0 B7R0.1 C#CCCCNCC F1913-1828 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.1 CCCCCN=[N+]=[N-] F1901-3150 [0,0,0,0,0,0|3,0,0]=3 2 B6R0.6 C=CCCCC=O F2147-8874 [1,0,0,0,0,0|0,0,2]=3 3 B6R0.6 C=CCCNCC F1911-1848 [1,0,0,0,0,0|1,0,1]=3 4 B6R0.6 CNCCCCN F8880-9088 [1,0,0,0,0,0|2,0,0]=3 5 B8R0.1 C#CCCC(F)CNC F2147-5935 [0,1,0,0,0,0|2,0,1]=4 6 B8R0.1 C=CCCC(C)CNC F2147-8859 [0,1,0,0,0,0|2,0,0]=3 7 B8R0.1 C=CCCC(C)CNC F2147-8860 [0,1,0,0,0,0|2,0,0]=3 8 B8R0.1 C=CCCC(F)CNC F2147-5995 [0,1,0,0,0,0|2,0,0]=3 9 B8R0.1 CCCCC(F)CNC F2147-5515 [0,1,0,0,0,0|2,0,0]=3 10 B8R0.1 CNCC(F)CCOC F2147-5765 [0,1,0,0,0,0|3,0,0]=4 11 B8R0.4 C=CCCCCN=[N+]=[N-] F1901-3161 [0,1,0,0,0,0|3,0,0]=4 12 B8R0.4 COCCNCCCN F2187-1238 [0,1,0,0,0,0|2,0,1]=4 13 B8R0.6 C#CCCCC(F)CBr F2147-5942 [0,1,0,0,0,0|2,0,1]=4 14 B8R0.6 C#CCCCC(F)CN F2147-5943 [0,1,0,0,0,0|2,0,1]=4 15 B8R0.6 C#CCCCC(F)CO F2147-5941 [0,1,0,0,0,0|2,0,1]=4 16 B8R0.6 C=CCCCC(F)CBr F2147-6002 [0,1,0,0,0,0|2,0,0]=3 17 B8R0.6 C=CCCCC(F)CN F2147-6003 [0,1,0,0,0,0|2,0,0]=3 18 B8R0.6 C=CCCCC(F)CO F2147-6001 [0,1,0,0,0,0|2,0,0]=3 19 B8R0.6 CCNCCC(C)CC F1911-1829 [0,1,0,0,0,0|2,0,1]=4 20 B8R0.6 CCOCCC(F)CBr F2147-5772 [0,1,0,0,0,0|2,0,1]=4 21 B8R0.6 CCOCCC(F)CN F2147-5773 [0,1,0,0,0,0|2,0,1]=4 22 B8R0.6 CCOCCC(F)CO F2147-5771 [0,1,0,0,0,0|1,0,2]=4 23 B8R0.6 COC(=O)CCCC=O F1913-2954 [0,1,0,0,0,0|1,0,1]=3 24 B8R0.7 C#CCCCNC(C)C F1913-1829 [0,1,0,0,0,0|2,0,1]=4 25 B8R0.7 CC(=O)CCCCCN F1903-0013 [0,1,0,0,0,0|1,0,0]=2 26 B8R0.7 CC(C)COCCCO F2148-2039 [0,1,0,0,0,0|1,0,2]=4 27 B8R0.7 COCCNCC(C)N F1904-0452 [0,1,0,0,0,0|3,0,0]=4 28 B8R1.2 C#CC1CCCCN1 F2167-2867 [0,0,0,1,0,0|2,0,1]=4 29 B8R1.2 C#CC1CCCCO1 F2147-2842 [0,0,0,1,0,0|2,0,1]=4 30 B8R1.2 C#CC1CCCOC1 F2147-2833 [0,0,0,1,0,0|2,0,1]=4 31 B8R1.2 C#CC1CCNCC1 F2147-1861 [0,0,0,1,0,0|2,0,1]=4 