0 B6R0.1 CC(CN)CCN BB12-1906 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.1 CCC\C(N)=N\O BB10-0037 [0,0,0,0,0,0|2,0,2]=4 2 B6R0.1 CCNC(C)CO BB12-1659 [0,0,0,0,0,0|1,0,2]=3 3 B6R0.1 CC[C@H](N)COC BB20-3253 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 CNC(C)CCO BB12-1373 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.1 CCOC(C)=N BB12-3674 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.1 CNCC(C)=O BB12-3010 [1,0,0,0,0,0|1,0,1]=3 7 B5R0.1 CNCC(C)O BB12-1288 [1,0,0,0,0,0|1,0,1]=3 8 B5R0.2 CCSCCN BB53-1545 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.2 CSCCC#N BB12-3714 [1,0,0,0,0,0|2,0,1]=4 10 B5R0.2 [C-]#[N+]CCCC BB56-0718 [1,0,0,0,0,0|2,0,0]=3 11 B5R0.2 [C-]#[N+]CCOC BB56-1837 [1,0,0,0,0,0|3,0,0]=4 12 B5R0.3 CCC(C)NC BB53-1672 [1,0,0,0,0,0|2,0,0]=3 13 B5R0.3 CNC(C)CO BB12-1570 [1,0,0,0,0,0|1,0,2]=4 14 B5R0.3 [C-]#[N+]C(C)CC BB56-1204 [1,0,0,0,0,0|2,0,0]=3 15 B7R0.2 CC(C#N)CN(C)C BB12-1399 [0,1,0,0,0,0|2,0,1]=4 16 B7R0.2 CC(CO)CN(C)C BB12-3644 [0,1,0,0,0,0|1,0,2]=4 17 B7R0.2 C\C(C=O)=C\N(C)C BB12-3546 [0,1,0,0,0,0|1,0,2]=4 18 B7R0.3 CCCCC(N)CO BB56-2048 [0,1,0,0,0,0|1,0,2]=4 19 B7R0.3 CCN(C)CCCN BB12-1555 [0,1,0,0,0,0|2,0,1]=4 20 B7R0.3 CCN(C)CCCO BB12-3254 [0,1,0,0,0,0|2,0,1]=4 21 B7R0.3 CCO\C=C(\C)C=O BB12-3547 [0,1,0,0,0,0|0,0,2]=3 22 B7R0.3 CSCCC(N)CO BB56-2047 [0,1,0,0,0,0|1,0,2]=4 23 B7R0.5 CC(CCN)N(C)C BB12-1370 [0,1,0,0,0,0|3,0,0]=4 24 B7R0.5 CC(CCO)N(C)C BB12-3646 [0,1,0,0,0,0|3,0,0]=4 25 B7R0.5 CC(NC=O)C(=O)O BB12-1345 [0,1,0,0,0,0|2,0,1]=4 26 B7R0.5 CCSC(C)C(=O)O BB12-3261 [0,1,0,0,0,0|1,0,0]=2 27 B7R0.5 CNCC(C)C(=O)O BB12-1637 [0,1,0,0,0,0|1,0,0]=2 28 B7R0.7 CCNC(C)CCO BB12-1398 [0,1,0,0,0,0|1,0,2]=4 29 B7R0.11 COC(C)(C)CCN BB12-2310 [0,1,0,0,0,0|3,0,0]=4 30 B7R0.12 CCOC(CC)CBr BB12-3730 [0,1,0,0,0,0|2,0,1]=4 31 B7R1.1 CNC1CCCC1 BB53-1678 [0,0,0,1,0,0|2,0,0]=3 32 B7R1.3 NC1CCCOC1 BB12-2177 [0,0,0,1,0,0|1,0,2]=4 33 B7R1.4 NC1CCNC1=O BB12-2184 [0,0,0,1,0,0|2,0,0]=3 34 B7R1.6 CNCC1CCC1 BB12-1623 [0,0,0,1,0,0|2,0,1]=4 35 B4R0.2 CSCCCl BB53-1396 [2,0,0,0,0,0|2,0,0]=4 36 B4R0.2 CSCCN BB12-0970 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.2 CC(N)CC(=O)O BB12-2890 [1,1,0,0,0,0|1,0,1]=4 38 B6R0.4 CC(C)SCCCl BB53-1373 [1,1,0,0,0,0|1,0,1]=4 39 B6R0.4 CC(C)SCCN BB53-1544 [1,1,0,0,0,0|1,0,1]=4 40 B6R0.4 CC(C)SCCO BB53-1392 [1,1,0,0,0,0|1,0,1]=4 41 B6R0.4 CCNCC(C)O BB12-1676 [1,1,0,0,0,0|0,0,1]=3 42 B6R0.4 CCSCC(=O)O BB12-3264 [1,1,0,0,0,0|1,0,1]=4 43 B6R0.4 CNCCC(=O)O BB12-1452 [1,1,0,0,0,0|1,0,1]=4 44 B6R0.4 COCCC(=O)Cl BB20-1617 [1,1,0,0,0,0|1,0,1]=4 45 B6R0.5 COCC(C)(C)N BB53-1697 [1,1,0,0,0,0|1,0,1]=4 