0 B6R1.2 CC1CCNC1 F8887-6193 [0,0,0,0,0,0|2,0,0]=2 1 B6R1.2 IC1CCCC1 F0001-0550 [0,0,0,0,0,0|1,0,0]=1 2 B6R1.2 O=C1NCCN1 F0001-0353 [0,0,0,0,0,0|2,1,1]=4 3 B7R1.1 COC1CCNC1 F8881-0669 [0,1,0,0,0,0|1,1,0]=3 4 B7R1.1 N#CC1=CCCC1 F9995-1512 [0,1,0,0,0,0|1,0,2]=4 5 B7R1.2 O=C1CCC(=O)C1 F0001-1098 [0,1,0,0,0,0|0,1,2]=4 6 B7R1.4 CC1CCCC1=O F9995-1299 [0,1,0,0,0,0|0,1,1]=3 7 B7R1.14 CC1(C)CCCN1 F1905-0628 [0,1,0,0,0,0|2,0,0]=3 8 B5R0.1 CC(C)CC#N F0001-1677 [0,0,1,0,0,0|2,0,1]=4 9 B5R0.1 COCC(C)N F2190-0371 [0,0,1,0,0,0|2,0,0]=3 10 B5R0.2 C#CCCCI F8885-4128 [0,0,1,0,0,0|1,0,2]=4 11 B5R0.2 CCCCC#N F0001-0220 [0,0,1,0,0,0|1,0,1]=3 12 B5R0.2 CCCCC=O F2190-0583 [0,0,1,0,0,0|0,1,1]=3 13 B5R0.2 CCCCCO F0001-1831 [0,0,1,0,0,0|0,1,0]=2 14 B5R0.2 CCCCNN F2169-0384 [0,0,1,0,0,0|2,0,0]=3 15 B5R0.2 CCOCCCl F0001-1693 [0,0,1,0,0,0|2,0,0]=3 16 B5R0.2 CCSCCN F2147-1017 [0,0,1,0,0,0|2,0,0]=3 17 B5R0.2 CNCCOC F0001-1089 [0,0,1,0,0,0|3,0,0]=4 18 B5R0.2 ICCCCI F0001-1692 [0,0,1,0,0,0|2,0,0]=3 19 B5R0.2 N#CCCCBr F0001-1378 [0,0,1,0,0,0|2,0,1]=4 20 B5R0.3 C#CC(O)CC F0001-1172 [0,0,1,0,0,0|0,1,2]=4 21 B5R0.3 NCC(O)CN F0001-1632 [0,0,1,0,0,0|2,1,0]=4 22 B5R0.3 OC(CCl)CCl F0001-2291 [0,0,1,0,0,0|2,1,0]=4 23 B7R2.13 C1NCC2CC12 F2197-0058 [0,0,0,1,0,0|2,0,0]=3 24 B5R1.2 FC1CNC1 F2148-2176 [0,0,0,0,1,0|2,0,0]=3 25 B5R1.2 O=C1CSC1 F2147-0949 [0,0,0,0,1,0|1,1,1]=4 26 B7R1.3 C=C1CCNCC1 F8888-3171 [0,0,0,0,0,1|1,0,1]=3 27 B7R1.3 IC1CCCCC1 F2190-0186 [0,0,0,0,0,1|1,0,0]=2 28 B7R1.3 NC1CCOCC1 F0001-1086 [0,0,0,0,0,1|1,0,0]=2 29 B7R1.3 O=C1COCCN1 F8889-4140 [0,0,0,0,0,1|1,1,1]=4 30 B4R0.2 CCCCCl F0001-0200 [1,0,1,0,0,0|1,0,0]=3 31 B4R0.2 CSCCN F2191-0292 [1,0,1,0,0,0|2,0,0]=4 32 B6R0.1 COC(C)CCO F0001-0848 [0,1,1,0,0,0|1,1,0]=4 33 B6R0.2 CC(C)OC(C)C F0001-0159 [0,1,1,0,0,0|2,0,0]=4 34 B6R0.2 CC(N)CN(C)C F8882-5478 [0,1,1,0,0,0|2,0,0]=4 35 B6R0.3 CC(C)C(N)CO F1564-0026 [0,1,1,0,0,0|2,0,0]=4 36 B6R0.4 CC(C)NCCN F2187-0287 [0,1,1,0,0,0|2,0,0]=4 37 B6R0.4 CNCCN(C)C F0001-0495 [0,1,1,0,0,0|2,0,0]=4 38 B6R0.4 CSCCC(C)=O F0001-0996 [0,1,1,0,0,0|0,1,1]=4 39 B6R0.5 CCNC(C)(C)C F8882-0031 [0,1,1,0,0,0|2,0,0]=4 