0 B6R0.6 CCCCCCC F1908-0180 [0,0,0,0,0,0|1,0,2]=3 1 B6R0.6 CCCCN=C=S F1915-0013 [0,0,0,0,0,0|1,1,2]=4 2 B6R0.6 CCNCCNC F2147-1525 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.6 CC\C=C\CCO F0001-2233 [0,0,0,0,0,0|0,0,2]=2 4 B6R0.6 OCCCCCO F0001-0238 [0,0,0,0,0,0|1,0,2]=3 5 B5R0.2 CCCCC#N F0001-0220 [1,0,0,0,0,0|1,0,2]=4 6 B5R0.2 CCCCC=O F2190-0583 [1,0,0,0,0,0|0,0,2]=3 7 B5R0.2 CCCCCO F0001-1831 [1,0,0,0,0,0|0,0,1]=2 8 B5R0.2 CCCCNN F2169-0384 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.2 CCOCCCl F0001-1693 [1,0,0,0,0,0|2,0,1]=4 10 B5R0.2 CCSCCN F2147-1017 [1,0,0,0,0,0|2,0,1]=4 11 B5R0.2 CNCCOC F0001-1089 [1,0,0,0,0,0|2,0,1]=4 12 B5R0.2 ICCCCI F0001-1692 [1,0,0,0,0,0|2,0,1]=4 13 B7R0.1 CCCCCCCC F0001-0244 [0,1,0,0,0,0|1,0,2]=4 14 B7R0.1 CCCCCCCN F9995-1631 [0,1,0,0,0,0|1,0,2]=4 15 B7R0.1 CCCCCCCO F0001-0245 [0,1,0,0,0,0|0,0,2]=3 16 B7R0.1 CCNCCNCC F8889-7850 [0,1,0,0,0,0|2,0,1]=4 17 B7R0.1 ClCCCCCCBr F0001-1706 [0,1,0,0,0,0|1,0,2]=4 18 B7R0.1 ICCCCCCI F0001-1700 [0,1,0,0,0,0|1,0,2]=4 19 B7R0.1 OCCCCCCO F0001-1701 [0,1,0,0,0,0|0,0,2]=3 20 B7R0.4 CCCCCB(O)O F0001-1263 [0,1,0,0,0,0|1,0,2]=4 21 B7R0.4 CCCCCC(C)N F0001-0370 [0,1,0,0,0,0|1,0,2]=4 22 B7R0.7 CCCC(=O)OCC F0001-0107 [0,1,0,0,0,0|2,0,0]=3 23 B7R0.7 CCOC(=O)CCS F0001-1439 [0,1,0,0,0,0|1,1,1]=4 24 B7R1.1 N#CC1=CCCC1 F9995-1512 [0,0,0,1,0,0|1,0,1]=3 25 B7R1.1 OCC1=CSC=N1 F2173-0020 [0,0,0,1,0,0|2,0,1]=4 26 B7R1.3 IC1CCCCC1 F2190-0186 [0,0,0,1,0,0|1,0,2]=4 27 B7R1.24 C1CNCCOC1 F2148-0116 [0,0,0,1,0,0|1,0,1]=3 28 B4R0.2 CCCCCl F0001-0200 [2,0,0,0,0,0|1,0,0]=3 29 B4R0.2 CSCCN F2191-0292 [2,0,0,0,0,0|2,0,0]=4 30 B6R0.1 CCCC(=O)NN F3191-0132 [1,1,0,0,0,0|2,0,0]=4 31 B6R0.1 COC(C)CCO F0001-0848 [1,1,0,0,0,0|1,0,1]=4 32 B6R0.4 CCCCB(O)O F0001-1206 [1,1,0,0,0,0|1,0,1]=4 33 B6R0.4 CSCCC(C)=O F0001-0996 [1,1,0,0,0,0|1,0,1]=4 34 B8R0.6 CCCCOC(=O)CS F0001-0048 [0,2,0,0,0,0|0,1,1]=4 35 B6R1.1 C1=CCNCC1 F8889-0743 [1,0,0,1,0,0|1,0,0]=3 36 B6R1.1 C1CCOCC1 F0001-0499 [1,0,0,1,0,0|0,0,1]=3 37 B6R1.2 CC1=CC=NO1 F0001-2561 [1,0,0,1,0,0|1,0,1]=4 38 B6R1.2 CC1CCNC1 F8887-6193 [1,0,0,1,0,0|1,0,1]=4 39 B6R1.2 IC1CCCC1 F0001-0550 [1,0,0,1,0,0|1,0,1]=4 40 B6R1.3 CNCC1CC1 F2158-1936 [1,0,0,1,0,0|1,0,1]=4 41 B8R1.2 BrCC1CCCCO1 F1909-1580 [0,1,0,1,0,0|0,0,2]=4 42 B8R1.2 COC1CCCNC1 F2158-0941 [0,1,0,1,0,0|1,0,1]=4 43 B8R1.2 ON=C1CCCCC1 F1723-0300 [0,1,0,1,0,0|1,0,1]=4 44 B8R1.5 CC1CCCNC1=O F1913-7611 [0,1,0,1,0,0|2,0,0]=4 45 B8R1.8 CCCN1C=CC=N1 F2169-1036 [0,1,0,1,0,0|1,0,1]=4 46 B8R1.11 CCC1CCCC1=O F8889-4518 [0,1,0,1,0,0|1,0,1]=4 47 B8R1.11 CN1CCCC1CO F8889-8364 [0,1,0,1,0,0|0,0,2]=4 48 B8R1.22 O=C1CCOCCN1 F8881-7824 [0,1,0,1,0,0|1,0,1]=4 49 B8R1.4 NC1CCCC(O)C1 F2147-2237 [0,1,0,1,0,0|0,0,2]=4 50 B8R1.72 CC1(C)CNCCO1 F2148-0112 [0,1,0,1,0,0|1,0,1]=4 51 B8R2.34 C1=CC2CC1CN2 F2167-7157 [0,0,0,2,0,0|2,0,0]=4 52 B8R2.25 C1CC2OC2CO1 F8889-2237 [0,0,0,2,0,0|1,0,1]=4