46 B6R0.5 CS(=O)(=O)CCN BB53-1620 [1,1,0,0,0,0|2,0,0]=4 47 B6R0.5 CS(=O)(=O)CCO BB53-1360 [1,1,0,0,0,0|2,0,0]=4 48 B6R0.6 C=CCCCC#N BB12-2224 [1,1,0,0,0,0|1,0,1]=4 49 B6R0.6 CCCSCCN BB53-1582 [1,1,0,0,0,0|1,0,1]=4 50 B6R0.6 CCSCCNC BB12-0971 [1,1,0,0,0,0|2,0,0]=4 51 B6R0.6 [C-]#[N+]CCCOC BB56-1464 [1,1,0,0,0,0|2,0,0]=4 52 B6R0.8 CCC(C)(N)CO BB56-2220 [1,1,0,0,0,0|0,0,2]=4 53 B6R0.9 CCC(C#N)NC BB12-1702 [1,1,0,0,0,0|1,0,1]=4 54 B8R0.5 CCCC(N)CC(=O)O BB12-1701 [0,2,0,0,0,0|1,0,0]=3 55 B8R0.5 CN(CCO)CC(=O)O BB12-1628 [0,2,0,0,0,0|2,0,0]=4 56 B8R0.19 CCN(C)CC(C)CN BB12-1352 [0,2,0,0,0,0|1,0,1]=4 57 B8R0.23 CC(CN(C)C)C(=O)O BB12-1434 [0,2,0,0,0,0|1,0,0]=3 58 B8R0.8 C=CCSC(C)C(=O)O BB12-3266 [0,2,0,0,0,0|0,0,2]=4 59 B8R0.8 CCCC[C@H](N)C(=O)O BB12-2277 [0,2,0,0,0,0|1,0,0]=3 60 B8R0.25 CC(C)(C=O)CCC#N BB12-1601 [0,2,0,0,0,0|0,0,1]=3 61 B8R0.15 CCCC(CN)N(C)C BB12-3578 [0,2,0,0,0,0|1,0,1]=4 62 B6R1.2 O[C@@H]1CCNC1 BB12-3487 [1,0,0,1,0,0|1,0,1]=4 63 B6R1.6 NCC1CCC1 BB12-1679 [1,0,0,1,0,0|1,0,1]=4 64 B8R1.1 CN1CCC(CBr)C1 BB12-3105 [0,1,0,1,0,0|1,0,1]=4 65 B8R1.1 CN1CCC(CCl)C1 BB12-1681 [0,1,0,1,0,0|1,0,1]=4 66 B8R1.1 CN1CCC(CN)C1 BB56-2350 [0,1,0,1,0,0|1,0,1]=4 67 B8R1.2 CNC1CCCCC1 BB53-1677 [0,1,0,1,0,0|1,0,1]=4 68 B8R1.2 CNC1CCOCC1 BB53-1688 [0,1,0,1,0,0|2,0,0]=4 69 B8R1.2 CNC1CCSCC1 BB53-1643 [0,1,0,1,0,0|2,0,0]=4 70 B8R1.2 COC1CCCNC1 BB12-3161 [0,1,0,1,0,0|1,0,1]=4 71 B8R1.2 COC1CCNCC1 BB12-3162 [0,1,0,1,0,0|2,0,0]=4 72 B8R1.2 O=CC1CC=CCC1 BB01-8334 [0,1,0,1,0,0|0,0,1]=3 73 B8R1.2 OCC1CCCCC1 BB20-4574 [0,1,0,1,0,0|0,0,2]=4 74 B8R1.2 OCC1CCCCN1 BB56-1322 [0,1,0,1,0,0|0,0,2]=4 75 B8R1.2 OCC1CCCOC1 BB12-1755 [0,1,0,1,0,0|0,0,2]=4 76 B8R1.2 [C-]#[N+]C1CCCCC1 BB56-1202 [0,1,0,1,0,0|2,0,0]=4 77 B8R1.5 O=C1CCOCC1O BB17-2979 [0,1,0,1,0,0|1,0,0]=3 78 B8R1.5 O=C1OCCCC1Br BB17-3008 [0,1,0,1,0,0|1,0,0]=3 79 B8R1.22 CC1CCCCCN1 BB12-3099 [0,1,0,1,0,0|1,0,1]=4 80 B8R1.22 CC1CCCNCC1 BB12-1445 [0,1,0,1,0,0|1,0,1]=4 81 B8R1.52 CC1(C#N)CCCO1 BB12-2060 [0,1,0,1,0,0|1,0,1]=4 82 B8R1.52 NC1(CO)CCCC1 BB56-2049 [0,1,0,1,0,0|0,0,2]=4 83 B8R1.7 NC(=O)[C@@H]1CCCN1 BB12-3488 [0,1,0,1,0,0|1,0,0]=3 84 B8R1.8 CCCC1CCCN1 BB56-1742 [0,1,0,1,0,0|1,0,1]=4 85 B8R1.8 CNCC1CCCC1 BB12-1620 [0,1,0,1,0,0|1,0,1]=4 86 B8R1.8 NCCC1CCCC1 BB12-2130 [0,1,0,1,0,0|1,0,1]=4 87 B8R1.8 S=C=NC1CCCC1 BB53-1313 [0,1,0,1,0,0|0,1,1]=4 88 B8R1.11 CCC1CCCC1=O BB12-2911 [0,1,0,1,0,0|0,0,0]=2 89 B8R1.11 CN1CCCC1CBr BB12-3093 [0,1,0,1,0,0|1,0,1]=4 90 B8R1.11 CN1CCCC1CO BB12-1660 [0,1,0,1,0,0|0,0,2]=4 91 B8R1.28 CCC(C)(O)C1CC1 BB12-2976 [0,1,0,1,0,0|1,0,1]=4 92 B8R1.72 CC1(C)CCCNC1 BB12-1606 [0,1,0,1,0,0|1,0,1]=4