0 B8R0.23 C=C(NC(C)=O)C(=O)O BB01-7568 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.23 CC(CC(=O)O)N(C)C BB12-1308 [0,0,0,0,0,0|4,0,0]=4 2 B8R0.23 CC(CN(C)C)C(=O)O BB12-1434 [0,0,0,0,0,0|4,0,0]=4 3 B8R0.23 CN(CC(=O)O)C(N)=O BB57-2505 [0,0,0,0,0,0|4,0,0]=4 4 B7R0.2 CCC(C)NC(N)=O BB01-7615 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.2 CCN(C)CC(C)=O BB12-2316 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.2 CNC(C)CC(=O)O BB12-1285 [1,0,0,0,0,0|3,0,0]=4 7 B7R0.5 CC(NC=O)C(=O)O BB12-1345 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.5 CCSC(C)C(=O)O BB12-3261 [1,0,0,0,0,0|1,1,1]=4 9 B7R0.5 CNCC(C)C(=O)O BB12-1637 [1,0,0,0,0,0|3,0,0]=4 10 B7R0.6 C=C(C)COC(C)=O BB12-2984 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.6 CC(=O)OCC(=O)Cl BB12-3445 [1,0,0,0,0,0|1,0,0]=2 12 B9R0.11 CC(=O)NC(C)(C)C(=O)O BB57-1682 [0,1,0,0,0,0|2,0,0]=3 13 B9R0.23 COC(=O)C(C)CN(C)C BB12-3648 [0,1,0,0,0,0|3,0,0]=4 14 B9R0.23 COC(=O)C(C)NC(N)=O BB01-7618 [0,1,0,0,0,0|2,0,0]=3 15 B9R0.23 O=C(O)CC(Br)C(=O)CBr BB54-5215 [0,1,0,0,0,0|3,0,0]=4 16 B9R0.39 CC(=O)NC(C#N)C(N)=O BB55-6845 [0,1,0,0,0,0|2,0,1]=4 17 B9R1.35 C=C1CCC(C(=O)O)C1 BB58-5288 [0,0,0,1,0,0|3,0,0]=4 18 B9R1.35 CC1=NC(C(=O)O)CC1 BB58-2824 [0,0,0,1,0,0|3,0,0]=4 19 B9R1.35 O=C1CC(C(=O)O)CN1 BB57-2160 [0,0,0,1,0,0|3,0,0]=4 20 B9R1.35 O=C1CC(C(=O)O)CS1 BB01-0509 [0,0,0,1,0,0|3,0,0]=4 21 B9R1.69 CC1CN(C)CCC1=O BB54-0258 [0,0,0,1,0,0|3,0,0]=4 22 B7R0.16 CC(C(=O)O)C(=O)O BB20-4558 [0,0,0,0,1,0|2,0,0]=3 23 B7R0.16 CC(C(=O)O)N(C)C BB12-1429 [0,0,0,0,1,0|3,0,0]=4 24 B9R0.53 CC(=O)NC(C)CC(=O)O BB57-3774 [0,0,0,0,0,1|2,0,0]=3 25 B6R0.2 CC(C)NC(N)=O BB01-7616 [2,0,0,0,0,0|2,0,0]=4 26 B6R0.4 CCOCC(=O)Cl BB01-8267 [2,0,0,0,0,0|1,0,1]=4 27 B6R0.4 COCCC(C)=O BB58-1056 [2,0,0,0,0,0|2,0,0]=4 28 B6R0.3 CNC(C)C(=O)O BB57-2982 [2,0,0,0,0,0|2,0,0]=4 29 B6R0.3 COC(C)C(=O)O BB57-2927 [2,0,0,0,0,0|1,0,0]=3 30 B6R0.3 CSC(C)C(=O)O BB12-2671 [2,0,0,0,0,0|1,1,0]=4 31 B8R0.3 COC(=O)C(C)N=C=O BB01-6534 [1,1,0,0,0,0|1,0,1]=4 