32 B8R1.2 C=CC1CCCCN1 F8888-8035 [0,0,0,1,0,0|2,0,0]=3 33 B8R1.2 C=CC1CCNCC1 F8881-4810 [0,0,0,1,0,0|2,0,0]=3 34 B8R1.2 C=CC1CCNCC1 F8887-5174 [0,0,0,1,0,0|2,0,0]=3 35 B8R1.2 C=CC1CNCCO1 F1913-7045 [0,0,0,1,0,0|3,0,0]=4 36 B8R1.2 CC=C1CCCNC1 F8884-6468 [0,0,0,1,0,0|2,0,1]=4 37 B8R1.2 CC=C1CCNCC1 F8884-6465 [0,0,0,1,0,0|2,0,1]=4 38 B8R1.2 CCC1CC=CCN1 F1913-5257 [0,0,0,1,0,0|2,0,1]=4 39 B8R1.2 NOC1CCOCC1 F1913-1605 [0,0,0,1,0,0|3,0,0]=4 40 B8R1.2 NOC1CCOCC1 F8880-8686 [0,0,0,1,0,0|3,0,0]=4 41 B8R1.5 C[C@@H]1CNCCN1C F8886-0200 [0,0,0,1,0,0|3,0,0]=4 42 B8R1.5 O=C1NCCCC1F F2147-8375 [0,0,0,1,0,0|2,0,0]=3 43 B8R1.8 C#CCC1CCNC1 F1913-5174 [0,0,0,1,0,0|2,0,1]=4 44 B8R1.8 C#CCC1CCOC1 F1913-5179 [0,0,0,1,0,0|2,0,1]=4 45 B8R1.8 CNCC1CCCN1 F1911-1650 [0,0,0,1,0,0|2,0,1]=4 46 B8R1.8 CNCC1CCSC1 F2147-4276 [0,0,0,1,0,0|3,0,0]=4 47 B8R1.8 C\C=C\C1CCCN1 F2167-7750 [0,0,0,1,0,0|2,0,1]=4 48 B8R1.8 C\C=C\C1CCNC1 F2167-7751 [0,0,0,1,0,0|2,0,1]=4 49 B8R1.8 N#CCC1CCNC1 F2167-8342 [0,0,0,1,0,0|2,0,1]=4 50 B8R1.8 N#CCC1CCSC1 F2185-0952 [0,0,0,1,0,0|2,0,1]=4 51 B8R1.8 NCCC1CCCS1 F2147-4099 [0,0,0,1,0,0|1,1,1]=4 52 B8R1.8 NCCC1CCSC1 F2147-4105 [0,0,0,1,0,0|2,0,1]=4 53 B8R1.8 NNCC1CCCC1 F1904-0026 [0,0,0,1,0,0|2,0,0]=3 54 B8R1.8 O=CCC1CCOC1 F8880-7241 [0,0,0,1,0,0|1,0,0]=2 55 B8R1.8 OCCC1CCSC1 F2147-4104 [0,0,0,1,0,0|1,0,2]=4 56 B8R1.10 C=CCNC1CCC1 F8882-7150 [0,0,0,1,0,0|2,0,0]=3 57 B8R1.10 C=CCOC1CNC1 F1913-2811 [0,0,0,1,0,0|3,0,0]=4 58 B8R1.10 C=CCOC1CNC1 F2147-1192 [0,0,0,1,0,0|3,0,0]=4 59 B8R1.10 CCCCC1CNC1 F8884-5213 [0,0,0,1,0,0|2,0,0]=3 60 B8R1.10 CCCNC1CCC1 F8882-7148 [0,0,0,1,0,0|2,0,1]=4 61 B8R1.10 CCNCC1CCC1 F8888-1372 [0,0,0,1,0,0|2,0,1]=4 62 B8R1.10 CCNCC1CNC1 F8885-4763 [0,0,0,1,0,0|3,0,0]=4 63 B8R1.10 CNCCC1CCC1 F8885-7790 [0,0,0,1,0,0|2,0,0]=3 64 B8R1.10 