0 B7R0.5 CC(CCBr)C(F)F F1913-1886 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.5 CC(CCN)C(F)F F1913-1887 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.5 CC(CCO)C(F)F F1913-1885 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.5 CCCC(C)C(C)N F8882-3710 [0,0,0,0,0,0|2,0,1]=3 4 B7R0.5 CCSC(F)C(=O)O F8884-4602 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.5 CNCC(C)[N+](=O)[O-] F1904-0189 [0,0,0,0,0,0|2,0,1]=3 6 B7R0.5 N#CCC(F)C(=O)O F2147-5599 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.5 NC(CCF)C(=O)O F1913-7468 [0,0,0,0,0,0|2,0,0]=2 8 B7R0.5 O=C(O)\C(Br)=C\CO F1913-6627 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.5 O=C(O)\C(F)=C\CO F1913-6626 [0,0,0,0,0,0|2,0,2]=4 10 B6R0.1 C#CC(C)CCBr F1913-0984 [1,0,0,0,0,0|2,0,1]=4 11 B6R0.1 C#CC(C)CCN F1913-0985 [1,0,0,0,0,0|2,0,1]=4 12 B6R0.1 C#CC(C)CCN F1913-0986 [1,0,0,0,0,0|2,0,1]=4 13 B6R0.1 C#CC(C)CCO F1913-0983 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.1 CCCC(F)CBr F2147-5497 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.1 CCCC(F)CN F2147-5498 [1,0,0,0,0,0|2,0,1]=4 16 B6R0.1 CCCC(F)CO F2147-5496 [1,0,0,0,0,0|1,0,1]=3 17 B6R0.1 CNCC(C)NC F1911-1810 [1,0,0,0,0,0|3,0,0]=4 18 B6R0.1 CNCC(F)CO F1913-7400 [1,0,0,0,0,0|2,0,1]=4 19 B6R0.1 CNCC(F)CO F1913-7401 [1,0,0,0,0,0|2,0,1]=4 20 B6R0.1 CSCC(N)CO F8883-8043 [1,0,0,0,0,0|2,0,1]=4 21 B6R0.1 NC(CO)CCF F8888-3054 [1,0,0,0,0,0|2,0,1]=4 22 B6R0.1 NCCC(O)CO F1913-1693 [1,0,0,0,0,0|2,0,1]=4 23 B6R0.1 NCC[C@H](O)CO F1913-7178 [1,0,0,0,0,0|2,0,1]=4 24 B6R0.1 OCCC(F)CO F2147-5755 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.3 CCC(F)C(=O)O F2147-5487 [1,0,0,0,0,0|1,0,0]=2 26 B6R0.4 C#CCCC(=O)Cl F1913-1831 [1,0,0,0,0,0|1,0,2]=4 27 B6R0.4 C=C(C)CCCN F1913-0543 [1,0,0,0,0,0|3,0,0]=4 28 B6R0.4 CSSCC(=O)O F8881-3230 [1,0,0,0,0,0|2,0,0]=3 29 B6R0.4 NCCC[N+](=O)[O-] F2147-8750 [1,0,0,0,0,0|2,0,1]=4 30 B6R0.4 O=C(O)\C=C\CF F0006-0316 [1,0,0,0,0,0|1,0,2]=4 31 B8R0.2 CCC(C)C(F)C(=O)O F2147-5574 [0,1,0,0,0,0|1,0,0]=2 32 B8R0.3 COC(=O)C(N)CCF F1913-7467 [0,1,0,0,0,0|2,0,0]=3 