0 B10R0.71 CCCCCCCCN=[N+]=[N-] F1901-3138 [0,0,0,0,0,0|3,0,0]=3 1 B9R0.45 CCCCCCCN=[N+]=[N-] F1901-3140 [1,0,0,0,0,0|3,0,0]=4 2 B11R0.3 CCCCCCCCCCCC F0001-0259 [0,1,0,0,0,0|1,0,1]=3 3 B11R1.5 CCCN1CCNCCC1=O F2167-7680 [0,0,0,1,0,0|2,0,0]=3 4 B11R1.17 CCOCC1CCCCN1N F1907-5300 [0,0,0,1,0,0|3,0,0]=4 5 B11R1.28 C=CCOCC1CCNCC1 F2145-0115 [0,0,0,1,0,0|3,0,0]=4 6 B11R1.28 CCCCCC1CCCCN1 F2167-1860 [0,0,0,1,0,0|1,0,1]=3 7 B11R1.28 CCCCCC1CCCNC1 F2167-1858 [0,0,0,1,0,0|2,0,0]=3 8 B11R1.28 CCCCCC1CCNCC1 F2167-1859 [0,0,0,1,0,0|2,0,1]=4 9 B11R1.28 CCNCCC1CCCCC1 F1911-1676 [0,0,0,1,0,0|2,0,1]=4 10 B11R1.28 CCSCCC1CCCCN1 F2167-0621 [0,0,0,1,0,0|2,0,1]=4 11 B11R1.28 CNCCCC1CCCOC1 F2147-8429 [0,0,0,1,0,0|3,0,0]=4 12 B11R1.28 CNCCCC1CCOCC1 F2147-8423 [0,0,0,1,0,0|3,0,0]=4 13 B11R1.28 N#CCCCC1CCCCN1 F2167-7186 [0,0,0,1,0,0|2,0,1]=4 14 B11R1.28 N#CCCCC1CCCNC1 F2167-7187 [0,0,0,1,0,0|2,0,1]=4 15 B11R1.28 N#CCCCC1CCNCC1 F2167-7188 [0,0,0,1,0,0|2,0,1]=4 16 B11R1.190 CCCCCNC1CCC1F F1910-8124 [0,0,0,1,0,0|2,0,1]=4 17 B11R1.190 CCCCCN[C@@H]1CC[C@H]1O F6619-0455 [0,0,0,1,0,0|1,0,2]=4 18 B11R1.203 C#CCNC1CCCCCC1 F8882-0127 [0,0,0,1,0,0|2,0,1]=4 19 B11R1.203 COCCC1CCCNCC1 F2167-8075 [0,0,0,1,0,0|3,0,0]=4 20 B11R1.203 N#CCCC1CCCNCC1 F2167-7191 [0,0,0,1,0,0|2,0,1]=4 21 B12R0.251 CCCCCCCCC(Br)C(=O)Cl F2167-4982 [0,2,0,0,0,0|0,0,0]=2 22 B10R1.4 C#CCC1CCCCC1=O F8882-5657 [1,0,0,1,0,0|0,0,2]=4 23 B10R1.4 CCCC1CNCCC1O F1907-6846 [1,0,0,1,0,0|1,0,1]=4 24 B10R1.4 O=C1CCCCN1CCCl F1905-0054 [1,0,0,1,0,0|2,0,0]=4 25 B10R1.17 BrCCCC1CCCOC1 F2147-8427 [1,0,0,1,0,0|2,0,0]=4 26 B10R1.17 BrCCCC1CCOCC1 F8888-2251 [1,0,0,1,0,0|2,0,0]=4 27 B10R1.17 CCCCC1CCCCN1 F2167-1857 [1,0,0,1,0,0|1,0,0]=3 28 B10R1.17 CCCCC1CCCCN1 F8886-3808 [1,0,0,1,0,0|1,0,0]=3 29 B10R1.17 CCCCC1CCCNC1 F2167-1856 [1,0,0,1,0,0|1,0,1]=4 30 B10R1.17 CCCCC1CCCNC1 F8882-8889 [1,0,0,1,0,0|1,0,1]=4 31 B10R1.17 CCCCC1CCNCC1 F8882-8892 [1,0,0,1,0,0|1,0,1]=4 32 B10R1.17 CCNCC1CCCCN1 F1911-1645 [1,0,0,1,0,0|2,0,0]=4 33 B10R1.17 CCSCC1CCCCN1 F2167-0589 [1,0,0,1,0,0|2,0,0]=4 34 B10R1.17 CSCCC1CCCCN1 F2167-0620 [1,0,0,1,0,0|2,0,0]=4 35 B10R1.17 NCCCC1CCCOC1 F2147-8428 [1,0,0,1,0,0|2,0,0]=4 36 B10R1.17 NCCCC1CCOCC1 F2147-8422 [1,0,0,1,0,0|2,0,0]=4 37 B10R1.17 OCCCC1CCCNC1 F2147-8462 [1,0,0,1,0,0|1,0,1]=4 38 B10R1.17 OCCCC1CCCOC1 F2147-8426 [1,0,0,1,0,0|1,0,1]=4 39 B10R1.19 CCN1CCNCCC1=O F2167-7669 [1,0,0,1,0,0|2,0,0]=4 40 B10R1.37 CCCCNC1CCC1F F1910-8122 [1,0,0,1,0,0|2,0,0]=4 41 B10R1.37 CCCCN[C@@H]1CC[C@H]1O F6619-0450 [1,0,0,1,0,0|1,0,1]=4 