40 B6R0.6 CCCCCCC F1908-0180 [0,1,1,0,0,0|1,0,0]=3 41 B6R0.6 CCCCN=C=S F1915-0013 [0,1,1,0,0,0|0,0,2]=4 42 B6R0.6 CCNCCNC F2147-1525 [0,1,1,0,0,0|2,0,0]=4 43 B6R0.6 CC\C=C\CCO F0001-2233 [0,1,1,0,0,0|0,1,1]=4 44 B6R0.6 OCCCCCO F0001-0238 [0,1,1,0,0,0|0,1,0]=3 45 B6R1.5 NC1CC(=O)C1 F2147-8243 [0,1,0,0,1,0|0,1,1]=4 46 B6R1.6 NNC1CCC1 F2135-1119 [0,1,0,0,1,0|1,0,0]=3 47 B8R1.2 BrCC1CCCCO1 F1909-1580 [0,1,0,0,0,1|1,0,0]=3 48 B8R1.2 COC1CCCNC1 F2158-0941 [0,1,0,0,0,1|0,1,0]=3 49 B8R1.2 COC1CCNCC1 F0001-1147 [0,1,0,0,0,1|0,1,0]=3 50 B8R1.2 COC1CCNCC1 F2158-0858 [0,1,0,0,0,1|0,1,0]=3 51 B8R1.2 CSC1=NCCCN1 F2147-0307 [0,1,0,0,0,1|1,0,1]=4 52 B8R1.2 FCC1CCCNC1 F2148-2174 [0,1,0,0,0,1|1,0,0]=3 53 B8R1.2 N#CC1CCNCC1 F2189-0074 [0,1,0,0,0,1|1,0,0]=3 54 B8R1.2 ON=C1CCCCC1 F1723-0300 [0,1,0,0,0,1|0,1,1]=4 55 B8R1.3 C[C@H]1CC[C@H](N)CC1 F0001-0986 [0,1,0,0,0,1|1,0,0]=3 56 B8R1.4 CC1CCCC(C)N1 F2190-0336 [0,1,0,0,0,1|1,0,0]=3 57 B8R1.4 NC1CCCC(O)C1 F2147-2237 [0,1,0,0,0,1|0,1,0]=3 58 B8R1.5 CC1CCCNC1=O F1913-7611 [0,1,0,0,0,1|0,1,1]=4 59 B8R1.72 CC1(C)CNCCO1 F2148-0112 [0,1,0,0,0,1|2,0,0]=4 60 B8R1.72 CC1(C)COCCN1 F2148-0109 [0,1,0,0,0,1|2,0,0]=4 61 B8R1.72 FC1(F)CCCNC1 F2148-2178 [0,1,0,0,0,1|1,0,0]=3 62 B8R1.72 FC1(F)CCNCC1 F2158-0926 [0,1,0,0,0,1|1,0,0]=3 63 B8R1.72 O=S1(=O)CCCCO1 F0001-0588 [0,1,0,0,0,1|1,1,0]=4 64 B8R1.1 CN1CCC(CO)C1 F2147-0775 [0,2,0,0,0,0|1,1,0]=4 65 B8R1.7 O=C(O)C1CCNC1 F0001-1559 [0,2,0,0,0,0|1,1,0]=4 66 B8R1.8 COCC1CCNC1 F1907-0846 [0,2,0,0,0,0|1,1,0]=4 67 B8R1.8 NCCN1CCCC1 F2187-2176 [0,2,0,0,0,0|2,0,0]=4 68 B8R1.11 CCC1CCCC1=O F8889-4518 [0,2,0,0,0,0|0,1,1]=4 69 B8R1.11 CN1CCCC1CO F8889-8364 [0,2,0,0,0,0|1,1,0]=4 70 B8R1.52 C#CC1(O)CCCC1 F8883-8235 [0,2,0,0,0,0|0,1,0]=3 71 B6R1.3 CNCC1CC1 F2158-1936 [0,0,1,1,0,0|2,0,0]=4 72 B6R1.1 C1CCOCC1 F0001-0499 [0,0,1,1,0,0|0,1,0]=3 73 B8R2.25 C1CC2OC2CO1 F8889-2237 [0,0,0,1,0,1|0,1,0]=3 74 B8R1.22 O=C1CCNCCN1 F2158-1556 [0,0,0,0,0,2|0,1,1]=4 75 B8R1.22 O=C1CCNCCN1 F8880-3444 [0,0,0,0,0,2|0,1,1]=4 76 B8R1.22 O=C1CCOCCN1 F8881-7824 [0,0,0,0,0,2|0,1,1]=4 77 B8R1.22 O=C1CCSCCN1 F2147-1376 [0,0,0,0,0,2|0,1,1]=4