0 B6R0.3 C=C[C@H](N)C(=O)O BB31-5208 [0,0,0,0,0,0|1,0,2]=3 1 B6R0.3 CC(C#N)C(=O)O BB32-3033 [0,0,0,0,0,0|1,0,1]=2 2 B6R0.3 CC[C@@H](C)C(=O)O BB31-4656 [0,0,0,0,0,0|0,0,0]=0 3 B6R0.3 CC[C@@H](O)C(=O)O BB31-3920 [0,0,0,0,0,0|1,0,0]=1 4 B6R0.3 NC[C@@H](N)C(=O)O BB31-4003 [0,0,0,0,0,0|2,0,0]=2 5 B5R0.1 CC(=O)CCBr BB31-4479 [1,0,0,0,0,0|2,0,0]=3 6 B5R0.1 CC(O)CCBr BB32-3029 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.1 COCC(N)=O BB31-3207 [1,0,0,0,0,0|2,0,0]=3 8 B5R0.1 O=C(O)CCF BB32-2513 [1,0,0,0,0,0|1,0,0]=2 9 B5R0.1 O=C(O)\C=C\Br BB31-5400 [1,0,0,0,0,0|1,0,2]=4 10 B5R0.3 C=C[C@H](N)CO BB32-0951 [1,0,0,0,0,0|3,0,0]=4 11 B5R0.3 CC(CO)CBr BB31-7772 [1,0,0,0,0,0|1,0,1]=3 12 B5R0.3 CO[C@@H](C)CO BB31-0453 [1,0,0,0,0,0|1,0,1]=3 13 B5R0.3 O=C[C@H](O)CO BB31-6122 [1,0,0,0,0,0|2,0,0]=3 14 B5R0.5 CC(=O)C(N)=O BB32-3571 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.5 CC(C)C(C)CCO BB31-7531 [0,1,0,0,0,0|2,0,1]=4 16 B7R0.5 CC(CCO)C(N)=O BB31-7816 [0,1,0,0,0,0|1,0,0]=2 17 B7R0.5 NCCC(F)C(=O)O BB31-4428 [0,1,0,0,0,0|1,0,0]=2 18 B7R0.10 COC(=O)C(C)CN BB31-6417 [0,1,0,0,0,0|1,0,0]=2 19 B7R0.10 COC(=O)[C@@H](C)CBr BB31-6195 [0,1,0,0,0,0|1,0,0]=2 20 B7R0.10 C\C=C(/Br)C(=O)OC BB31-3618 [0,1,0,0,0,0|1,0,2]=4 21 B7R0.13 CC(=O)C(C)(C)CO BB32-0806 [0,1,0,0,0,0|2,0,0]=3 22 B7R0.13 CC(C)(CN)C(=O)O BB31-3976 [0,1,0,0,0,0|1,0,0]=2 23 B7R0.13 CC(C)(CN)C(=O)O BB31-5761 [0,1,0,0,0,0|1,0,0]=2 24 B7R0.13 C[C@@](N)(CO)C(=O)O BB31-6838 [0,1,0,0,0,0|1,0,0]=2 25 B7R0.13 NCC(F)(F)C(=O)O BB31-0714 [0,1,0,0,0,0|2,0,0]=3 26 B7R0.13 NCC(F)(F)C(=O)O BB32-1782 [0,1,0,0,0,0|2,0,0]=3 27 B7R0.15 CN[C@@H](CO)C(=O)O BB31-9937 [0,1,0,0,0,0|1,0,0]=2 28 B7R0.15 NC[C@H](CO)C(=O)O BB31-2226 [0,1,0,0,0,0|1,0,0]=2 29 B7R0.16 CC(C)C(C)C(=O)O BB31-8342 [0,1,0,0,0,0|0,0,0]=1 30 B7R1.4 NC1CCNC1=O BB31-0754 [0,0,0,1,0,0|2,0,0]=3 31 