0 B5R0.3 CCC(C)NC BB53-1672 [0,0,0,0,0,0|2,0,0]=2 1 B5R0.3 CC\C(N)=N\O BB12-3467 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.3 CNC(=S)NN BB12-2784 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.3 CNC(C)CO BB12-1570 [0,0,0,0,0,0|2,0,0]=2 4 B5R0.3 [C-]#[N+]C(C)CC BB56-1204 [0,0,0,0,0,0|2,0,0]=2 5 B4R0.1 C\C(N)=N\O BB53-1937 [1,0,0,0,0,0|2,0,1]=4 6 B4R0.2 CSCCCl BB53-1396 [1,0,0,0,0,0|2,0,0]=3 7 B4R0.2 CSCCN BB12-0970 [1,0,0,0,0,0|1,0,0]=2 8 B6R0.1 CC(CN)CCN BB12-1906 [0,1,0,0,0,0|0,0,0]=1 9 B6R0.1 CCNC(=S)NN BB12-3098 [0,1,0,0,0,0|2,0,1]=4 10 B6R0.1 CCNC(C)CO BB12-1659 [0,1,0,0,0,0|1,0,0]=2 11 B6R0.1 CC[C@H](N)COC BB20-3253 [0,1,0,0,0,0|2,0,0]=3 12 B6R0.1 CNC(=O)CCN BB12-1715 [0,1,0,0,0,0|2,0,1]=4 13 B6R0.1 CNC(C)CCO BB12-1373 [0,1,0,0,0,0|2,0,0]=3 14 B6R0.1 CNCC(=O)NN BB12-1497 [0,1,0,0,0,0|2,0,1]=4 15 B6R0.1 COC(=O)CCN BB12-2761 [0,1,0,0,0,0|2,0,1]=4 16 B6R0.3 CC(C)C(=O)NN BB12-1583 [0,1,0,0,0,0|2,0,1]=4 17 B6R0.3 CC(CN)N(C)C BB12-3256 [0,1,0,0,0,0|1,0,0]=2 18 B6R0.3 CC(CO)[N+](=O)[O-] BB12-1675 [0,1,0,0,0,0|3,0,0]=4 19 B6R0.3 CSC(C)C(=O)O BB12-2671 [0,1,0,0,0,0|2,0,1]=4 20 B6R0.8 CCC(C)(N)CO BB56-2220 [0,1,0,0,0,0|1,0,0]=2 21 B6R0.9 CCC(C#N)NC BB12-1702 [0,1,0,0,0,0|0,0,2]=3 22 B6R1.2 OC1CNOC1 BB12-1709 [0,0,0,1,0,0|2,0,0]=3 23 B6R1.2 O[C@@H]1CCNC1 BB12-3487 [0,0,0,1,0,0|1,0,0]=2 24 B6R1.6 NCC1CCC1 BB12-1679 [0,0,0,1,0,0|0,0,0]=1 25 B3R0.1 [C-]#[N+]CC BB56-1802 [2,0,0,0,0,0|1,0,1]=4 26 B5R0.1 CCOC(C)=N BB12-3674 [1,1,0,0,0,0|0,0,2]=4 27 B5R0.1 CNCC(C)=O BB12-3010 [1,1,0,0,0,0|1,0,1]=4 28 B5R0.1 CNCC(C)O BB12-1288 [1,1,0,0,0,0|1,0,0]=3 29 B5R0.4 CC(C)(N)CO BB17-0635 [1,1,0,0,0,0|1,0,0]=3 30 B5R0.5 CC(Cl)C(N)=O BB12-1307 [1,1,0,0,0,0|1,0,1]=4 31 B5R0.2 CCSCCN BB53-1545 [1,1,0,0,0,0|0,0,0]=2 32 B5R0.2 CSCCC#N BB12-3714 [1,1,0,0,0,0|0,0,2]=4 33 B5R0.2 [C-]#[N+]CCCC BB56-0718 [1,1,0,0,0,0|0,0,1]=3 34 B5R0.2 [C-]#[N+]CCOC BB56-1837 [1,1,0,0,0,0|1,0,1]=4 35 B7R0.2 CC(C#N)CN(C)C BB12-1399 [0,2,0,0,0,0|0,0,2]=4 36 B7R0.2 CC(CO)CN(C)C BB12-3644 [0,2,0,0,0,0|1,0,0]=3 37 B7R0.2 CCN(C)CC(=O)O BB12-1321 [0,2,0,0,0,0|2,0,0]=4 38 B7R0.2 CCN(C)CC(C)=O BB12-2316 [0,2,0,0,0,0|2,0,0]=4 39 B7R0.2 CNC(C)CC(=O)O BB12-1285 [0,2,0,0,0,0|2,0,0]=4 40 B7R0.3 CCC(=O)NCCN BB12-2323 [0,2,0,0,0,0|1,0,1]=4 41 B7R0.3 CCCCC(N)CO BB56-2048 [0,2,0,0,0,0|2,0,0]=4 42 B7R0.3 CCN(C)CCCN BB12-1555 [0,2,0,0,0,0|1,0,0]=3 43 B7R0.3 CCN(C)CCCO BB12-3254 [0,2,0,0,0,0|2,0,0]=4 44 B7R0.3 CSCCC(N)CO BB56-2047 [0,2,0,0,0,0|2,0,0]=4 45 B7R0.5 CC(CCN)N(C)C BB12-1370 [0,2,0,0,0,0|1,0,0]=3 46 B7R0.5 CC(CCO)N(C)C BB12-3646 [0,2,0,0,0,0|2,0,0]=4 47 B7R0.5 CCSC(C)C(=O)O BB12-3261 [0,2,0,0,0,0|1,0,1]=4 48 B7R0.5 CNCC(C)C(=O)O BB12-1637 [0,2,0,0,0,0|1,0,1]=4 49 B7R0.7 CCNC(C)CCO BB12-1398 [0,2,0,0,0,0|1,0,0]=3 50 B7R0.7 CNCC(O)COC BB17-0811 [0,2,0,0,0,0|1,0,0]=3 51 B7R0.10 CCN(C)C(=O)CCl BB12-2479 [0,2,0,0,0,0|2,0,0]=4 52 B7R0.10 CNC(=O)C(C)NC BB12-3606 [0,2,0,0,0,0|1,0,1]=4 53 B7R0.11 CCS(=O)(=O)CCN BB53-1627 [0,2,0,0,0,0|2,0,0]=4 54 B7R0.11 COC(C)(C)CCN BB12-2310 [0,2,0,0,0,0|1,0,0]=3 55 B7R0.12 CCOC(CC)CBr BB12-3730 [0,2,0,0,0,0|1,0,0]=3 56 B7R0.13 CCC(C)(N)C(=O)O BB56-0974 [0,2,0,0,0,0|1,0,1]=4 57 B7R0.14 CC(C)(C)C(=O)CN BB12-1271 [0,2,0,0,0,0|1,0,1]=4 58 B7R0.15 CCC(CC)N(C)C BB12-3678 [0,2,0,0,0,0|1,0,0]=3 59 B7R0.15 CCC(CN)N(C)C BB12-3590 [0,2,0,0,0,0|0,0,0]=2 60 B7R0.15 CCC(CO)N(C)C BB12-3597 [0,2,0,0,0,0|1,0,0]=3 61 B5R1.2 O=C1CNC1 BB20-3400 [1,0,0,1,0,0|1,0,1]=4 62 B7R1.1 CNC1CCCC1 BB53-1678 [0,1,0,1,0,0|1,0,0]=3 63 B7R1.3 NC1CCCOC1 BB12-2177 [0,1,0,1,0,0|2,0,0]=4 64 B7R1.3 OC1CCOCC1 BB12-1171 [0,1,0,1,0,0|2,0,0]=4 65 B7R1.3 OC1CCSCC1 BB53-1540 [0,1,0,1,0,0|2,0,0]=4 66 B7R1.4 NC1CCNC1=O BB12-2184 [0,1,0,1,0,0|1,0,1]=4 67 B7R1.6 CNCC1CCC1 BB12-1623 [0,1,0,1,0,0|0,0,0]=2 68 B7R1.18 NC(=O)C1CCC1 BB12-3033 [0,1,0,1,0,0|0,0,1]=3