33 B8R0.8 C#CCCC(F)C(=O)O F2147-5931 [0,1,0,0,0,0|1,0,1]=3 34 B8R0.8 C#CCCC(N)C(=O)O F2147-2762 [0,1,0,0,0,0|1,0,1]=3 35 B8R0.8 C=CCCC(F)C(=O)O F2147-5991 [0,1,0,0,0,0|1,0,1]=3 36 B8R0.8 C=CCCC(N)C(=O)O F8880-1233 [0,1,0,0,0,0|1,0,1]=3 37 B8R0.8 CC#CCC(F)C(=O)O F2147-5556 [0,1,0,0,0,0|1,0,1]=3 38 B8R0.8 CC#CCC(N)C(=O)O F8881-2802 [0,1,0,0,0,0|1,0,1]=3 39 B8R0.8 CCCCC(Br)C(=O)Cl F1913-0464 [0,1,0,0,0,0|2,0,0]=3 40 B8R0.8 CCNCC(C)[N+](=O)[O-] F1904-0640 [0,1,0,0,0,0|1,0,1]=3 41 B8R0.8 CNCCC(C)C(F)F F1913-1888 [0,1,0,0,0,0|2,0,1]=4 42 B8R0.8 COCCC(F)C(=O)O F2147-5761 [0,1,0,0,0,0|1,0,0]=2 43 B8R0.8 COCCC(N)C(=O)O F8887-3926 [0,1,0,0,0,0|1,0,0]=2 44 B8R0.8 CSC\C=C(/Br)C(=O)O F1913-6624 [0,1,0,0,0,0|1,0,2]=4 45 B8R0.8 CSC\C=C(/F)C(=O)O F1913-6625 [0,1,0,0,0,0|1,0,2]=4 46 B8R0.8 N#CCCC(F)C(=O)O F2147-5779 [0,1,0,0,0,0|1,0,1]=3 47 B8R0.12 C#CCC(C)(C)C(=O)O F8881-1591 [0,1,0,0,0,0|0,0,2]=3 48 B8R0.12 CC(C)(CCF)C(=O)O F1913-7218 [0,1,0,0,0,0|1,0,0]=2 49 B8R0.12 CNCC(C)(C)[N+](=O)[O-] F1904-0188 [0,1,0,0,0,0|2,0,1]=4 50 B8R0.12 COCC(C)(C)C(=O)Cl F2147-5320 [0,1,0,0,0,0|2,0,0]=3 51 B8R0.23 C=C(C)CC(F)C(=O)O F2147-5976 [0,1,0,0,0,0|1,0,1]=3 52 B8R0.23 CC(CC(F)F)C(=O)O F1913-0355 [0,1,0,0,0,0|1,0,0]=2 53 B8R0.23 CC(CN(C)C)[N+](=O)[O-] F1904-0273 [0,1,0,0,0,0|2,0,1]=4 54 B8R0.23 NC(CC(F)F)C(=O)O F8887-3929 [0,1,0,0,0,0|2,0,0]=3 55 B8R0.23 O=C(O)C(F)CC(F)F F2147-6009 [0,1,0,0,0,0|2,0,0]=3 56 B8R0.23 O=C(O)CC(F)C(=O)O F2147-5754 [0,1,0,0,0,0|2,0,1]=4 57 B8R1.5 FC1OCCCC1Br F1911-2868 [0,0,0,1,0,0|2,0,1]=4 58 B8R1.5 O=C1NCCCC1F F2147-8375 [0,0,0,1,0,0|2,0,0]=3 59 B8R1.7 O=C(O)C1=CCCO1 F8889-5190 [0,0,0,1,0,0|1,0,2]=4 60 B8R1.7 O=C(O)C1CCSC1 F2147-1614 [0,0,0,1,0,0|1,0,0]=2 61 B8R1.13 CCN[C@@H]1CC[C@H]1O F6619-0539 [0,0,0,1,0,0|2,0,1]=4 62 B8R1.23 CC(=O)C1CC(=O)C1 F2147-4832 [0,0,0,1,0,0|2,0,1]=4 63 B8R1.23 NC(=O)N1CC(N)C1 F2147-4842 [0,0,0,1,0,0|3,0,0]=4 64 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 F1913-7309 [0,0,0,1,0,0|1,0,0]=2 65 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 F1913-7308 [0,0,0,1,0,0|1,0,0]=2 