0 B10R0.74 C=CC(=O)OCCCCCC CS-0167366 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.74 CCCCCC#CC(=O)OC CS-W014292 [0,0,0,0,0,0|0,0,0]=0 2 B10R0.74 CCCCCCCC(=O)NN CS-W002067 [0,0,0,0,0,0|2,0,2]=4 3 B10R0.74 CCCCCCCC(=O)NO CS-W001857 [0,0,0,0,0,0|2,0,2]=4 4 B10R0.74 CCCCCCCC(=O)OC CS-0128781 [0,0,0,0,0,0|0,0,2]=2 5 B10R0.74 CCCCCCCC(=O)O[Na] CS-W016055 [0,0,0,0,0,0|1,0,2]=3 6 B10R0.74 CCCCC\C=C\C(=O)OC CS-0097187 [0,0,0,0,0,0|0,0,2]=2 7 B10R0.74 COC(=O)CCCCCCBr CS-W004688 [0,0,0,0,0,0|1,0,2]=3 8 B10R0.74 COC(=O)CCCCCCN CS-W004807 [0,0,0,0,0,0|1,0,2]=3 9 B10R0.74 COC(=O)CCCCCCO CS-0059718 [0,0,0,0,0,0|1,0,2]=3 10 B9R0.2 CC(=O)OCCCCCBr CS-0006787 [1,0,0,0,0,0|2,0,1]=4 11 B9R0.2 CCCCCC#CC(=O)O CS-0297443 [1,0,0,0,0,0|0,0,0]=1 12 B9R0.2 CCCCCCCC(=O)O CS-0016549 [1,0,0,0,0,0|0,0,2]=3 13 B9R0.2 CCCCCCCC(C)=O CS-0015991 [1,0,0,0,0,0|0,0,2]=3 14 B9R0.2 CCCCC\C=C\C(=O)O CS-0098436 [1,0,0,0,0,0|0,0,2]=3 15 B9R0.2 NCCCCCCC(=O)O CS-W002042 [1,0,0,0,0,0|1,0,2]=4 16 B9R0.2 O=C(O)CCCCCCBr CS-W007714 [1,0,0,0,0,0|1,0,2]=4 17 B9R0.2 O=C(O)CCCCCCO CS-W022546 [1,0,0,0,0,0|1,0,2]=4 18 B9R0.46 CCCCCCC(=O)CC CS-0330265 [1,0,0,0,0,0|1,0,1]=3 19 B9R0.46 CCCCCCC(=O)NN CS-0215224 [1,0,0,0,0,0|2,0,1]=4 20 B9R0.46 CCCCCCC(=O)OC CS-0182587 [1,0,0,0,0,0|0,0,1]=2 21 B9R0.46 CCCCCCC(=O)O[Na] CS-0182616 [1,0,0,0,0,0|1,0,1]=3 22 B9R0.46 COC(=O)CCCCCBr CS-W015176 [1,0,0,0,0,0|1,0,1]=3 23 B9R0.46 COC(=O)CCCCCN CS-W008066 [1,0,0,0,0,0|1,0,1]=3 24 B9R0.46 COC(=O)CCCCCO CS-0187523 [1,0,0,0,0,0|1,0,1]=3 25 B11R0.4 CCCCCCCC(=O)OCC CS-W016021 [0,1,0,0,0,0|0,0,2]=3 26 B11R0.4 CCOC(=O)CCCCCCBr CS-W008245 [0,1,0,0,0,0|1,0,2]=4 27 B11R0.4 CCOC(=O)CCCCCCN CS-0028472 [0,1,0,0,0,0|1,0,2]=4 28 B11R0.40 CCCCCCCCC(=O)O[Na] CS-0185612 [0,1,0,0,0,0|1,0,2]=4 29 B11R0.40 CCCCCC\C=C\C(=O)OC CS-0152302 [0,1,0,0,0,0|0,0,2]=3 30 B11R0.40 COC(=O)CCCCCCCBr CS-0129057 [0,1,0,0,0,0|0,0,2]=3 31 B11R0.40 COC(=O)CCCCCCCN CS-0129029 [0,1,0,0,0,0|0,0,2]=3 32 B11R1.25 COC(=O)CNC1CCCC1 CS-W003871 [0,0,0,1,0,0|1,0,1]=3 33 B11R1.27 CCCCCC1CCC(=O)O1 CS-W017997 [0,0,0,1,0,0|2,0,1]=4 34 B11R1.40 COC(=O)CC1CCCCC1 CS-W017998 [0,0,0,1,0,0|0,0,2]=3 35 B11R1.40 COC(=O)CC1CCCNC1 CS-W003705 [0,0,0,1,0,0|1,0,2]=4 36 B11R1.40 COC(=O)CC1CCNCC1 CS-W001893 [0,0,0,1,0,0|1,0,2]=4 37 B11R1.40 COC(=O)CC1CCOCC1 CS-W001903 [0,0,0,1,0,0|1,0,2]=4 38 B11R1.40 COC(=O)CN1CCNCC1 CS-0150680 [0,0,0,1,0,0|2,0,1]=4 39 B11R1.40 COC(=O)NC1CCNCC1 CS-0628490 [0,0,0,1,0,0|2,0,1]=4 40 B11R1.222 COC(=O)C1CCCCN1C CS-0375594 [0,0,0,1,0,0|1,0,2]=4 41 B11R1.222 COC(=O)C1CCNCC1C CS-0049072 [0,0,0,1,0,0|1,0,2]=4 42 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1O CS-0163392 [0,0,0,1,0,0|1,0,2]=4 43 B8R0.4 CCCCCCCC=O CS-0138976 [2,0,0,0,0,0|0,0,2]=4 44 B8R0.4 CCCCC\C=C\C=O CS-0200283 [2,0,0,0,0,0|0,0,2]=4 45 B8R0.7 CC(=O)NCCCCN CS-0453679 [2,0,0,0,0,0|2,0,0]=4 46 B8R0.7 CC(=O)OCCCCCl CS-W010967 [2,0,0,0,0,0|2,0,0]=4 47 B8R0.7 CCCCCCC(C)=O CS-W011125 [2,0,0,0,0,0|0,0,1]=3 48 B8R0.7 CCCCOCC(=O)O CS-0152080 [2,0,0,0,0,0|1,0,1]=4 49 B8R0.7 NCCCCCC(=O)O CS-2204 [2,0,0,0,0,0|1,0,1]=4 50 B8R0.7 O=C(O)CCCCCBr CS-W007559 [2,0,0,0,0,0|1,0,1]=4 51 B8R0.7 O=C(O)CCCCCCl CS-W018132 [2,0,0,0,0,0|1,0,1]=4 52 B8R0.7 O=C(O)CCCCCO CS-0158392 [2,0,0,0,0,0|1,0,1]=4 53 B8R0.7 O=C(O)CCCCC[O-] CS-0160664 [2,0,0,0,0,0|1,0,1]=4 54 B8R0.6 C#CCCCC(=O)OC CS-0127624 [2,0,0,0,0,0|0,0,2]=4 55 B8R0.6 C=CC(=O)CCCCC CS-0168504 [2,0,0,0,0,0|1,0,1]=4 56 B8R0.6 C=CCCCC(=O)OC CS-0015919 [2,0,0,0,0,0|0,0,2]=4 57 B8R0.6 CCCCCC(=O)NN CS-0152328 [2,0,0,0,0,0|2,0,0]=4 58 B8R0.6 CCC\C=C\C(=O)OC CS-W013465 [2,0,0,0,0,0|0,0,2]=4 59 B8R0.6 CNCCCC(=O)OC CS-0112438 [2,0,0,0,0,0|1,0,0]=3 60 B8R0.6 COC(=O)CCCC#N CS-0216788 [2,0,0,0,0,0|1,0,1]=4 61 B8R0.6 COC(=O)CCCCBr CS-W022866 [2,0,0,0,0,0|1,0,0]=3 62 B8R0.6 COC(=O)CCCCCl CS-0098043 [2,0,0,0,0,0|1,0,0]=3 63 B8R0.6 COC(=O)CCCCN CS-0018002 [2,0,0,0,0,0|1,0,0]=3 64 B8R0.6 COC(=O)CCCCO CS-0021769 [2,0,0,0,0,0|1,0,0]=3 65 B8R0.6 COC(=O)COCCCl CS-0209481 [2,0,0,0,0,0|2,0,0]=4 66 B8R0.6 COCCCC(=O)OC CS-W011093 [2,0,0,0,0,0|1,0,0]=3 67 B8R0.6 O=C(CCCCO)O[Na] CS-0047732 [2,0,0,0,0,0|2,0,0]=4 68 B10R0.4 CC(=O)SCCCCCCN CS-0437379 [1,1,0,0,0,0|1,0,1]=4 69 B10R0.4 CCCCCCCCC(=O)O CS-0076036 [1,1,0,0,0,0|0,0,2]=4 70 B10R0.4 CCCCOCCOC(C)=O CS-0198135 [1,1,0,0,0,0|1,0,1]=4 71 B10R0.4 NCCCCCCCC(=O)O CS-0661652 [1,1,0,0,0,0|0,0,2]=4 72 B10R0.4 NCCCCCCCC(=O)O CS-W019464 [1,1,0,0,0,0|0,0,2]=4 73 B10R0.4 O=C(O)CCCCCCCBr CS-W007700 [1,1,0,0,0,0|0,0,2]=4 74 B10R0.4 O=C(O)CCCCCCCO