0 B6R0.3 CC(CN)N(C)C BB12-3256 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.3 CC(CO)[N+](=O)[O-] BB12-1675 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.3 CSC(C)C(=O)O BB12-2671 [0,0,0,0,0,0|1,0,0]=1 3 B5R0.1 CCOC(C)=N BB12-3674 [1,0,0,0,0,0|3,0,0]=4 4 B5R0.1 CNCC(C)=O BB12-3010 [1,0,0,0,0,0|2,0,0]=3 5 B5R0.1 CNCC(C)O BB12-1288 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.3 CCC(C)NC BB53-1672 [1,0,0,0,0,0|2,0,0]=3 7 B5R0.3 CC\C(N)=N\O BB12-3467 [1,0,0,0,0,0|2,0,1]=4 8 B5R0.3 CNC(C)CO BB12-1570 [1,0,0,0,0,0|1,0,1]=3 9 B5R0.3 [C-]#[N+]C(C)CC BB56-1204 [1,0,0,0,0,0|2,0,0]=3 10 B5R0.5 CC(Cl)C(N)=O BB12-1307 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.5 CC(CCN)N(C)C BB12-1370 [0,1,0,0,0,0|3,0,0]=4 12 B7R0.5 CC(CCO)N(C)C BB12-3646 [0,1,0,0,0,0|3,0,0]=4 13 B7R0.5 CC(NC=O)C(=O)O BB12-1345 [0,1,0,0,0,0|1,0,1]=3 14 B7R0.5 CCSC(C)C(=O)O BB12-3261 [0,1,0,0,0,0|0,0,0]=1 15 B7R0.5 CNCC(C)C(=O)O BB12-1637 [0,1,0,0,0,0|0,0,0]=1 16 B7R0.10 CCN(C)C(=O)CCl BB12-2479 [0,1,0,0,0,0|2,0,0]=3 17 B7R0.10 CNC(=O)C(C)NC BB12-3606 [0,1,0,0,0,0|2,0,0]=3 18 B7R0.13 CCC(C)(N)C(=O)O BB56-0974 [0,1,0,0,0,0|0,0,0]=1 19 B7R0.14 CCN(C)S(=O)(=O)Cl BB12-1301 [0,1,0,0,0,0|2,0,1]=4 20 B7R0.15 CCC(CC)N(C)C BB12-3678 [0,1,0,0,0,0|3,0,0]=4 21 B7R0.15 CCC(CN)N(C)C BB12-3590 [0,1,0,0,0,0|3,0,0]=4 22 B7R0.15 CCC(CO)N(C)C BB12-3597 [0,1,0,0,0,0|3,0,0]=4 23 B7R0.16 CC(C(=O)O)C(=O)O BB20-4558 [0,1,0,0,0,0|1,0,1]=3 24 B7R0.16 CC(C(=O)O)N(C)C BB12-1429 [0,1,0,0,0,0|1,0,0]=2 25 B7R1.4 NC1CCNC1=O BB12-2184 [0,0,0,1,0,0|2,0,0]=3 26 B7R1.18 NC(=O)C1CCC1 BB12-3033 [0,0,0,1,0,0|1,0,0]=2 27 B7R0.2 CCN(C)CC(=O)O BB12-1321 [0,0,0,0,0,1|1,0,0]=2 28 B7R0.2 CCN(C)CC(C)=O BB12-2316 [0,0,0,0,0,1|2,0,0]=3 29 B7R0.2 CNC(C)CC(=O)O BB12-1285 [0,0,0,0,0,1|1,0,0]=2 30 B6R0.1 C#CC(=O)OCC BB53-1426 [1,1,0,0,0,0|2,0,0]=4 31 B6R0.1 CCC\C(N)=N\O BB10-0037 [1,1,0,0,0,0|1,0,0]=3 32 B6R0.1 CNC(=O)CCCl BB12-1619 [1,1,0,0,0,0|2,0,0]=4 33 B6R0.1 CNC(=O)CCN BB12-1715 [1,1,0,0,0,0|2,0,0]=4 34 B6R0.1 CNC(=O)CCO BB12-3660 [1,1,0,0,0,0|2,0,0]=4 35 B6R0.1 CNCC(=O)NN BB12-1497 [1,1,0,0,0,0|2,0,0]=4 36 