66 B8R1.43 C#CC1CC1C(=O)O F1913-1035 [0,0,0,1,0,0|0,0,2]=3 67 B8R1.43 C=CC1CC1C(=O)O F1913-5193 [0,0,0,1,0,0|0,0,2]=3 68 B8R1.43 C=C[C@H]1C[C@@H]1C(=O)O F1913-7368 [0,0,0,1,0,0|0,0,2]=3 69 B8R1.43 C=C[C@H]1C[C@H]1C(=O)O F1913-7369 [0,0,0,1,0,0|0,0,2]=3 70 B8R1.54 NC(=O)C(N)C1CC1 F8882-4798 [0,0,0,1,0,0|2,0,0]=3 71 B8R1.78 O=C(O)C1(F)CCC1 F1913-4938 [0,0,0,1,0,0|1,0,0]=2 72 B8R0.5 COCC(C)CC(=O)O F8881-0004 [0,0,0,0,0,1|1,0,0]=2 73 B5R0.1 CNCC(C)N F8889-7014 [2,0,0,0,0,0|2,0,0]=4 74 B5R0.3 CCC(F)CO F2147-5488 [2,0,0,0,0,0|1,0,1]=4 75 B5R0.5 CC(=O)C(C)N F1967-1159 [2,0,0,0,0,0|2,0,0]=4 76 B7R0.2 CC(C)CC(F)CO F2147-5521 [1,1,0,0,0,0|1,0,1]=4 77 B7R0.2 CC(CO)CC(F)F F1913-0356 [1,1,0,0,0,0|1,0,1]=4 78 B7R0.3 C#CC(C)CCNC F1913-0987 [1,1,0,0,0,0|1,0,1]=4 79 B7R0.3 C#CC(C)CCNC F1913-0988 [1,1,0,0,0,0|1,0,1]=4 80 B7R0.3 C=CCCC(C)C=O F2147-8873 [1,1,0,0,0,0|0,0,1]=3 81 B7R0.3 C=CCCC(C)CO F2147-8855 [1,1,0,0,0,0|0,0,2]=4 82 B7R0.3 CC(C=O)CCC#N F8888-5611 [1,1,0,0,0,0|0,0,1]=3 83 B7R0.3 CCC(C)CCNC F1911-1828 [1,1,0,0,0,0|1,0,1]=4 84 B7R0.3 CCCCC(F)CO F2147-5513 [1,1,0,0,0,0|1,0,1]=4 85 B7R0.3 CCNCC(C)CC F8881-5417 [1,1,0,0,0,0|1,0,1]=4 86 B7R0.3 CCNCC(C)NC F1911-1811 [1,1,0,0,0,0|2,0,0]=4 87 B7R0.3 COCCC(F)CO F2147-5762 [1,1,0,0,0,0|1,0,1]=4 88 B7R0.3 COCCC(N)CO F8888-3344 [1,1,0,0,0,0|1,0,1]=4 89 B7R0.3 OCCCC(F)CO F2147-5787 [1,1,0,0,0,0|1,0,1]=4 90 B7R0.10 CCC(C)C(F)CO F2147-5575 [1,1,0,0,0,0|1,0,1]=4 91 B7R0.11 C#CC(C)(C)CCC F2147-6045 [1,1,0,0,0,0|1,0,1]=4 92 B7R0.11 C#CCC(C)(C)C=O F2147-6079 [1,1,0,0,0,0|0,0,2]=4 93 B7R0.11 CC(C)(C=O)CCF F1913-7217 [1,1,0,0,0,0|1,0,0]=3 94 B7R0.11 CC(C)(CO)CCF F1913-7219 [1,1,0,0,0,0|1,0,1]=4 95 B7R0.11 CC(C)(CO)CCN F2147-1664 [1,1,0,0,0,0|1,0,1]=4 96 B7R0.11 CCCC(C)(C)C#N F8883-9505 [1,1,0,0,0,0|1,0,1]=4 97 B7R0.11 CCCC(C)(C)C=O F2147-6044 [1,1,0,0,0,0|0,0,0]=2 98 B7R0.11 CCCC(C)(C)CBr F8885-1049 [1,1,0,0,0,0|1,0,1]=4 99 B7R0.11 CCCC(C)(C)CN F2147-6041 [1,1,0,0,0,0|1,0,1]=4 100 B7R0.11 CCCC(C)(C)CO F8885-0869 [1,1,0,0,0,0|0,0,1]=3 101 B7R0.11 CCCC(C)(F)CN F1967-9151 [1,1,0,0,0,0|1,0,1]=4 