CS-0187285 [1,1,0,0,0,0|0,0,2]=4 75 B10R0.75 CCCCCCC(N)C(=O)O CS-W016177 [1,1,0,0,0,0|0,0,2]=4 76 B10R0.75 CCCCCCC(O)C(=O)O CS-W016160 [1,1,0,0,0,0|0,0,2]=4 77 B10R0.75 CCCCCC[C@@H](N)C(=O)O CS-0152326 [1,1,0,0,0,0|0,0,2]=4 78 B10R0.75 [C@H](N)(CCCCCC)C(=O)O CS-W006364 [1,1,0,0,0,0|0,0,2]=4 79 B10R0.78 CCCCC(C)CCC(=O)O CS-W010894 [1,1,0,0,0,0|0,0,2]=4 80 B10R0.18 CCCCC(=O)CC(=O)OC CS-0152392 [1,1,0,0,0,0|0,0,2]=4 81 B10R0.83 CCCCC[C@H](N)C(=O)NC CS-0310534 [1,1,0,0,0,0|1,0,1]=4 82 B10R0.83 COC(=O)C(N)CCCCN CS-0201761 [1,1,0,0,0,0|1,0,1]=4 83 B10R0.83 COC(=O)[C@H](N)CCCCN CS-W016710 [1,1,0,0,0,0|1,0,1]=4 84 B10R0.83 [C@H](N)(CCCCN)C(=O)OC CS-W010347 [1,1,0,0,0,0|1,0,1]=4 85 B12R0.1 CCCCCCCCC(=O)OCC CS-0107002 [0,2,0,0,0,0|0,0,2]=4 86 B12R0.1 CCOC(=O)CCCCCCCBr CS-D1735 [0,2,0,0,0,0|0,0,2]=4 87 B12R0.206 CCCCCCCC(=O)OCCC CS-0185761 [0,2,0,0,0,0|0,0,2]=4 88 B12R0.248 C=CCCCCCCCC(=O)OC CS-0197689 [0,2,0,0,0,0|0,0,2]=4 89 B12R0.248 CCCCCCCCCC(=O)OC CS-W016888 [0,2,0,0,0,0|0,0,2]=4 90 B12R0.248 COC(=O)CCCCCCCCBr CS-0129031 [0,2,0,0,0,0|0,0,2]=4 91 B12R0.248 COC(=O)CCCCCCCCO CS-W016785 [0,2,0,0,0,0|0,0,2]=4 92 B10R1.10 CCCC1CCCC(=O)O1 CS-W018288 [1,0,0,1,0,0|0,0,2]=4 93 B10R1.16 CCCCC1CCC(=O)O1 CS-W018278 [1,0,0,1,0,0|0,0,2]=4 94 B10R1.18 CC(=O)CC1CCCCC1 CS-0155063 [1,0,0,1,0,0|0,0,2]=4 95 B10R1.18 O=C(O)C=C1CCCCC1 CS-0196826 [1,0,0,1,0,0|0,0,2]=4 96 B10R1.18 O=C(O)CC1CCCCC1 CS-W019439 [1,0,0,1,0,0|0,0,2]=4 97 B10R1.18 O=C(O)CN1CCCCC1 CS-0067848 [1,0,0,1,0,0|1,0,1]=4 98 B10R1.61 CC1CCCCC1C(=O)O CS-W018286 [1,0,0,1,0,0|0,0,2]=4 99 B10R1.66 O=C(O)CCC1CCCC1 CS-W018280 [1,0,0,1,0,0|0,0,2]=4 100 B10R1.78 O=C1CCCCCCCN1 CS-0090258 [1,0,0,1,0,0|1,0,1]=4 101 B10R1.348 O=C(O)C1CCCCCC1 CS-W007921 [1,0,0,1,0,0|0,0,2]=4 102 B10R1.348 O=C(O)C1CCCCCN1 CS-0054144 [1,0,0,1,0,0|1,0,1]=4 103 B10R1.1 CCCC1CCC(=O)CC1 CS-W002273 [1,0,0,1,0,0|1,0,1]=4 104 B10R1.15 CCC(=O)C1CCCCC1 CS-0069673 [1,0,0,1,0,0|1,0,1]=4 105 B10R1.15 COC(=O)C1=CCCCC1 CS-W009174 [1,0,0,1,0,0|0,0,2]=4 106 B10R1.15 COC(=O)C1CCCCN1 CS-0043132 [1,0,0,1,0,0|1,0,1]=4 107 B10R1.15 COC(=O)C1CCCCN1 CS-W003366 [1,0,0,1,0,0|1,0,1]=4 108 B10R1.15 COC(=O)C1CCCCO1 CS-W001905 [1,0,0,1,0,0|1,0,1]=4 109 B10R1.15 COC(=O)C1CCCNC1 CS-0042814 [1,0,0,1,0,0|1,0,1]=4 110 B10R1.15 COC(=O)C1CCCNC1 CS-W005063 [1,0,0,1,0,0|1,0,1]=4 111 B10R1.15 COC(=O)C1CCCOC1 CS-W001863 [1,0,0,1,0,0|1,0,1]=4 112 B10R1.15 COC(=O)C1CCNCC1 CS-W002947 [1,0,0,1,0,0|1,0,1]=4 113 B10R1.15 COC(=O)C1CCNCC1 CS-W016419 [1,0,0,1,0,0|1,0,1]=4 114 B10R1.15 COC(=O)C1CCOCC1 CS-D1156 [1,0,0,1,0,0|1,0,1]=4 115 B10R1.15 COC(=O)N1CCCCC1 CS-0200219 [1,0,0,1,0,0|1,0,0]=3 116 B10R1.15 COC(=O)N1CCNCC1 CS-0069574 [1,0,0,1,0,0|2,0,0]=4 117 B10R1.15 COC(=O)[C@@H]1CCCCN1 CS-W001485 [1,0,0,1,0,0|1,0,1]=4 118 B10R1.15 COC(=O)[C@@H]1CCCNC1 CS-0040391 [1,0,0,1,0,0|1,0,1]=4 119 B10R1.15 COC(=O)[C@@H]1CCCNC1 CS-M0789 [1,0,0,1,0,0|1,0,1]=4 120 B10R1.15 COC(=O)[C@H]1CCCCN1 CS-D1721 [1,0,0,1,0,0|1,0,1]=4 121 B10R1.15 COC(=O)[C@H]1CCCNC1 CS-M2670 [1,0,0,1,0,0|1,0,1]=4 122 B10R1.27 COC(=O)CC1CCOC1 CS-0104771 [1,0,0,1,0,0|1,0,1]=4 123 B10R1.27 COC(=O)C[C@@H]1CCCN1 CS-W021179 [1,0,0,1,0,0|1,0,1]=4 124 B10R1.27 COC(=O)C[C@@H]1CCNC1 CS-0187829 [1,0,0,1,0,0|1,0,1]=4 125 B10R1.27 COC(=O)C[C@H]1CCNC1 CS-0187993 [1,0,0,1,0,0|1,0,1]=4 126 B10R1.149 COC(=O)[C@@H]1CCCN1C CS-0450221 [1,0,0,1,0,0|1,0,1]=4 127 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N CS-0375992 [1,0,0,1,0,0|1,0,1]=4 128 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C CS-0645794 [1,0,0,1,0,0|1,0,1]=4 129 B12R1.32 CCOC(=O)C=C1CCCCC1 CS-0151873 [0,1,0,1,0,0|0,0,2]=4 130 B12R1.32 CCOC(=O)CC1CCCCC1 CS-0108510 [0,1,0,1,0,0|0,0,2]=4 131 B12R1.27 COC(=O)COC1CCNCC1 CS-0341267 [0,1,0,1,0,0|1,0,1]=4 132 B12R1.365 COC(=O)C1CCCCCC1=O CS-0043401 [0,1,0,1,0,0|0,0,2]=4 133 B12R1.49 COC(=O)CN1CCC(N)CC1 CS-0127776 [0,1,0,1,0,0|1,0,1]=4 134 B12R1.50 COC(=O)CN1CCCC(N)C1 CS-0340378 [0,1,0,1,0,0|1,0,1]=4 135 B12R1.34 COC(=O)C(=O)C1CCCCC1 CS-0150927 [0,1,0,1,0,0|0,0,2]=4 136 B12R1.34 COC(=O)C(N)C1CCCCC1 CS-0301830 [0,1,0,1,0,0|0,0,2]=4 137 B12R1.34 COC(=O)[C@@H](N)C1CCCCC1 CS-M2292 [0,1,0,1,0,0|0,0,2]=4 138 B12R1.34 COC(=O)[C@H](N)C1CCCCC1 CS-B1505 [0,1,0,1,0,0|0,0,2]=4 139 B12R1.108 COC(=O)[C@H](N)CC1CCCC1 CS-0438918 [0,1,0,1,0,0|0,0,2]=4 140 B12R1.1731 COC(=O)C1(N)CCCCCC1 CS-0161817 [0,1,0,1,0,0|0,0,2]=4 141 B12R1.3524 COC(=O)CC1(N)CCCCC1 CS-0112565 [0,1,0,1,0,0|0,0,2]=4 142 B12R2.24 O=C1CCC2CCCCC2O1 CS-0063175 [0,0,0,2,0,0|0,0,2]=4