COCCC1CNC1 F8887-6268 [0,0,0,1,0,0|3,0,0]=4 65 B8R1.10 COCCC1CNC1 F8888-1515 [0,0,0,1,0,0|3,0,0]=4 66 B8R1.10 N#CCCC1CNC1 F2167-8350 [0,0,0,1,0,0|2,0,1]=4 67 B8R1.10 NCCNC1CCC1 F8882-7404 [0,0,0,1,0,0|2,0,1]=4 68 B8R1.10 OCCOC1CCC1 F8880-0040 [0,0,0,1,0,0|1,0,2]=4 69 B8R1.11 C#CC1CCCN1C F1913-6405 [0,0,0,1,0,0|2,0,1]=4 70 B8R1.11 C#C[C@H]1CCC[C@H]1F F1913-7824 [0,0,0,1,0,0|2,0,1]=4 71 B8R1.11 C=C1CNCC1OC F1913-1751 [0,0,0,1,0,0|3,0,0]=4 72 B8R1.11 CC1CCCC1CN F9995-1054 [0,0,0,1,0,0|1,0,1]=3 73 B8R1.11 CC1CNCC1CF F1907-0971 [0,0,0,1,0,0|2,0,1]=4 74 B8R1.11 CCC1COCC1=O F2167-8875 [0,0,0,1,0,0|1,0,0]=2 75 B8R1.11 CCN1CCOC1=O F2167-7096 [0,0,0,1,0,0|2,0,0]=3 76 B8R1.11 CNC1CCOC1=O F2147-2129 [0,0,0,1,0,0|2,0,0]=3 77 B8R1.11 CN[C@@H]1CCC[C@H]1O F6545-4701 [0,0,0,1,0,0|1,0,2]=4 78 B8R1.11 N#CC1CCCC1N F8889-5854 [0,0,0,1,0,0|2,0,1]=4 79 B8R1.11 NCC1CCCC1O F2147-1890 [0,0,0,1,0,0|1,0,2]=4 80 B8R1.11 NC[C@@H]1CCC[C@H]1O F2147-1912 [0,0,0,1,0,0|1,0,2]=4 81 B8R1.13 CCNC1CCC1F F1910-8210 [0,0,0,1,0,0|2,0,1]=4 82 B8R1.13 CCN[C@@H]1CC[C@H]1O F6619-0539 [0,0,0,1,0,0|1,0,2]=4 83 B8R1.13 CNCC1CCC1C F1913-0555 [0,0,0,1,0,0|2,0,0]=3 84 B8R1.17 C#CC1CC1CNC F1913-1039 [0,0,0,1,0,0|2,0,1]=4 85 B8R1.17 C#CC1CC1CNC F1913-1040 [0,0,0,1,0,0|2,0,1]=4 86 B8R1.17 C#C[C@H]1C[C@@H]1CNC F1913-1115 [0,0,0,1,0,0|2,0,1]=4 87 B8R1.17 CNC[C@H]1C[C@@H]1CF F1913-1129 [0,0,0,1,0,0|2,0,1]=4 88 B8R1.17 CNC[C@H]1C[C@@H]1CO F1913-1131 [0,0,0,1,0,0|1,0,2]=4 89 B8R1.22 CC1CCNCCO1 F8881-5827 [0,0,0,1,0,0|1,0,2]=4 90 B8R1.22 CC1CCNCCS1 F2147-1371 [0,0,0,1,0,0|1,1,1]=4 91 B8R1.22 CC1CNCCOC1 F1905-0581 [0,0,0,1,0,0|3,0,0]=4 92 B8R1.22 CC1CNCCOC1 F8889-8537 [0,0,0,1,0,0|3,0,0]=4 93 B8R1.22 C[C@@H]1CCNCCO1 F1913-5628 [0,0,0,1,0,0|1,0,2]=4 94 B8R1.22 C[C@@H]1CCNCCO1 F1913-5629 [0,0,0,1,0,0|1,0,2]=4 95 