B7R1.4 NC1CCOC1=O BB52-6516 [0,0,0,1,0,0|1,0,0]=2 32 B7R1.12 C[C@@H]1C[C@H]1C(=O)O BB32-3490 [0,0,0,1,0,0|0,0,0]=1 33 B7R1.12 C[C@H]1C[C@@H]1C(=O)O BB32-0696 [0,0,0,1,0,0|0,0,0]=1 34 B7R1.12 O=C(O)[C@@H]1C[C@H]1F BB31-3334 [0,0,0,1,0,0|1,0,0]=2 35 B7R1.18 CC(=O)N1CCC1 BB32-2755 [0,0,0,1,0,0|2,0,0]=3 36 B7R1.18 CC(N)C1CCC1 BB31-5264 [0,0,0,1,0,0|2,0,1]=4 37 B7R1.18 CC(O)C1CNC1 BB31-4088 [0,0,0,1,0,0|2,0,1]=4 38 B7R1.18 N=C(N)C1CCC1 BB31-6957 [0,0,0,1,0,0|2,0,0]=3 39 B7R1.18 NC(=O)C1CNC1 BB31-1092 [0,0,0,1,0,0|2,0,0]=3 40 B7R1.18 NC(=S)C1CCC1 BB31-2990 [0,0,0,1,0,0|1,1,0]=3 41 B7R1.18 O=C(O)C1=CCC1 BB32-1171 [0,0,0,1,0,0|0,0,2]=3 42 B7R1.18 O=C(O)C1COC1 BB31-0382 [0,0,0,1,0,0|1,0,0]=2 43 B7R1.19 CC1(C(N)=O)CC1 BB31-3052 [0,0,0,1,0,0|1,0,0]=2 44 B7R1.19 O=C(O)C1(Br)CC1 BB31-8489 [0,0,0,1,0,0|1,0,0]=2 45 B7R0.2 CCC(N)CC(=O)O BB31-5235 [0,0,0,0,0,1|1,0,0]=2 46 B7R0.2 CC[C@H](N)CC(=O)O BB31-2771 [0,0,0,0,0,1|1,0,0]=2 47 B4R0.2 C=CCCI BB31-6880 [2,0,0,0,0,0|2,0,0]=4 48 B6R0.1 C#CCC(=O)OC BB32-1580 [1,1,0,0,0,0|0,0,2]=4 49 B6R0.1 CCCC(=O)CCl BB31-4027 [1,1,0,0,0,0|1,0,0]=3 50 B6R0.1 NNC(=O)CCO BB31-4269 [1,1,0,0,0,0|2,0,0]=4 51 B6R0.2 CC(C)C[N+](=O)[O-] BB32-3569 [1,1,0,0,0,0|1,0,1]=4 52 B6R0.4 CC(=O)CCCBr BB31-6000 [1,1,0,0,0,0|1,0,0]=3 53 B6R0.4 CCCCC(=N)N BB31-8730 [1,1,0,0,0,0|2,0,0]=4 54 B6R0.4 COCCC(=N)N BB31-7023 [1,1,0,0,0,0|2,0,0]=4 55 B6R0.4 COCOC(C)=O BB32-2824 [1,1,0,0,0,0|2,0,0]=4 56 B6R0.4 NCCNC(N)=O BB32-3910 [1,1,0,0,0,0|2,0,0]=4 57 B6R0.4 O=[N+]([O-])CCCO BB31-4344 [1,1,0,0,0,0|1,0,1]=4 58 B6R0.9 CCC(C#N)CC BB32-3543 [1,1,0,0,0,0|1,0,1]=4 59 B6R0.9 CCC(CC)NC BB31-6271 [1,1,0,0,0,0|1,0,1]=4 60 B6R0.9 CCC(CC)NN BB31-5111 [1,1,0,0,0,0|2,0,0]=4 61 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O BB31-6183 [0,1,0,0,0,1|1,0,0]=3 62 B8R0.5 CCCC(C)CC(C)=O BB32-3065 [0,1,0,0,0,1|1,0,0]=3 