102 B7R0.13 COC(C)(C)C(=O)Cl F1913-7579 [1,1,0,0,0,0|2,0,0]=4 103 B7R0.15 CCC(OC)C(N)=O F3310-0230 [1,1,0,0,0,0|1,0,0]=3 104 B7R0.15 COC(CN)C(=O)O F8888-0400 [1,1,0,0,0,0|1,0,0]=3 105 B7R0.16 CC(C(=O)O)C(F)F F1913-6649 [1,1,0,0,0,0|1,0,0]=3 106 B7R0.16 CC(C)C(F)C(=O)O F8889-5916 [1,1,0,0,0,0|1,0,0]=3 107 B7R0.4 C#CCOCC(=O)O F8885-6186 [1,1,0,0,0,0|0,0,2]=4 108 B7R0.4 C=C(C)CCCNC F1913-0544 [1,1,0,0,0,0|2,0,0]=4 109 B7R0.4 O=C(O)C#CCCO F1913-6697 [1,1,0,0,0,0|0,0,2]=4 110 B7R0.6 CC(=O)OCC(C)C F0001-0218 [1,1,0,0,0,0|2,0,0]=4 111 B7R0.6 O=C(O)CCC(F)F F8880-4978 [1,1,0,0,0,0|1,0,0]=3 112 B7R0.6 O=C(O)COC(F)F F8888-1299 [1,1,0,0,0,0|2,0,0]=4 113 B9R0.6 CCC\C(C)=C(/F)C(=O)O F1913-6647 [0,1,0,0,0,1|0,0,1]=3 114 B9R0.28 CCC(O)C(F)(F)C(=O)O F1913-1720 [0,2,0,0,0,0|1,0,0]=3 115 B9R0.8 C#CCCC(N)C(=O)OC F1913-2966 [0,2,0,0,0,0|1,0,1]=4 116 B9R0.60 C#CCC(C)(C)C(=O)OC F2147-6077 [0,2,0,0,0,0|0,0,2]=4 117 B9R0.60 C=CCC(C)(C)C(=O)OC F2147-6069 [0,2,0,0,0,0|0,0,2]=4 118 B9R0.60 CCCC(C)(C)C(=O)OC F2147-6043 [0,2,0,0,0,0|0,0,0]=2 119 B9R0.7 CC(=O)CCC(C)C(=O)O F2147-8545 [0,2,0,0,0,0|0,0,0]=2 120 B9R0.7 CC(=O)CCC(F)C(=O)O F2147-8556 [0,2,0,0,0,0|1,0,0]=3 121 B9R0.7 CC(C)=CCC(F)C(=O)O F2147-5922 [0,2,0,0,0,0|1,0,1]=4 122 B9R0.7 CC(C)NCC(C)[N+](=O)[O-] F1904-0430 [0,2,0,0,0,0|1,0,1]=4 123 B9R0.7 CC(CCC(F)F)C(=O)O F2147-8564 [0,2,0,0,0,0|0,0,0]=2 124 B9R0.7 NC(CCC(F)F)C(=O)O F2147-8561 [0,2,0,0,0,0|1,0,0]=3 125 B9R0.7 NC(CSC(F)F)C(=O)O F2197-0378 [0,2,0,0,0,0|2,0,0]=4 126 B9R0.7 O=C(O)CCC(F)C(=O)O F2147-5786 [0,2,0,0,0,0|1,0,1]=4 127 B9R0.47 C#CCCCC(F)C(=O)O F2147-5940 [0,2,0,0,0,0|1,0,0]=3 128 B9R0.47 C#CCCCC(N)C(=O)O F2147-6623 [0,2,0,0,0,0|1,0,0]=3 129 B9R0.47 C=CCCCC(F)C(=O)O F2147-6000 [0,2,0,0,0,0|1,0,0]=3 130 B9R0.47 C=CCCCC(N)C(=O)O F2147-6652 [0,2,0,0,0,0|1,0,0]=3 131 B9R0.47 CCCNCC(C)[N+](=O)[O-] F1904-0579 [0,2,0,0,0,0|1,0,1]=4 132 B9R0.47 CCOCCC(F)C(=O)O F2147-5770 [0,2,0,0,0,0|1,0,0]=3 133 B9R0.47 CCOCCC(N)C(=O)O F2147-6583 [0,2,0,0,0,0|1,0,0]=3 134 B9R0.51 C=CCCC(F)(F)C(=O)O F1913-2950 [0,2,0,0,0,0|1,0,1]=4 135 B9R0.51 