0 B6R0.2 CC(C)C[N+](=O)[O-] BB32-3569 [0,0,0,0,0,0|3,0,0]=3 1 B5R0.1 CC(=O)CCBr BB31-4479 [1,0,0,0,0,0|2,0,0]=3 2 B5R0.1 COCC(C)Br BB31-8127 [1,0,0,0,0,0|3,0,0]=4 3 B5R0.1 COCC(N)=O BB31-3207 [1,0,0,0,0,0|3,0,0]=4 4 B5R0.1 O=C(O)CCF BB32-2513 [1,0,0,0,0,0|3,0,0]=4 5 B7R0.2 CCC(N)CC(=O)O BB31-5235 [0,1,0,0,0,0|3,0,0]=4 6 B7R0.2 CC[C@H](N)CC(=O)O BB31-2771 [0,1,0,0,0,0|3,0,0]=4 7 B7R0.9 CC(O)CC(C)(C)C BB31-5872 [0,1,0,0,0,0|1,0,2]=4 8 B7R0.16 CC(C)C(C)C(=O)O BB31-8342 [0,1,0,0,0,0|2,0,0]=3 9 B7R0.16 CC(C)C(N)C(C)C BB32-2069 [0,1,0,0,0,0|2,0,1]=4 10 B7R1.2 C[C@@H]1CCC(=O)N1 BB31-7724 [0,0,0,1,0,0|1,0,0]=2 11 B7R1.2 C[C@H]1CCC(=O)N1 BB31-2966 [0,0,0,1,0,0|1,0,0]=2 12 B7R1.2 NC1=CC(=O)CC1 BB31-4485 [0,0,0,1,0,0|2,0,1]=4 13 B7R1.2 N[C@H]1CNC(=O)C1 BB31-3703 [0,0,0,1,0,0|3,0,0]=4 14 B7R1.2 O=C1C=CC(O)O1 BB31-2490 [0,0,0,1,0,0|1,0,2]=4 15 B7R1.2 O=C1CC(O)CO1 BB31-5337 [0,0,0,1,0,0|3,0,0]=4 16 B7R1.2 O=C1CCC(O)C1 BB31-4994 [0,0,0,1,0,0|2,0,0]=3 17 B7R1.12 C[C@@H]1C[C@H]1C(=O)O BB32-3490 [0,0,0,1,0,0|2,0,0]=3 18 B7R1.12 C[C@H]1C[C@@H]1C(=O)O BB32-0696 [0,0,0,1,0,0|2,0,0]=3 19 B7R1.12 O=C(O)[C@@H]1C[C@H]1F BB31-3334 [0,0,0,1,0,0|3,0,0]=4 20 B7R1.16 CC1(C)CC(=O)N1 BB32-2836 [0,0,0,1,0,0|1,0,0]=2 21 B7R1.16 CC1(C)CC(Br)C1 BB32-1942 [0,0,0,1,0,0|2,0,1]=4 22 B7R1.16 O=C1CC(F)(F)C1 BB31-1782 [0,0,0,1,0,0|3,0,0]=4 23 B5R0.5 CC(=O)C(N)=O BB32-3571 [0,0,0,0,1,0|2,0,1]=4 24 B7R0.6 CC(=O)NCC(C)O BB31-7690 [0,0,0,0,0,1|2,0,0]=3 25 B7R0.6 CC(=O)NNC(C)C BB32-2318 [0,0,0,0,0,1|1,0,0]=2 26 B7R0.6 CC(C)CC[N+](=O)[O-] BB32-3570 [0,0,0,0,0,1|3,0,0]=4 27 B7R0.6 CC(N)CCC(=O)O BB31-2419 [0,0,0,0,0,1|3,0,0]=4 28 B7R0.6 CC(O)CCC(=O)[O-] BB31-5329 [0,0,0,0,0,1|3,0,0]=4 29 B6R0.1 CCCC(=O)CCl BB31-4027 [1,1,0,0,0,0|1,0,0]=3 30 B6R0.3 CC[C@@H](C)C(=O)O BB31-4656 [1,1,0,0,0,0|2,0,0]=4 31 B6R0.3 CC[C@@H](O)C(=O)O BB31-3920 [1,1,0,0,0,0|2,0,0]=4 