B6R0.1 COC(=O)CCN BB12-2761 [1,1,0,0,0,0|1,0,0]=3 37 B6R0.1 COC(=O)CCO BB12-1300 [1,1,0,0,0,0|1,0,0]=3 38 B6R0.1 COC\C(N)=N\O BB20-4328 [1,1,0,0,0,0|2,0,0]=4 39 B6R0.1 CSC\C(N)=N\O BB12-3469 [1,1,0,0,0,0|2,0,0]=4 40 B6R0.1 N\C(CCO)=N/O BB12-3471 [1,1,0,0,0,0|2,0,0]=4 41 B6R0.2 CC(N)CC(=O)O BB12-2890 [1,1,0,0,0,0|0,0,0]=2 42 B6R0.4 CCNCC(C)O BB12-1676 [1,1,0,0,0,0|1,0,1]=4 43 B6R0.4 CCSCC(=O)O BB12-3264 [1,1,0,0,0,0|0,0,0]=2 44 B6R0.4 CNCCC(=O)O BB12-1452 [1,1,0,0,0,0|0,0,0]=2 45 B6R0.4 COCCC(=O)Cl BB20-1617 [1,1,0,0,0,0|1,0,0]=3 46 B6R0.4 CSCCC(=N)N BB12-3715 [1,1,0,0,0,0|2,0,0]=4 47 B6R0.8 CCC(C)(N)CO BB56-2220 [1,1,0,0,0,0|0,0,1]=3 48 B6R0.9 CCC(C#N)NC BB12-1702 [1,1,0,0,0,0|1,0,1]=4 49 B8R0.5 CCCC(N)CC(=O)O BB12-1701 [0,1,0,0,0,1|1,0,0]=3 50 B8R0.5 CN(CCO)CC(=O)O BB12-1628 [0,1,0,0,0,1|1,0,0]=3 51 B8R0.19 CCN(C)CC(=O)NN BB12-2715 [0,1,0,0,0,1|2,0,0]=4 52 B8R0.23 CC(CC(=O)O)N(C)C BB12-1308 [0,1,0,0,0,1|1,0,0]=3 53 B8R0.34 CCS(=O)(=O)CC(=O)O BB12-3267 [0,1,0,0,0,1|2,0,0]=4 54 B8R0.3 CCOC(=O)C(=O)CC BB12-2925 [0,2,0,0,0,0|1,0,1]=4 55 B8R0.3 COC(=O)C(C)N=C=O BB01-6534 [0,2,0,0,0,0|1,0,1]=4 56 B8R0.3 [C-]#[N+]C(C)C(=O)OCC BB56-0006 [0,2,0,0,0,0|1,0,1]=4 57 B8R0.8 C=CCSC(C)C(=O)O BB12-3266 [0,2,0,0,0,0|0,0,1]=3 58 B8R0.8 CCCC[C@H](N)C(=O)O BB12-2277 [0,2,0,0,0,0|1,0,0]=3 59 B8R0.13 CCC(C)(N)C(=O)OC BB56-0964 [0,2,0,0,0,0|0,0,0]=2 60 B8R0.37 CN(C)C(C)(C)C(=O)O BB12-3603 [0,2,0,0,0,0|1,0,0]=3 61 B8R0.18 CCC(C(=O)O)N(C)C BB12-3549 [0,2,0,0,0,0|0,0,0]=2 62 B6R1.11 N=C(N)C1CC1 BB53-1675 [1,0,0,1,0,0|2,0,0]=4 63 B6R1.11 NC(=S)C1CC1 BB12-3485 [1,0,0,1,0,0|1,1,0]=4 64 B6R1.6 NCC1CCC1 BB12-1679 [1,0,0,1,0,0|1,0,1]=4 65 B8R1.5 O=C1CCOCC1O BB17-2979 [0,1,0,1,0,0|2,0,0]=4 66 B8R1.5 O=C1OCCCC1Br BB17-3008 [0,1,0,1,0,0|1,0,0]=3 67 B8R1.7 NC(=O)[C@@H]1CCCN1 BB12-3488 [0,1,0,1,0,0|1,0,0]=3 68 B8R1.11 CCC1CCCC1=O BB12-2911 [0,1,0,1,0,0|1,0,0]=3 69 B8R1.38 COC(=O)C1CCC1 BB12-2967 [0,1,0,1,0,0|0,0,0]=2 70 B8R1.38 NNC(=O)C1CCC1 BB12-2674 [0,1,0,1,0,0|1,0,0]=3 71 B8R0.9 CCN(C)CCC(=O)O BB12-3650 [0,0,0,0,0,2|1,0,0]=3 72 B8R0.9 CCS(=O)CCC(=O)O BB12-3269 [0,0,0,0,0,2|2,0,0]=4