CC#CCC(C)(C)C(=O)O F2147-6084 [0,2,0,0,0,0|0,0,1]=3 136 B9R0.51 CCNCC(C)(C)[N+](=O)[O-] F1904-0639 [0,2,0,0,0,0|1,0,1]=4 137 B9R0.11 C=C(C)CC(C)(C)C(=O)O F8884-3397 [0,2,0,0,0,0|0,0,1]=3 138 B9R0.11 CN(C)CC(C)(N)C(=O)O F8882-7257 [0,2,0,0,0,0|1,0,0]=3 139 B9R0.74 C#CCC(C)(CC)C(=O)O F8884-4867 [0,2,0,0,0,0|0,0,2]=4 140 B9R0.15 CCCN(CCC)C(=O)Cl F0001-0880 [0,2,0,0,0,0|2,0,0]=4 141 B9R0.39 CCC(CC(F)F)C(=O)O F1913-0357 [0,2,0,0,0,0|1,0,0]=3 142 B9R0.57 CC(C)(C)OC(F)C(=O)O F8884-4590 [0,2,0,0,0,0|2,0,0]=4 143 B9R0.57 CC(CS(C)(=O)=O)C(=O)O F8881-1611 [0,2,0,0,0,0|1,0,0]=3 144 B7R1.1 C=CC1CCCN1 F2147-2045 [1,0,0,1,0,0|2,0,0]=4 145 B7R1.1 NOC1CCCC1 F1913-1613 [1,0,0,1,0,0|2,0,0]=4 146 B7R1.3 NC1C=CCCC1 F8888-4627 [1,0,0,1,0,0|2,0,0]=4 147 B7R1.4 CC1COCC1=O F2167-8874 [1,0,0,1,0,0|1,0,0]=3 148 B7R1.4 O=C1CCCC1O F8888-4387 [1,0,0,1,0,0|1,0,0]=3 149 B7R1.4 O=C1NCCC1F F2147-8443 [1,0,0,1,0,0|2,0,0]=4 150 B7R1.4 OC1CCCC1F F1905-6475 [1,0,0,1,0,0|1,0,1]=4 151 B7R1.6 CCCC1CNC1 F8884-5060 [1,0,0,1,0,0|1,0,1]=4 152 B7R1.9 NC[C@@H]1C[C@@H]1CO F1913-6685 [1,0,0,1,0,0|1,0,1]=4 153 B7R1.9 NC[C@@H]1C[C@@H]1CO F1913-6686 [1,0,0,1,0,0|1,0,1]=4 154 B7R1.9 NC[C@H]1C[C@@H]1CO F1913-1130 [1,0,0,1,0,0|1,0,1]=4 155 B7R1.9 OC[C@@H]1C[C@H]1CO F1913-6662 [1,0,0,1,0,0|1,0,1]=4 156 B7R1.9 OC[C@H]1C[C@@H]1CF F1913-1127 [1,0,0,1,0,0|1,0,1]=4 157 B7R1.9 OC[C@H]1C[C@H]1CO F1913-6677 [1,0,0,1,0,0|1,0,1]=4 158 B7R1.10 CC1CC(CBr)C1 F1913-0299 [1,0,0,1,0,0|1,0,1]=4 159 B7R1.10 CC1CC(CN)C1 F1913-0300 [1,0,0,1,0,0|1,0,1]=4 160 B7R1.10 OC[C@H]1C[C@@H](F)C1 F1913-7314 [1,0,0,1,0,0|1,0,1]=4 161 B7R1.10 OC[C@H]1C[C@H](F)C1 F1913-7310 [1,0,0,1,0,0|1,0,1]=4 162 B7R1.22 CC(NN)C1CC1 F8888-5132 [1,0,0,1,0,0|2,0,0]=4 163 B7R1.25 CC1(CN)CCC1 F8889-4504 [1,0,0,1,0,0|1,0,1]=4 164 B7R1.18 NC(=S)C1CCC1 F1913-0023 [1,0,0,1,0,0|1,1,0]=4 165 B7R1.18 O=C(O)C1=CCC1 F8889-7863 [1,0,0,1,0,0|0,0,2]=4 166 B7R1.20 O=C(O)C=C1CC1 F8880-6304 [1,0,0,1,0,0|0,0,2]=4 167 B9R1.7 NCCC1CNC(=O)C1 F2147-1996 [0,0,0,1,0,1|2,0,0]=4 168 B9R1.7 O=C1CC(CCO)CN1 F2147-1995 [0,0,0,1,0,1|2,0,0]=4 169 B9R1.13 