42 B10R1.85 CCCC1CCCNCC1 F8889-6452 [1,0,0,1,0,0|1,0,1]=4 43 B12R1.8 CCCCCCC1CCCNC1 F2167-1850 [0,1,0,1,0,0|1,0,1]=4 44 B12R1.8 CCCCCCC1CCNCC1 F2167-1851 [0,1,0,1,0,0|1,0,1]=4 45 B12R1.267 O=C1CCCCC1CNCCBr F0861-0007 [0,1,0,1,0,0|1,0,0]=3 46 B12R1.329 C#CCNC1CCCCCCC1 F8882-0129 [0,1,0,1,0,0|1,0,1]=4 47 B12R1.383 CCCCCCNC1CCC1F F1910-8125 [0,1,0,1,0,0|1,0,1]=4 48 B12R1.383 CCCCCCN[C@@H]1CC[C@H]1O F6619-0464 [0,1,0,1,0,0|0,0,2]=4 49 B12R1.32 CNCC(F)CC1CCCCC1 F2147-5917 [0,1,0,1,0,0|2,0,0]=4 50 B12R1.32 NCCC(O)CC1CCCCC1 F2189-0756 [0,1,0,1,0,0|1,0,1]=4 51 B12R1.125 CC(=O)NCC1CCNCC1C F1907-2224 [0,1,0,1,0,0|2,0,0]=4 52 B12R1.125 NC(=O)CN[C@H]1CCCC[C@@H]1O F6545-4312 [0,1,0,1,0,0|2,0,0]=4 53 B12R1.125 O=C(O)CN[C@@H]1CCCC[C@H]1F F1910-7767 [0,1,0,1,0,0|2,0,0]=4 54 B12R1.130 O=C(O)CCN[C@@H]1CCC[C@H]1F F1910-7624 [0,1,0,1,0,0|2,0,0]=4 55 B12R1.210 CC(C)CN1CCNCCC1=O F2167-7691 [0,1,0,1,0,0|2,0,0]=4 56 B12R1.252 CC(C)CCCC1CCCNC1 F2167-1861 [0,1,0,1,0,0|2,0,0]=4 57 B12R1.252 O=C(O)CCCC1CCCNC1 F2167-8162 [0,1,0,1,0,0|1,0,0]=3 58 B12R1.1343 NC(=O)CNC1CCCCCC1 F8886-5037 [0,1,0,1,0,0|1,0,0]=3 59 B12R1.1343 O=C(O)CCC1CCCNCC1 F2167-8167 [0,1,0,1,0,0|1,0,0]=3 60 B12R2.7 O=C1CCCCC12CCNC2 F2147-4045 [0,0,0,2,0,0|1,0,0]=3 61 B12R2.7 O=C1NCCOC12CCCC2 F2147-5082 [0,0,0,2,0,0|2,0,0]=4 62 B12R2.10 O=C1OCCC1C2CCCC2 F1913-3223 [0,0,0,2,0,0|1,0,0]=3 63 B12R2.98 C1CCC(CC2CCNC2)C1 F8880-4631 [0,0,0,2,0,0|2,0,0]=4 64 B12R2.229 O=C1NCCCN2CCC[C@@H]12 F1913-7158 [0,0,0,2,0,0|2,0,0]=4 65 B12R2.2056 C1CCC(CCC2CNC2)C1 F2167-8091 [0,0,0,2,0,0|2,0,0]=4 66 B12R2.4328 C1CCC2(CCCC2)CNC1 F2148-0049 [0,0,0,2,0,0|2,0,0]=4 67 B12R2.24 O=C1CNC2CCCCC2N1 F8889-6754 [0,0,0,2,0,0|2,0,0]=4 68 B12R2.225 O=C1CCCCC1CC2CC2 F8884-4917 [0,0,0,2,0,0|0,0,0]=2 69 B12R2.225 OC1CCCCC1CC2CC2 F8884-6006 [0,0,0,2,0,0|0,0,2]=4 70 B12R2.8 O=C1CCCC12CCCCC2 F2167-7904 [0,0,0,2,0,0|0,0,0]=2 71 B12R2.8 O=C1CCCC12CCCNC2 F2147-4051 [0,0,0,2,0,0|1,0,0]=3 72 B12R2.8 O=C1CCCC12CCNCC2 F8888-1844 [0,0,0,2,0,0|1,0,0]=3 73 B12R2.2057 C1CCC(CCC2CC2)NC1 F8882-9458 [0,0,0,2,0,0|1,0,1]=4 74 B12R2.2057 C1CNCC(CCC2CC2)C1 F2167-8043 [0,0,0,2,0,0|2,0,0]=4 75 B12R2.2058 C1CC(CC2CCCNC2)C1 F2167-1844 [0,0,0,2,0,0|2,0,0]=4 76 B12R2.2058 C1CCC(CC2CCC2)NC1 F2167-1846 [0,0,0,2,0,0|1,0,1]=4 77 B12R2.2058 C1CCC(CC2CNC2)CC1 F8882-9423 [0,0,0,2,0,0|2,0,0]=4 78 B12R2.1114 O=C1CCCC1CC2CCC2 F8884-4912 [0,0,0,2,0,0|0,0,0]=2 79 B12R2.1114 O=C1CCCN1CC2CNC2 F2147-2514 [0,0,0,2,0,0|2,0,0]=4 80 B12R2.1114 OC1CCCC1CC2CCC2 F8884-4925 [0,0,0,2,0,0|0,0,2]=4