32 B8R0.8 CCCOC(C)C(=O)O BB55-7871 [1,1,0,0,0,0|1,0,1]=4 33 B8R0.12 CCOC(C)(C)C(=O)O BB57-2291 [1,1,0,0,0,0|1,0,1]=4 34 B8R0.9 CCC(=O)CCC(=O)O BB57-6622 [1,1,0,0,0,0|2,0,0]=4 35 B8R0.9 CCC(=O)NCC(=O)O BB55-4733 [1,1,0,0,0,0|2,0,0]=4 36 B8R0.9 NCC(=O)CCC(=O)O BB57-4885 [1,1,0,0,0,0|2,0,0]=4 37 B8R0.18 CC(=O)C(=NO)C(C)=O BB12-1907 [0,1,0,0,1,0|1,0,1]=4 38 B10R0.43 CC(=O)CNC(C)(C)C(C)=O BB54-2739 [0,1,0,0,0,1|1,0,0]=3 39 B10R0.47 CC(C)(NC(=O)CCl)C(=O)O BB57-3787 [0,2,0,0,0,0|2,0,0]=4 40 B10R0.47 CCC(=O)NC(C)(C)C(=O)O BB57-3784 [0,2,0,0,0,0|2,0,0]=4 41 B10R0.141 COC(=O)C(C)(C)NC(C)=O BB57-1522 [0,2,0,0,0,0|1,0,0]=3 42 B10R0.32 CCOC(=O)C(C)NC(N)=O BB01-7598 [0,2,0,0,0,0|2,0,0]=4 43 B10R0.162 CC(=O)CN(C(C)=O)C(C)=O BB12-2965 [0,2,0,0,0,0|2,0,0]=4 44 B10R0.162 CC(=O)N[C@@H](C(=O)O)C(C)C BB12-2923 [0,2,0,0,0,0|2,0,0]=4 45 B8R1.1 O=C1CCC(CBr)O1 BB58-1167 [1,0,0,1,0,0|1,0,1]=4 46 B8R1.1 O=C1CCC(CCl)O1 BB54-5256 [1,0,0,1,0,0|1,0,1]=4 47 B8R1.4 CC1CC(=O)CCN1 BB54-5684 [1,0,0,1,0,0|2,0,0]=4 48 B8R1.4 CC1CCCC(=O)N1 BB58-1969 [1,0,0,1,0,0|1,0,1]=4 49 B8R1.5 CC1CNCCC1=O BB58-3122 [1,0,0,1,0,0|2,0,0]=4 50 B8R1.5 CC1OCCNC1=O BB58-1681 [1,0,0,1,0,0|1,0,1]=4 51 B8R1.7 CC(=O)C1CCCC1 BB55-6362 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.7 O=C(Cl)C1CCCO1 BB20-1591 [1,0,0,1,0,0|1,0,1]=4 53 B8R1.3 O=C1CCS(=O)CC1 BB53-1536 [1,0,0,1,0,0|2,0,0]=4 54 B8R1.50 CN1C(=O)CNC1=O BB26-0158 [0,0,0,1,1,0|2,0,0]=4 55 B8R1.50 CN1C(=O)CNC1=O BB58-1433 [0,0,0,1,1,0|2,0,0]=4 56 B10R1.13 O=C1CCC(C(=O)O)CN1 BB58-1718 [0,0,0,1,0,1|2,0,0]=4 57 B10R1.470 CC1=NOC(C)(C(=O)O)C1 BB05-4675 [0,0,0,1,0,1|2,0,0]=4 58 B10R1.470 CC1=NOC(C)(C(=O)O)C1 BB55-3996 [0,0,0,1,0,1|2,0,0]=4 59 B10R1.54 O=C(O)CC1CCC(=O)N1 BB58-3082 [0,0,0,1,0,1|2,0,0]=4 60 B10R1.14 COC(=O)C1CNC(=O)C1 BB57-2168 [0,1,0,1,0,0|2,0,0]=4 61 B10R1.14 NNC(=O)C1CCC(=O)N1 BB17-2412 [0,1,0,1,0,0|2,0,0]=4 62 B10R1.113 O=C1CSCC(C(=O)O)N1 BB01-5725 [0,1,0,1,0,0|2,0,0]=4 63 B8R0.28 NC(=O)COCC(=O)O BB12-2362 [1,0,0,0,0,1|2,0,0]=4