R0.1 CCOC(=O)CCCCCO CS-W023138 [0,2,0,0,0,0|0,0,0]=2 51 B10R0.2 CCOC(=O)C[C@H](O)CC#N CS-W002591 [0,2,0,0,0,0|1,0,1]=4 52 B10R0.19 CCOC(=O)[C@@H](N)CCCN CS-0101217 [0,2,0,0,0,0|1,0,0]=3 53 B10R0.26 CCOC(=O)CC(=O)C(C)C CS-W016205 [0,2,0,0,0,0|1,0,1]=4 54 B10R0.55 COC(=O)CCCCC(=O)O CS-W017938 [0,2,0,0,0,0|1,0,1]=4 55 B8R1.2 COC1CCNCC1 CS-0040128 [1,0,0,1,0,0|2,0,0]=4 56 B8R1.2 COC1CCNCC1 CS-W005038 [1,0,0,1,0,0|2,0,0]=4 57 B8R1.2 NCC1CCCCC1 CS-0015361 [1,0,0,1,0,0|1,0,1]=4 58 B8R1.2 NCC1CCOCC1 CS-W008973 [1,0,0,1,0,0|2,0,0]=4 59 B8R1.2 OCC1CCCCC1 CS-W011242 [1,0,0,1,0,0|1,0,1]=4 60 B8R1.2 OCC1CCOCC1 CS-D1227 [1,0,0,1,0,0|2,0,0]=4 61 B8R1.1 NC[C@H]1CCC(=O)N1 CS-0105178 [1,0,0,1,0,0|2,0,0]=4 62 B8R1.1 O=C1CCC(CBr)O1 CS-M2142 [1,0,0,1,0,0|2,0,0]=4 63 B8R1.1 O=C1CC[C@@H](CO)N1 CS-B0366 [1,0,0,1,0,0|2,0,0]=4 64 B8R1.3 CC1CCC(O)CC1 CS-0059254 [1,0,0,1,0,0|0,0,2]=4 65 B8R1.3 CN1CCC(=O)CC1 CS-W009198 [1,0,0,1,0,0|1,0,0]=3 66 B8R1.3 O=C1CC[C@@H](O)CN1 CS-D0041 [1,0,0,1,0,0|2,0,0]=4 67 B8R1.3 O=C1CC[C@H](O)CN1 CS-D0042 [1,0,0,1,0,0|2,0,0]=4 68 B8R1.50 CC1C(=O)CCC1=O CS-W013660 [1,0,0,1,0,0|1,0,1]=4 69 B8R1.7 O=C(O)C1CCCN1 CS-W013624 [1,0,0,1,0,0|2,0,0]=4 70 B8R1.7 O=C(O)C1CCCO1 CS-W018496 [1,0,0,1,0,0|2,0,0]=4 71 B8R1.7 O=C(O)C1CCNC1 CS-W019683 [1,0,0,1,0,0|2,0,0]=4 72 B8R1.34 O=C(O)CC1CCC1 CS-D0460 [1,0,0,1,0,0|1,0,0]=3 73 B8R1.72 CC1(N)CCCCC1 CS-0037804 [1,0,0,1,0,0|1,0,1]=4 74 B8R1.72 CC1(O)CCCCC1 CS-W013634 [1,0,0,1,0,0|0,0,2]=4 75 B10R1.13 CC(=O)N1CCC(=O)CC1 CS-W018303 [0,1,0,1,0,0|1,0,1]=4 76 B10R1.13 CC(C)C1CCC(=O)CC1 CS-W011030 [0,1,0,1,0,0|0,0,0]=2 77 B10R1.13 NC(=O)C1CCC(=O)CC1 CS-W022230 [0,1,0,1,0,0|1,0,1]=4 78 B10R1.14 COC(=O)C1CCC(N)C1 CS-W006920 [0,1,0,1,0,0|1,0,0]=3 79 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 CS-M0623 [0,1,0,1,0,0|2,0,0]=4 80 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 CS-W017145 [0,1,0,1,0,0|2,0,0]=4 81 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 CS-M0680 [0,1,0,1,0,0|2,0,0]=4 82 B10R1.14 [C@@H]1(O)CN[C@@H](C(=O)OC)C1 CS-W006629 [0,1,0,1,0,0|2,0,0]=4 83 B10R1.11 CCOC(=O)[C@@H]1CSCN1 CS-0043107 [0,1,0,1,0,0|2,0,0]=4 84 B10R1.11 CCOC(=O)[C@H]1CCCN1 CS-0080165 [0,1,0,1,0,0|1,0,0]=3 85 B10R1.29 CCCCN1CCCC1=O CS-W016436 [0,1,0,1,0,0|1,0,0]=3 86 B10R1.78 O=C1CCCCCCCN1 CS-0090258 [0,1,0,1,0,0|0,0,0]=2 87 B10R1.85 OCCN1CCCCCC1 CS-B0251 [0,1,0,1,0,0|2,0,0]=4 88 B10R1.135 CCOC(=O)C1CC1C#N CS-0049506 [0,1,0,1,0,0|1,0,1]=4 89 B10R1.137 CCOC(=O)CC1CCC1 CS-D0101 [0,1,0,1,0,0|0,0,0]=2 90 B10R1.138 CCCC(=O)OC[C@H]1CO1 CS-D1790 [0,1,0,1,0,0|2,0,0]=4 91 B10R1.15 COC(=O)C1CCCCC1 CS-W007704 [0,1,0,1,0,0|1,0,0]=3 92 B10R1.15 COC(=O)C1CCCCN1 CS-0043132 [0,1,0,1,0,0|1,0,0]=3 93 B10R1.15 COC(=O)C1CCCNC1 CS-0042814 [0,1,0,1,0,0|1,0,0]=3 94 B10R1.15 COC(=O)C1CCNCC1 CS-W016419 [0,1,0,1,0,0|1,0,0]=3 95 B10R1.15 COC(=O)C1CNCCN1 CS-0094441 [0,1,0,1,0,0|2,0,0]=4 96 B10R1.15 COC(=O)C1COCCN1 CS-D1697 [0,1,0,1,0,0|2,0,0]=4 97 B10R1.15 COC(=O)[C@@H]1CCCNC1 CS-0040391 [0,1,0,1,0,0|1,0,0]=3 98 B10R1.15 COC(=O)[C@H]1CCCCN1 CS-D1721 [0,1,0,1,0,0|1,0,0]=3 99 B10R1.15 COC(=O)[C@H]1COCCN1 CS-0109445 [0,1,0,1,0,0|2,0,0]=4 100 B10R1.15 O=C(CBr)C1CCOCC1 CS-0045281 [0,1,0,1,0,0|1,0,0]=3 101 B10R1.15 O=C(CCl)N1CCOCC1 CS-W021985 [0,1,0,1,0,0|2,0,0]=4 102 B10R1.15 [C@@H]1(C(=O)OC)COCCN1 CS-0044006 [0,1,0,1,0,0|2,0,0]=4 103 B10R1.411 COC(=O)C1(N)CCCC1 CS-B0437 [0,1,0,1,0,0|1,0,0]=3 104 B10R1.27 O=C(CCl)NC1CCCC1 CS-B1572 [0,1,0,1,0,0|1,0,0]=3