0 B6R0.4 CC(C)SCCN BB53-1544 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.4 CCNCC(C)O BB12-1676 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.4 CCSCC(=O)O BB12-3264 [0,0,0,0,0,0|2,0,0]=2 3 B6R0.4 CNCCC(=O)O BB12-1452 [0,0,0,0,0,0|2,0,0]=2 4 B6R0.4 COCCC(=O)Cl BB20-1617 [0,0,0,0,0,0|3,0,0]=3 5 B6R0.4 CSCCC(=N)N BB12-3715 [0,0,0,0,0,0|4,0,0]=4 6 B5R0.1 CCOC(C)=N BB12-3674 [1,0,0,0,0,0|3,0,0]=4 7 B5R0.1 CNCC(C)=O BB12-3010 [1,0,0,0,0,0|2,0,0]=3 8 B5R0.1 CNCC(C)O BB12-1288 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.2 CCSCCN BB53-1545 [1,0,0,0,0,0|2,0,1]=4 10 B5R0.2 [C-]#[N+]CCCC BB56-0718 [1,0,0,0,0,0|3,0,0]=4 11 B7R0.2 CCN(C)CC(=O)O BB12-1321 [0,1,0,0,0,0|2,0,0]=3 12 B7R0.2 CCN(C)CC(C)=O BB12-2316 [0,1,0,0,0,0|3,0,0]=4 13 B7R0.2 CNC(C)CC(=O)O BB12-1285 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.3 CCC(=O)NCCN BB12-2323 [0,1,0,0,0,0|2,0,0]=3 15 B7R0.3 CCCCC(=O)NN BB12-2550 [0,1,0,0,0,0|2,0,0]=3 16 B7R0.3 CCCCC(N)CO BB56-2048 [0,1,0,0,0,0|2,0,1]=4 17 B7R0.3 CCN(C)CCCN BB12-1555 [0,1,0,0,0,0|3,0,0]=4 18 B7R0.3 CNCCC(=O)NC BB12-1428 [0,1,0,0,0,0|3,0,0]=4 19 B7R0.3 COCCC(=O)NN BB20-4502 [0,1,0,0,0,0|3,0,0]=4 20 B7R0.3 COCC\C(N)=N\O BB12-3470 [0,1,0,0,0,0|3,0,0]=4 21 B7R0.4 C=CCSCC(=O)O BB12-3265 [0,1,0,0,0,0|1,0,1]=3 22 B7R0.4 CC(=O)NCCCO BB12-3384 [0,1,0,0,0,0|2,0,0]=3 23 B7R0.4 CCCSCC(=O)O BB12-3263 [0,1,0,0,0,0|1,0,0]=2 24 B7R0.4 CCSCCC(=O)O BB12-3270 [0,1,0,0,0,0|1,0,0]=2 25 B7R0.4 NC(=O)CSCCO BB53-1357 [0,1,0,0,0,0|2,0,0]=3 26 B7R0.5 CC(CCN)N(C)C BB12-1370 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.5 CC(NC=O)C(=O)O BB12-1345 [0,1,0,0,0,0|2,0,1]=4 28 B7R0.5 CCSC(C)C(=O)O BB12-3261 [0,1,0,0,0,0|2,0,0]=3 29 B7R0.5 CNCC(C)C(=O)O BB12-1637 [0,1,0,0,0,0|2,0,0]=3 30 B7R0.6 CC(C)SCC(=O)O BB12-3365 [0,1,0,0,0,0|2,0,0]=3 31 B7R0.8 CS(=O)(=O)NCCN BB12-2754 [0,1,0,0,0,0|2,0,1]=4 32 B7R1.2 O=C1C=C(O)CC1 BB12-0743 [0,0,0,1,0,0|2,0,1]=4 33 B7R1.18 NC(=O)C1CCC1 BB12-3033 [0,0,0,1,0,0|2,0,0]=3 34 B4R0.2 CSCCN BB12-0970 [2,0,0,0,0,0|1,0,1]=4 35 B6R0.1 C#CC(=O)OCC BB53-1426 [1,1,0,0,0,0|2,0,0]=4 36 B6R0.1 CCC\C(N)=N\O BB10-0037 [1,1,0,0,0,0|1,0,0]=3 37 B6R0.1 CNC(=O)CCCl BB12-1619 [1,1,0,0,0,0|2,0,0]=4 38 B6R0.1 CNC(=O)CCN BB12-1715 [1,1,0,0,0,0|1,0,0]=3 39 B6R0.1 CNC(=O)CCO BB12-3660 [1,1,0,0,0,0|2,0,0]=4 40 B6R0.1 CNCC(=O)NN BB12-1497 [1,1,0,0,0,0|2,0,0]=4 41 B6R0.1 COC(=O)CCN BB12-2761 [1,1,0,0,0,0|0,0,0]=2 42 B6R0.1 COC(=O)CCO BB12-1300 [1,1,0,0,0,0|1,0,0]=3 