63 B8R0.5 CCC[C@H](N)CC(=O)O BB32-3503 [0,1,0,0,0,1|1,0,0]=3 64 B8R0.5 CCC\C(C)=C\C(=O)O BB31-5804 [0,1,0,0,0,1|0,0,1]=3 65 B8R0.16 CCC(CC)CC(=O)O BB32-3031 [0,1,0,0,0,1|0,0,0]=2 66 B8R0.19 CC[C@H](O)CC(=O)OC BB31-5331 [0,1,0,0,0,1|1,0,0]=3 67 B8R0.19 COC(=O)N[C@@H](C)CN BB31-0922 [0,1,0,0,0,1|1,0,0]=3 68 B8R0.23 CC(=O)C(C)CC(=O)O BB31-6096 [0,1,0,0,0,1|0,0,1]=3 69 B8R0.23 CC(C)[C@H](N)CC(=O)O BB31-7640 [0,1,0,0,0,1|1,0,0]=3 70 B8R0.3 CCOC(=O)[C@@H](C)OC BB31-7778 [0,2,0,0,0,0|1,0,0]=3 71 B8R0.8 C=CCC[C@H](N)C(=O)O BB31-7442 [0,2,0,0,0,0|1,0,0]=3 72 B8R0.8 CCCCC(=O)C(=O)O BB31-4311 [0,2,0,0,0,0|1,0,1]=4 73 B8R0.12 C=CC[C@@](C)(N)C(=O)O BB31-5407 [0,2,0,0,0,0|0,0,1]=3 74 B8R0.12 C=CC[C@](C)(N)C(=O)O BB31-5427 [0,2,0,0,0,0|0,0,1]=3 75 B8R0.15 CCCC(CC)C(=O)O BB31-3760 [0,2,0,0,0,0|0,0,0]=2 76 B8R0.13 COC(=O)C(C)(C)C=O BB31-8066 [0,2,0,0,0,0|1,0,1]=4 77 B8R0.20 CCN(CC)C(=O)CN BB31-5658 [0,2,0,0,0,0|2,0,0]=4 78 B8R0.36 CCC(C)(CC)C(=O)O BB31-3894 [0,2,0,0,0,0|0,0,0]=2 79 B8R0.27 CC(C(=O)O)C(F)(F)F BB32-1822 [0,2,0,0,0,0|1,0,0]=3 80 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O BB31-7670 [0,2,0,0,0,0|1,0,0]=3 81 B8R0.27 CC(C)(C)[C@H](O)C(=O)O BB31-5424 [0,2,0,0,0,0|1,0,0]=3 82 B8R0.27 CC(C)(O)[C@H](N)C(=O)O BB31-5147 [0,2,0,0,0,0|1,0,0]=3 83 B8R0.18 CC(C)[C@@H](CN)C(=O)O BB31-3788 [0,2,0,0,0,0|0,0,0]=2 84 B8R0.18 CC(C)[C@H](CN)C(=O)O BB31-1792 [0,2,0,0,0,0|0,0,0]=2 85 B6R1.2 NC1=NCCO1 BB32-1676 [1,0,0,1,0,0|2,0,0]=4 86 B6R1.5 CN1CC(=O)C1 BB31-3564 [1,0,0,1,0,0|2,0,0]=4 87 B6R1.5 O=C1CC(O)C1 BB31-5120 [1,0,0,1,0,0|2,0,0]=4 88 B6R1.11 O=C(O)C1CO1 BB31-6282 [1,0,0,1,0,0|1,0,0]=3 89 B6R1.11 O=C([O-])[C@H]1CO1 BB31-6739 [1,0,0,1,0,0|1,0,1]=4 90 B6R1.6 BrCC1COC1 BB31-2069 [1,0,0,1,0,0|1,0,1]=4 91 B6R1.6 CNC1CCC1 BB31-5108 [1,0,0,1,0,0|2,0,0]=4 92 B6R1.6 NNC1CCC1 BB31-0660 [1,0,0,1,0,0|2,0,0]=4 