B8R1.22 C[C@H]1CCNCCO1 F1913-5626 [0,0,0,1,0,0|1,0,2]=4 96 B8R1.22 C[C@H]1CCNCCO1 F1913-5627 [0,0,0,1,0,0|1,0,2]=4 97 B8R1.22 O=C1CSCCCN1 F2147-3664 [0,0,0,1,0,0|2,0,0]=3 98 B8R1.36 C#CCCNC1CC1 F2147-2115 [0,0,0,1,0,0|2,0,1]=4 99 B8R1.36 C#CCNCC1CC1 F2158-1960 [0,0,0,1,0,0|2,0,1]=4 100 B8R1.36 C=CCCNC1CC1 F1911-1850 [0,0,0,1,0,0|2,0,0]=3 101 B8R1.36 C=CCOCC1CO1 F1995-0410 [0,0,0,1,0,0|3,0,0]=4 102 B8R1.36 CCCCNC1CC1 F8880-3713 [0,0,0,1,0,0|2,0,1]=4 103 B8R1.36 CCNCCC1CC1 F8880-7065 [0,0,0,1,0,0|2,0,1]=4 104 B8R1.36 COCCNC1CC1 F8880-3933 [0,0,0,1,0,0|3,0,0]=4 105 B8R1.36 NCCOCC1CC1 F2167-3699 [0,0,0,1,0,0|2,0,1]=4 106 B8R1.36 OCCNCC1CC1 F2158-1963 [0,0,0,1,0,0|1,0,2]=4 107 B5R0.2 CCNCCF F1913-6491 [2,0,0,0,0,0|2,0,0]=4 108 B5R0.2 NCCCCS F1905-6519 [2,0,0,0,0,0|1,1,0]=4 109 B7R0.3 C=CCCC(C)C=O F2147-8873 [1,1,0,0,0,0|0,0,2]=4 110 B7R0.3 C=CCCC(C)CBr F2147-8856 [1,1,0,0,0,0|1,0,1]=4 111 B7R0.3 C=CCCC(C)CN F2147-8858 [1,1,0,0,0,0|1,0,1]=4 112 B7R0.3 C=CCCC(C)CO F2147-8855 [1,1,0,0,0,0|1,0,1]=4 113 B7R0.3 C=CCCC(F)CBr F2147-5993 [1,1,0,0,0,0|1,0,1]=4 114 B7R0.3 C=CCCC(F)CN F2147-5994 [1,1,0,0,0,0|1,0,1]=4 115 B7R0.3 C=CCCC(F)CO F2147-5992 [1,1,0,0,0,0|1,0,1]=4 116 B7R0.3 C=CCCC(N)CC F2147-8742 [1,1,0,0,0,0|0,0,1]=3 117 B7R0.3 CC(C=O)CCC#N F8888-5611 [1,1,0,0,0,0|1,0,1]=4 118 B7R0.3 CCC(C)CCNC F1911-1828 [1,1,0,0,0,0|1,0,1]=4 119 B7R0.3 CCCCC(F)CBr F1967-2984 [1,1,0,0,0,0|1,0,0]=3 120 B7R0.3 CCCCC(F)CN F2147-5514 [1,1,0,0,0,0|1,0,0]=3 121 B7R0.3 CCCCC(F)CO F2147-5513 [1,1,0,0,0,0|0,0,1]=3 122 B7R0.3 CCNCC(C)CC F8881-5417 [1,1,0,0,0,0|1,0,1]=4 123 B7R0.3 COCCC(F)CBr F2147-5763 [1,1,0,0,0,0|2,0,0]=4 124 B7R0.3 COCCC(F)CN F2147-5764 [1,1,0,0,0,0|2,0,0]=4 125 B7R0.3 COCCC(F)CO F2147-5762 [1,1,0,0,0,0|1,0,1]=4 126 B7R0.3 COCCC(N)CO F8888-3344 [1,1,0,0,0,0|1,0,1]=4 