NC(=O)OC1CCNC1 F2147-2038 [0,0,0,1,0,1|2,0,0]=4 170 B9R1.13 O=C(O)CC1CCCS1 F2147-4096 [0,0,0,1,0,1|1,0,0]=3 171 B9R1.13 O=C(O)\C=C1\CCNC1 F2167-8175 [0,0,0,1,0,1|1,0,1]=4 172 B9R1.41 CC1NCCC1C(=O)O F1913-1553 [0,0,0,1,0,1|1,0,0]=3 173 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O F1913-3325 [0,0,0,1,0,1|2,0,0]=4 174 B9R1.41 O=C(O)[C@H]1CNC[C@H]1F F1913-3322 [0,0,0,1,0,1|2,0,0]=4 175 B9R1.48 CC1CC(=O)NCCN1 F8880-2316 [0,0,0,1,0,1|2,0,0]=4 176 B9R1.53 C=C1CC(CC(=O)O)C1 F1913-0309 [0,0,0,1,0,1|0,0,2]=4 177 B9R1.53 O=C(O)CN1CC(O)C1 F1908-0472 [0,0,0,1,0,1|2,0,0]=4 178 B9R1.137 CN(CC(=O)O)C1CC1 F8889-6758 [0,0,0,1,0,1|1,0,0]=3 179 B9R1.171 CC1(CC(=O)O)CCC1 F1913-0126 [0,0,0,1,0,1|0,0,0]=2 180 B9R1.171 CC1(CC(=O)O)COC1 F2147-8614 [0,0,0,1,0,1|1,0,0]=3 181 B9R1.110 O=C(O)C(F)C1CCC1 F2147-5897 [0,1,0,1,0,0|1,0,0]=3 182 B9R1.110 O=C(O)C(F)C1CNC1 F1913-0189 [0,1,0,1,0,0|1,0,0]=3 183 B9R1.110 O=C(O)C(F)C1COC1 F1913-0176 [0,1,0,1,0,0|1,0,0]=3 184 B9R1.5 CC1CSCCNC1=O F2147-1410 [0,1,0,1,0,0|1,0,0]=3 185 B9R1.11 C#CC(=O)N1CCCC1 F8885-5708 [0,1,0,1,0,0|2,0,0]=4 186 B9R1.11 OCC(F)C1CCCC1 F2147-5584 [0,1,0,1,0,0|1,0,1]=4 187 B9R1.15 CC1=C(CO)CCCO1 F2147-5246 [0,1,0,1,0,0|1,0,1]=4 188 B9R1.15 CC1OCCCC1CO F8884-4721 [0,1,0,1,0,0|1,0,1]=4 189 B9R1.15 CCC1CCCNC1=O F1913-7612 [0,1,0,1,0,0|1,0,0]=3 190 B9R1.15 NCC1CCCNC1=O F8887-7819 [0,1,0,1,0,0|1,0,0]=3 191 B9R1.33 O=C1COCC1CCF F1913-7697 [0,1,0,1,0,0|1,0,0]=3 192 B9R1.69 CN1CC(O)CCC1=O F1911-5597 [0,1,0,1,0,0|2,0,0]=4 193 B9R1.69 CN1C[C@@H](O)CCC1=O F1911-5598 [0,1,0,1,0,0|2,0,0]=4 194 B9R1.69 CN1C[C@H](O)CCC1=O F1911-5599 [0,1,0,1,0,0|2,0,0]=4 195 B9R1.88 C#CC1CC1C(=O)OC F1913-5197 [0,1,0,1,0,0|0,0,2]=4 196 B9R1.88 C=CC1CC1C(=O)OC F1913-5192 [0,1,0,1,0,0|0,0,2]=4 197 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO F1913-6664 [0,1,0,1,0,0|1,0,0]=3 198 B9R1.23 C#CC1CN(C)C(=O)O1 F2147-3314 [0,1,0,1,0,0|1,0,1]=4 199 B9R1.23 C=CC1CN(C)C(=O)O1 F2147-3318 [0,1,0,1,0,0|1,0,1]=4 200 B9R1.23 CN1CC(C=O)OC1=O F2147-3309 [0,1,0,1,0,0|1,0,1]=4 201 B9R1.23 CN1CC(CN)CC1=O F2147-0844 [0,1,0,1,0,0|2,0,0]=4 202 B9R1.35 NC(=O)C1CC(F)CN1 F1907-2144 [0,1,0,1,0,0|2,0,0]=4 203 B9R1.35 NC1CC=C(C(=O)O)C1 F1967-2233 [0,1,0,1,0,0|0,0,2]=4 204 B9R1.35 O=C1CC(C(=O)O)CO1 F2147-1585 [0,1,0,1,0,0|1,0,1]=4 205 B9R1.39 CCCN[C@@H]1CC[C@H]1O F6619-0442 [0,1,0,1,0,0|1,0,1]=4 206 B9R1.40 CC1(N)CCCNC1=O F1913-7530 [0,1,0,1,0,0|1,0,0]=3 207 B9R1.95 CC=C1CC(C(=O)O)C1 F2167-7754 [0,1,0,1,0,0|0,0,1]=3 208 B9R1.95 CCC1CC(C(=O)O)C1 F2167-8038 [0,1,0,1,0,0|0,0,0]=2 209 B9R1.95 CNC1CN(C(C)=O)C1 F2158-2072 [0,1,0,1,0,0|2,0,0]=4 210 B9R1.95 CNC1CN(C(N)=O)C1 F2147-4843 [0,1,0,1,0,0|2,0,0]=4 211 B9R1.95 CNC1CN(C(N)=O)C1 F2158-2067 [0,1,0,1,0,0|2,0,0]=4 212 B9R1.95 CS[C@H]1C[C@@H](C(=O)O)C1 F2147-8650 [0,1,0,1,0,0|0,0,0]=2 213 B9R1.95 CS[C@H]1C[C@H](C(=O)O)C1 F2147-8649 [0,1,0,1,0,0|0,0,0]=2 214 B9R1.112 O=C(O)C(F)CC1CC1 F2147-5861 [0,1,0,1,0,0|1,0,0]=3 215 B9R1.163 CC1(C(N)=O)CCCN1 F2147-6037 [0,1,0,1,0,0|1,0,0]=3 216 B9R1.163 NC(=O)C1(N)CCOC1 F8880-7445 [0,1,0,1,0,0|2,0,0]=4 217 B9R1.163 NC(=O)C1(N)CCOC1 F8888-2024 [0,1,0,1,0,0|2,0,0]=4 218 B9R1.163 O=C(O)C1(F)CCCC1 F8889-1819 [0,1,0,1,0,0|0,0,0]=2 219 B9R1.163 O=C(O)C1(F)CCNC1 F2197-0387 [0,1,0,1,0,0|1,0,0]=3 220 B9R1.165 CC(C)(C(N)=O)C1CC1 F1913-0232 [0,1,0,1,0,0|1,0,0]=3 221 B9R1.24 NCC1CCCS1(=O)=O F2147-4102 [0,1,0,1,0,0|1,0,1]=4 222 B9R1.119 O=C(O)C1(CF)CCC1 F2147-3068 [0,1,0,1,0,0|0,0,0]=2 223 B9R1.36 CC1(C)CC(N)C(=O)N1 F1913-1882 [0,1,0,1,0,0|2,0,0]=4 224 B9R1.36 CC1(C)CC(N)C(=O)N1 F1913-1883 [0,1,0,1,0,0|2,0,0]=4 225 B9R1.161 O=C(O)C1CC1C(F)F F1913-1043 [0,1,0,1,0,0|1,0,0]=3 226 B9R1.161 O=C(O)C1CC1[N+](=O)[O-] F2147-1409 [0,1,0,1,0,0|2,0,0]=4 227 B9R1.164 CC(=O)C1CC(C)(C)C1 F2147-2586 [0,1,0,1,0,0|1,0,0]=3 228 B9R1.164 CC1(C)CC(C(=O)O)N1 F1905-7334 [0,1,0,1,0,0|1,0,0]=3 229 B9R1.164 CC1(F)CC(C(=O)O)C1 F2147-5292 [0,1,0,1,0,0|0,0,0]=2 230 B9R1.164 O=C(Cl)C1CC(F)(F)C1 F2147-4625 [0,1,0,1,0,0|2,0,0]=4 231 B9R2.17 NC12CC1COC2=O F2147-3037 [0,0,0,2,0,0|1,0,0]=3 232 B9R2.53 O=C1C2CNCC1C2 F8880-2954 [0,0,0,2,0,0|2,0,0]=4 233 B9R2.7 O=C1CC2CCCC12 F8884-9269 [0,0,0,2,0,0|1,0,0]=3