32 B6R0.4 CC(=O)CCCBr BB31-6000 [1,1,0,0,0,0|1,0,0]=3 33 B6R0.4 COCOC(C)=O BB32-2824 [1,1,0,0,0,0|0,0,0]=2 34 B6R0.4 NCCNC(N)=O BB32-3910 [1,1,0,0,0,0|2,0,0]=4 35 B6R0.5 COCC(C)(C)N BB31-4342 [1,1,0,0,0,0|2,0,0]=4 36 B8R0.9 CCC(=O)NCC(C)C BB32-3399 [0,1,0,0,0,1|1,0,0]=3 37 B8R0.9 CCC(C)CCC(C)=O BB31-3584 [0,1,0,0,0,1|1,0,0]=3 38 B8R0.23 C=C(CC(C)C)C(=O)O BB31-4322 [0,1,0,0,0,1|2,0,0]=4 39 B8R0.23 CC(=O)C(=O)OC(C)C BB31-7341 [0,1,0,0,0,1|0,0,0]=2 40 B8R0.23 CC(C)[C@H](N)CC(=O)O BB31-7640 [0,1,0,0,0,1|2,0,0]=4 41 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O BB31-5226 [0,2,0,0,0,0|2,0,0]=4 42 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O BB31-6183 [0,2,0,0,0,0|2,0,0]=4 43 B8R0.5 CCCC(C)CC(C)=O BB32-3065 [0,2,0,0,0,0|1,0,0]=3 44 B8R0.16 CCC(CC)CC(=O)O BB32-3031 [0,2,0,0,0,0|2,0,0]=4 45 B8R0.19 CC[C@H](O)CC(=O)OC BB31-5331 [0,2,0,0,0,0|2,0,0]=4 46 B8R0.19 COC(=O)N[C@@H](C)CN BB31-0922 [0,2,0,0,0,0|1,0,0]=3 47 B8R0.24 COC(=O)CC(C)(C)O BB32-3552 [0,2,0,0,0,0|1,0,0]=3 48 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O BB31-7670 [0,2,0,0,0,0|2,0,0]=4 49 B8R0.27 CC(C)(C)[C@H](O)C(=O)O BB31-5424 [0,2,0,0,0,0|2,0,0]=4 50 B8R0.27 CC(C)(O)[C@H](N)C(=O)O BB31-5147 [0,2,0,0,0,0|2,0,0]=4 51 B8R0.18 CC(C)[C@@H](CN)C(=O)O BB31-3788 [0,2,0,0,0,0|2,0,0]=4 52 B8R0.18 CC(C)[C@H](CN)C(=O)O BB31-1792 [0,2,0,0,0,0|2,0,0]=4 53 B6R1.2 C[C@@H]1CCNC1 BB31-4239 [1,0,0,1,0,0|2,0,0]=4 54 B6R1.2 C[C@H]1CCNC1 BB31-5082 [1,0,0,1,0,0|2,0,0]=4 55 B6R1.2 NC1=NCCO1 BB32-1676 [1,0,0,1,0,0|2,0,0]=4 56 B6R1.3 CCNC1CC1 BB31-5032 [1,0,0,1,0,0|1,0,1]=4 57 B6R1.5 CN1CC(=O)C1 BB31-3564 [1,0,0,1,0,0|2,0,0]=4 58 B6R1.5 O=C1CC(O)C1 BB31-5120 [1,0,0,1,0,0|2,0,0]=4 59 B6R1.10 CC1(C)CCN1 BB31-8862 [1,0,0,1,0,0|1,0,1]=4 60 B8R1.3 CC1CNC(=O)CO1 BB31-1811 [0,0,0,1,0,1|1,0,0]=3 61 B8R1.3 C[C@@H]1CO[C@H](C)CN1 BB31-3235 [0,0,0,1,0,1|1,0,1]=4 62 B8R1.3 C[C@H]1CN[C@H](C)CO1 BB31-3234 [0,0,0,1,0,1|1,0,1]=4 63 B8R1.3 NC1CCC(=O)NC1 BB31-0976 [0,0,0,1,0,1|2,0,0]=4 64 B8R1.3 N[C@@H]1CCC(=O)NC1 BB31-0068 [0,0,0,1,0,1|2,0,0]=4 65 B8R1.3 O=C1CC[C@@H](O)CN1 BB31-0348 [0,0,0,1,0,1|2,0,0]=4 66 B8R1.23 CC(=O)N1CC(N)C1 BB31-2583 [0,0,0,1,0,1|2,0,0]=4 67 B8R1.51 CC1(C)CCC(=O)O1 BB31-8004 [0,0,0,1,0,1|2,0,0]=4 68 B8R1.51 CC1(C)COC(=O)C1 BB31-2397 [0,0,0,1,0,1|0,0,0]=2 69 B8R1.1 C=CC1CCC(=O)N1 BB31-7031 [0,1,0,1,0,0|1,0,1]=4 70 B8R1.1 COC1=CC(=O)CC1 BB31-5801 [0,1,0,1,0,0|1,0,1]=4 71 B8R1.1 N#CC1CCC(=O)C1 BB32-2063 [0,1,0,1,0,0|1,0,1]=4 72 B8R1.1 NCC1CCC(=O)N1 BB31-5970 [0,1,0,1,0,0|1,0,0]=3 73 B8R1.1 NCC1CNC(=O)O1 BB31-3233 [0,1,0,1,0,0|1,0,0]=3 74 B8R1.1 O=C1N[C@@H](CI)CO1 BB31-2803 [0,1,0,1,0,0|2,0,0]=4 75 B8R1.1 O=C1N[C@H](CO)CO1 BB31-1953 [0,1,0,1,0,0|2,0,0]=4 76 B8R1.4 CC1CCNC(=O)C1 BB31-5195 [0,1,0,1,0,0|1,0,0]=3 77 B8R1.4 CC1CCOC(=O)O1 BB31-3403 [0,1,0,1,0,0|0,0,0]=2 78 B8R1.4 CN1CCCC(=O)C1 BB31-5533 [0,1,0,1,0,0|2,0,0]=4 79 B8R1.4 C[C@@H]1COCC(=O)N1 BB31-1397 [0,1,0,1,0,0|1,0,0]=3 80 B8R1.4 C[C@H]1CC(=O)CCN1 BB32-0051 [0,1,0,1,0,0|1,0,0]=3 81 B8R1.4 C[C@H]1CNC[C@H](C)O1 BB31-4452 [0,1,0,1,0,0|1,0,1]=4 82 B8R1.4 O=C1CCCC(O)C1 BB31-8636 [0,1,0,1,0,0|2,0,0]=4 83 B8R1.4 O=C1C[C@H](O)CCN1 BB31-8745 [0,1,0,1,0,0|2,0,0]=4 84 B8R1.18 CN1CC(N)CC1=O BB31-0910 [0,1,0,1,0,0|2,0,0]=4 85 B8R1.31 CC1CCC1C(=O)O BB31-4909 [0,1,0,1,0,0|2,0,0]=4 86 B8R1.34 CC(=O)NC1CNC1 BB31-0276 [0,1,0,1,0,0|1,0,0]=3 87 B8R1.34 CC(C)OC1CNC1 BB51-2848 [0,1,0,1,0,0|1,0,1]=4 88 B8R1.34 O=C(O)CC1COC1 BB31-1686 [0,1,0,1,0,0|2,0,0]=4 89 B8R1.40 COC(=O)CC1CC1 BB32-1998 [0,1,0,1,0,0|1,0,0]=3 90 B8R1.50 CN1CCC(=O)C1=O BB32-2163 [0,1,0,1,0,0|2,0,0]=4 91 B8R2.53 O=C1CC2(CC2)C1 BB31-3929 [0,0,0,2,0,0|1,0,0]=3 92 B8R0.28 CC(=O)CCOC(C)=O BB31-0205 [0,0,0,0,0,2|1,0,1]=4