93 B6R1.6 O=CC1COC1 BB31-1651 [1,0,0,1,0,0|1,0,0]=3 94 B6R1.6 OC[C@@H]1CCN1 BB31-7982 [1,0,0,1,0,0|1,0,1]=4 95 B6R1.6 OC[C@H]1CCN1 BB31-4144 [1,0,0,1,0,0|1,0,1]=4 96 B6R1.7 CC1(CN)CC1 BB31-1478 [1,0,0,1,0,0|1,0,1]=4 97 B6R1.7 OCC1(Br)CC1 BB32-2844 [1,0,0,1,0,0|1,0,1]=4 98 B6R1.7 OCC1(F)CC1 BB32-0673 [1,0,0,1,0,0|1,0,1]=4 99 B8R1.1 NCC1CCC(=O)N1 BB31-5970 [0,0,0,1,0,1|2,0,0]=4 100 B8R1.1 NCC1CNC(=O)O1 BB31-3233 [0,0,0,1,0,1|2,0,0]=4 101 B8R1.1 O=C1N[C@@H](CI)CO1 BB31-2803 [0,0,0,1,0,1|1,0,0]=3 102 B8R1.1 O=C1N[C@H](CO)CO1 BB31-1953 [0,0,0,1,0,1|1,0,0]=3 103 B8R1.4 CC1CCNC(=O)C1 BB31-5195 [0,0,0,1,0,1|1,0,0]=3 104 B8R1.4 CC1CCOC(=O)O1 BB31-3403 [0,0,0,1,0,1|0,0,0]=2 105 B8R1.4 CN1CCCC(=O)C1 BB31-5533 [0,0,0,1,0,1|2,0,0]=4 106 B8R1.4 C[C@@H]1COCC(=O)N1 BB31-1397 [0,0,0,1,0,1|2,0,0]=4 107 B8R1.4 C[C@H]1CC(=O)CCN1 BB32-0051 [0,0,0,1,0,1|2,0,0]=4 108 B8R1.4 O=C1CCCC(O)C1 BB31-8636 [0,0,0,1,0,1|2,0,0]=4 109 B8R1.4 O=C1C[C@H](O)CCN1 BB31-8745 [0,0,0,1,0,1|2,0,0]=4 110 B8R1.31 CC1CCC1C(=O)O BB31-4909 [0,0,0,1,0,1|0,0,0]=2 111 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O BB31-3568 [0,0,0,1,0,1|1,0,0]=3 112 B8R1.34 CC(=O)NC1CNC1 BB31-0276 [0,0,0,1,0,1|2,0,0]=4 113 B8R1.34 O=C(O)CC1COC1 BB31-1686 [0,0,0,1,0,1|1,0,0]=3 114 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O BB32-1878 [0,0,0,1,0,1|1,0,1]=4 115 B8R1.5 CC1COCCC1=O BB31-0779 [0,1,0,1,0,0|1,0,0]=3 116 B8R1.5 CN1CCOCC1=O BB31-4094 [0,1,0,1,0,0|1,0,0]=3 117 B8R1.5 NC1CCCCC1=O BB31-7416 [0,1,0,1,0,0|2,0,0]=4 118 B8R1.5 NC1CCCNC1=O BB52-8540 [0,1,0,1,0,0|2,0,0]=4 119 B8R1.5 O=C1CCOCC1Br BB31-5776 [0,1,0,1,0,0|2,0,0]=4 120 B8R1.5 O=C1CCOCC1F BB32-3113 [0,1,0,1,0,0|2,0,0]=4 121 B8R1.5 O=C1NCCCC1Br BB32-1567 [0,1,0,1,0,0|2,0,0]=4 122 B8R1.7 CC(=O)[C@@H]1CCCO1 BB31-1725 [0,1,0,1,0,0|1,0,0]=3 123 B8R1.7 N=C(N)C1CCCO1 BB32-3453 [0,1,0,1,0,0|2,0,0]=4 124 B8R1.7 NC(=O)[C@@H]1CCNC1 BB31-1778 [0,1,0,1,0,0|1,0,0]=3 125 B8R1.7 NC(=O)[C@H]1CCNC1 BB31-1805 [0,1,0,1,0,0|1,0,0]=3 126 B8R1.7 O=C(O)C1CCCS1 BB32-0695 [0,1,0,1,0,0|0,0,0]=2 127 B8R1.7 O=C(O)[C@@H]1C=CCN1 BB31-3955 [0,1,0,1,0,0|0,0,2]=4 128 B8R1.7 O=C(O)[C@@H]1C=CCN1 BB31-5745 [0,1,0,1,0,0|0,0,2]=4 129 B8R1.7 O=C(O)[C@H]1CCNC1 BB31-5430 [0,1,0,1,0,0|0,0,0]=2 130 B8R1.19 CC1(C)CCNC1=S BB31-1760 [0,1,0,1,0,0|1,1,0]=4 131 B8R1.19 O=C1NCCC1(F)F BB31-3179 [0,1,0,1,0,0|2,0,0]=4 132 B8R1.23 CC(=O)N1CC(N)C1 BB31-2583 [0,1,0,1,0,0|2,0,0]=4 133 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 BB31-7196 [0,1,0,1,0,0|0,0,0]=2 134 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 BB31-8607 [0,1,0,1,0,0|0,0,0]=2 135 B8R1.23 O=C(O)C1CC(Cl)C1 BB31-7948 [0,1,0,1,0,0|0,0,0]=2 136 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 BB31-0994 [0,1,0,1,0,0|0,0,0]=2 137 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 BB31-0993 [0,1,0,1,0,0|0,0,0]=2 138 B8R1.78 CC(=O)C1(C)COC1 BB31-9824 [0,1,0,1,0,0|1,0,0]=3 139 B8R1.78 O=C(O)C1(O)COC1 BB31-2829 [0,1,0,1,0,0|1,0,0]=3 140 B8R1.38 COC(=O)C1COC1 BB31-3226 [0,1,0,1,0,0|1,0,0]=3 141 B8R1.38 O=C(CBr)C1CCC1 BB31-1832 [0,1,0,1,0,0|1,0,0]=3 142 B8R1.38 O=C(CBr)N1CCC1 BB31-6413 [0,1,0,1,0,0|2,0,0]=4 143 B8R1.50 CC1=NNC(=O)C1C BB52-7289 [0,1,0,1,0,0|1,0,1]=4 144 B8R1.50 CN1CCC(=O)C1=O BB32-2163 [0,1,0,1,0,0|1,0,1]=4 145 B8R1.63 CCC1(C(=O)O)CC1 BB31-2928 [0,1,0,1,0,0|0,0,0]=2 146 B8R1.63 COC1(C(=O)O)CC1 BB31-0109 [0,1,0,1,0,0|0,0,0]=2 147 B8R1.63 O=C(O)C1(CF)CC1 BB31-1780 [0,1,0,1,0,0|0,0,0]=2 148 B8R1.77 O=C(O)[C@@H]1CC1(F)F BB31-4050 [0,1,0,1,0,0|1,0,0]=3 149 B8R1.77 O=C(O)[C@H]1CC1(F)F BB31-3198 [0,1,0,1,0,0|1,0,0]=3 150 B8R2.2 CC12CCCC1O2 BB32-0835 [0,0,0,2,0,0|1,0,1]=4 151 B8R0.9 CCC(C)CCC(C)=O BB31-3584 [0,0,0,0,0,2|1,0,0]=3