43 B6R0.1 COC\C(N)=N\O BB20-4328 [1,1,0,0,0,0|2,0,0]=4 44 B6R0.1 CSC\C(N)=N\O BB12-3469 [1,1,0,0,0,0|2,0,0]=4 45 B6R0.1 N\C(CCO)=N/O BB12-3471 [1,1,0,0,0,0|2,0,0]=4 46 B6R0.2 CC(N)CC(=O)O BB12-2890 [1,1,0,0,0,0|0,0,0]=2 47 B6R0.3 CSC(C)C(=O)O BB12-2671 [1,1,0,0,0,0|1,0,0]=3 48 B6R0.5 CS(=O)(=O)CCN BB53-1620 [1,1,0,0,0,0|1,0,1]=4 49 B6R0.6 C=CCCCC#N BB12-2224 [1,1,0,0,0,0|1,0,1]=4 50 B6R0.6 CCCSCCN BB53-1582 [1,1,0,0,0,0|1,0,1]=4 51 B8R0.5 CCCC(N)CC(=O)O BB12-1701 [0,2,0,0,0,0|1,0,0]=3 52 B8R0.5 CN(CCO)CC(=O)O BB12-1628 [0,2,0,0,0,0|1,0,0]=3 53 B8R0.23 CC(CC(=O)O)N(C)C BB12-1308 [0,2,0,0,0,0|2,0,0]=4 54 B8R0.23 CC(CN(C)C)C(=O)O BB12-1434 [0,2,0,0,0,0|2,0,0]=4 55 B8R0.34 CCS(=O)(=O)CC(=O)O BB12-3267 [0,2,0,0,0,0|2,0,0]=4 56 B8R0.1 CCOC(=N)CCCCl BB12-2324 [0,2,0,0,0,0|2,0,0]=4 57 B8R0.1 CCOC(=O)CCC#N BB12-3513 [0,2,0,0,0,0|0,0,2]=4 58 B8R0.6 CCNCCC(=O)NN BB12-1383 [0,2,0,0,0,0|2,0,0]=4 59 B8R0.8 C=CCSC(C)C(=O)O BB12-3266 [0,2,0,0,0,0|1,0,1]=4 60 B8R0.8 CCCC[C@H](N)C(=O)O BB12-2277 [0,2,0,0,0,0|1,0,0]=3 61 B8R0.8 CN(C)C(=O)CCCCl BB12-3613 [0,2,0,0,0,0|2,0,0]=4 62 B8R0.9 CCN(C)CCC(=O)O BB12-3650 [0,2,0,0,0,0|1,0,0]=3 63 B8R0.9 CCS(=O)CCC(=O)O BB12-3269 [0,2,0,0,0,0|1,0,0]=3 64 B8R0.9 NNC(=O)CCC(N)=O BB12-2408 [0,2,0,0,0,0|1,0,1]=4 65 B8R0.21 CS(=O)(=O)NCCCN BB12-2137 [0,2,0,0,0,0|1,0,1]=4 66 B8R0.28 CN(C)CCCC(=O)O BB01-6266 [0,2,0,0,0,0|0,0,0]=2 67 B8R0.28 NC(=O)CCCC(=O)O BB12-2466 [0,2,0,0,0,0|0,0,0]=2 68 B8R0.28 NC(=O)COCC(=O)O BB12-2362 [0,2,0,0,0,0|0,0,1]=3 69 B8R0.29 CC(C)(N)CCC(=O)O BB12-1634 [0,2,0,0,0,0|0,0,0]=2 70 B6R1.2 O[C@@H]1CCNC1 BB12-3487 [1,0,0,1,0,0|1,0,1]=4 71 B6R1.11 N=C(N)C1CC1 BB53-1675 [1,0,0,1,0,0|2,0,0]=4 72 B6R1.11 NC(=S)C1CC1 BB12-3485 [1,0,0,1,0,0|1,1,0]=4 73 B6R1.6 NCC1CCC1 BB12-1679 [1,0,0,1,0,0|1,0,1]=4 74 B8R1.1 CC1=NOC(CN)C1 BB55-4169 [0,1,0,1,0,0|1,0,0]=3 75 B8R1.1 CC1=NOC(CO)C1 BB55-3949 [0,1,0,1,0,0|2,0,0]=4 76 B8R1.51 CC1(C)CCC(=O)N1 BB12-1604 [0,1,0,1,0,0|2,0,0]=4 77 B8R1.51 NC1CCS(=O)(=O)C1 BB12-2525 [0,1,0,1,0,0|1,0,1]=4 78 B8R1.2 COC1CCCNC1 BB12-3161 [0,1,0,1,0,0|1,0,1]=4 79 B8R1.2 ON=C1CCCCC1 BB12-1685 [0,1,0,1,0,0|2,0,0]=4 80 B8R1.5 O=C1CCOCC1O BB17-2979 [0,1,0,1,0,0|2,0,0]=4 81 B8R1.5 O=C1OCCCC1Br BB17-3008 [0,1,0,1,0,0|1,0,0]=3 82 B8R1.22 O=C1CCOCCN1 BB20-4217 [0,1,0,1,0,0|2,0,0]=4 83 B8R1.38 COC(=O)C1CCC1 BB12-2967 [0,1,0,1,0,0|1,0,0]=3 84 B8R1.38 NNC(=O)C1CCC1 BB12-2674 [0,1,0,1,0,0|2,0,0]=4 85 B8R1.7 NC(=O)[C@@H]1CCCN1 BB12-3488 [0,1,0,1,0,0|1,0,0]=3