127 B7R0.3 OCCCC(F)CO F2147-5787 [1,1,0,0,0,0|1,0,1]=4 128 B7R0.4 C=C(C)CCCNC F1913-0544 [1,1,0,0,0,0|1,0,1]=4 129 B7R0.4 C=CCCCC(C)N F1913-5300 [1,1,0,0,0,0|0,0,1]=3 130 B7R0.4 C=CCCNC(C)C F1911-1849 [1,1,0,0,0,0|1,0,1]=4 131 B7R0.4 CCCNCC(C)N F1904-0580 [1,1,0,0,0,0|1,0,1]=4 132 B7R0.4 CNCCCC(F)F F2147-6711 [1,1,0,0,0,0|2,0,0]=4 133 B7R0.7 C=CCC(F)CNC F2147-5542 [1,1,0,0,0,0|1,0,1]=4 134 B7R0.7 CCCC(F)CNC F2147-5499 [1,1,0,0,0,0|1,0,1]=4 135 B7R0.7 CCCC(O)CCN F2189-0721 [1,1,0,0,0,0|1,0,0]=3 136 B7R0.7 COCC(O)CCN F2189-0821 [1,1,0,0,0,0|2,0,0]=4 137 B9R0.5 C#CCCCC(F)CNC F2147-5944 [0,2,0,0,0,0|1,0,1]=4 138 B9R0.5 C=CCCCC(F)CNC F2147-6004 [0,2,0,0,0,0|1,0,0]=3 139 B9R0.5 CCOC(=O)CCCC=O F1913-2944 [0,2,0,0,0,0|0,0,1]=3 140 B9R0.5 CCOCCC(F)CNC F2147-5774 [0,2,0,0,0,0|2,0,0]=4 141 B9R0.35 CCOC(=O)C(F)CC=O F1913-0170 [0,2,0,0,0,0|1,0,1]=4 142 B9R0.40 C=CCCC(CC)CNC F2147-8864 [0,2,0,0,0,0|2,0,0]=4 143 B9R0.40 C=CCCC(CC)CNC F2147-8866 [0,2,0,0,0,0|2,0,0]=4 144 B9R0.48 CNCC(F)CCC(C)C F2147-5533 [0,2,0,0,0,0|2,0,0]=4 145 B9R0.66 C=CCCC(C)(C)CNC F2147-6454 [0,2,0,0,0,0|2,0,0]=4 146 B9R0.66 COCC(C)(C)CCC=O F1913-3083 [0,2,0,0,0,0|1,0,0]=3 147 B9R0.45 CCCCCCCN=[N+]=[N-] F1901-3140 [0,2,0,0,0,0|1,0,1]=4 148 B9R0.45 [N-]=[N+]=NCCCCCCN F1905-6479 [0,2,0,0,0,0|2,0,0]=4 149 B9R0.46 COCCCNC(=O)CN F1908-0835 [0,2,0,0,0,0|2,0,0]=4 150 B9R0.20 C#CCCCC(C)(C)C=O F2147-6407 [0,2,0,0,0,0|0,0,2]=4 151 B9R0.20 C=CCCCC(C)(C)C=O F2147-6468 [0,2,0,0,0,0|0,0,2]=4 152 B9R0.20 C=CCCCC(C)(C)CBr F2147-6467 [0,2,0,0,0,0|2,0,0]=4 153 B9R0.20 C=CCCCC(C)(C)CN F2147-6462 [0,2,0,0,0,0|2,0,0]=4 154 B9R0.20 C=CCCCC(C)(C)CO F2147-6466 [0,2,0,0,0,0|2,0,0]=4 155 B9R0.47 C#CCCCC(F)C(=O)O F2147-5940 [0,2,0,0,0,0|0,0,2]=4 156 B9R0.47 C#CCCCC(N)C(=O)O F2147-6623 [0,2,0,0,0,0|0,0,2]=4 157 B9R0.47 C=CCCCC(F)C(=O)O F2147-6000 [0,2,0,0,0,0|0,0,2]=4 158 B9R0.47 C=CCCCC(N)C(=O)O F2147-6652 [0,2,0,0,0,0|0,0,2]=4 159 B9R0.47 C=CCCCC(N)C(C)C F1913-5288 [0,2,0,0,0,0|1,0,0]=3 160 B9R0.47 C=CCCC[C@@H](N)C(C)C F1913-5295 [0,2,0,0,0,0|1,0,0]=3 161 B9R0.47 C=CCCC[C@H](N)C(C)C F1913-5296 [0,2,0,0,0,0|1,0,0]=3 162 B9R0.47 CCCNCC(C)[N+](=O)[O-] F1904-0579 [0,2,0,0,0,0|2,0,0]=4 163 B9R0.47 CCOCCC(F)C(=O)O F2147-5770 [0,2,0,0,0,0|1,0,0]=3 164 B9R0.47 CCOCCC(N)C(=O)O F2147-6583 [0,2,0,0,0,0|1,0,0]=3 165 B9R0.38 CNCCCCC(C)(F)F F2147-8531 [0,2,0,0,0,0|2,0,0]=4 166 B7R1.1 C=CC1CCCN1 F2147-2045 [1,0,0,1,0,0|1,0,1]=4 167 B7R1.1 FCC1CCCN1 F8887-7377 [1,0,0,1,0,0|2,0,0]=4 168 B7R1.1 NCC1CCCS1 F2147-4097 [1,0,0,1,0,0|1,1,0]=4 169 B7R1.1 NCC1CCSC1 F2147-1615 [1,0,0,1,0,0|2,0,0]=4 170 B7R1.1 NOC1CCCC1 F1913-1613 [1,0,0,1,0,0|2,0,0]=4 171 B7R1.3 C=C1CCCNC1 F8881-1787 [1,0,0,1,0,0|1,0,1]=4 172 B7R1.3 C=C1CCCNC1 F8888-3017 [1,0,0,1,0,0|1,0,1]=4 173 B7R1.3 C=C1CCNCC1 F8889-7546 [1,0,0,1,0,0|1,0,1]=4 174 B7R1.3 NC1C=CCCC1 F8888-4627 [1,0,0,1,0,0|1,0,1]=4 175 B7R1.4 CC1COCC1=O F2167-8874 [1,0,0,1,0,0|1,0,0]=3 176 B7R1.4 C[C@@H]1CNC[C@@H]1C F1913-3396 [1,0,0,1,0,0|1,0,1]=4 177 B7R1.4 C[C@H]1CNC[C@@H]1C F1913-3395 [1,0,0,1,0,0|1,0,1]=4 178 B7R1.4 FC1CCCC1Br F1911-2866 [1,0,0,1,0,0|2,0,0]=4 179 B7R1.4 NC1CCCC1Cl F8888-2180 [1,0,0,1,0,0|2,0,0]=4 180 B7R1.4 N[C@@H]1CCC[C@H]1F F1912-2823 [1,0,0,1,0,0|2,0,0]=4 181 B7R1.4 O=C1CCCC1O F8888-4387 [1,0,0,1,0,0|1,0,0]=3 182 B7R1.4 O=C1NCCC1F F2147-8443 [1,0,0,1,0,0|2,0,0]=4 183 B7R1.4 OC1CCCC1F F1905-6475 [1,0,0,1,0,0|1,0,1]=4 184 B7R1.5 CCOC1CC1N F8888-1749 [1,0,0,1,0,0|2,0,0]=4 185 B7R1.5 CCO[C@@H]1C[C@@H]1N F1913-3631 [1,0,0,1,0,0|2,0,0]=4 186 B7R1.5 COC[C@H]1C[C@@H]1N F1913-1125 [1,0,0,1,0,0|2,0,0]=4 187 B7R1.6 CCCC1CNC1 F8884-5060 [1,0,0,1,0,0|1,0,1]=4 188 B7R1.6 CCNC1CCC1 F8888-2427 [1,0,0,1,0,0|1,0,1]=4 189 B7R1.6 NCCC1CSC1 F2147-4274 [1,0,0,1,0,0|2,0,0]=4 190 B7R1.6 NOCC1CCC1 F1913-1611 [1,0,0,1,0,0|2,0,0]=4 191 B7R1.6 NOCC1CCC1 F8884-3381 [1,0,0,1,0,0|2,0,0]=4 192 B7R1.7 CNCCC1CC1 F8880-6305 [1,0,0,1,0,0|1,0,1]=4 193 B7R1.7 FCCNC1CC1 F1913-6486 [1,0,0,1,0,0|2,0,0]=4 194 B7R1.7 NCCCC1CC1 F8881-7723 [1,0,0,1,0,0|1,0,0]=3 195 B7R1.7 NCCNC1CC1 F2147-1530 [1,0,0,1,0,0|2,0,0]=4 196 B7R1.7 NCCOC1CC1 F2167-3710 [1,0,0,1,0,0|2,0,0]=4 197 B7R1.8 CC1CCC1CN F1913-0554 [1,0,0,1,0,0|1,0,0]=3 198 B7R1.8 CC1CCC1CO F1913-0553 [1,0,0,1,0,0|0,0,1]=3 199 B7R1.8 CNC1CCC1F F1910-8220 [1,0,0,1,0,0|2,0,0]=4 200 B7R1.8 CN[C@@H]1CC[C@H]1O F6619-0597 [1,0,0,1,0,0|1,0,1]=4 201 B7R1.9 NC[C@@H]1C[C@@H]1CO F1913-6685 [1,0,0,1,0,0|1,0,1]=4 202 B7R1.9 NC[C@@H]1C[C@@H]1CO F1913-6686 [1,0,0,1,0,0|1,0,1]=4 203 B7R1.9 NC[C@H]1C[C@@H]1CF F1913-1128 [1,0,0,1,0,0|2,0,0]=4 204 B7R1.9 NC[C@H]1C[C@@H]1CO F1913-1130 [1,0,0,1,0,0|1,0,1]=4 205 B7R1.9 NC[C@H]1C[C@H]1CN F1913-6678 [1,0,0,1,0,0|2,0,0]=4 206 B7R1.9 NC[C@H]1C[C@H]1CN F1913-6679 [1,0,0,1,0,0|2,0,0]=4 207 B7R1.9 OC[C@@H]1C[C@H]1CO F1913-6662 [1,0,0,1,0,0|1,0,1]=4 208 B7R1.9 OC[C@H]1C[C@@H]1CF F1913-1127 [1,0,0,1,0,0|1,0,1]=4 209 B7R1.9 OC[C@H]1C[C@H]1CO F1913-6677 [1,0,0,1,0,0|1,0,1]=4 210 B7R1.24 C1CNCCSC1 F2147-1370 [1,0,0,1,0,0|1,1,0]=4 211 B9R1.2 NCC1CCNC(=O)O1 F1913-1140 [0,1,0,1,0,0|2,0,0]=4 212 B9R1.2 O=C1CCCC(CCl)O1 F1913-3311 [0,1,0,1,0,0|1,0,0]=3 213 B9R1.2 O=C1COCC(CO)N1 F2147-2890 [0,1,0,1,0,0|2,0,0]=4 214 B9R1.2 O=C1NCCC(CBr)O1 F1913-1138 [0,1,0,1,0,0|2,0,0]=4 215 B9R1.2 O=C1NCCC(CO)O1 F1913-1136 [0,1,0,1,0,0|2,0,0]=4 216 B9R1.2 O=C1NCC[C@@H](CO)O1 F1913-7444 [0,1,0,1,0,0|2,0,0]=4 217 B9R1.2 O=C1NCC[C@H](CO)O1 F1913-7443 [0,1,0,1,0,0|2,0,0]=4 218 B9R1.7 COCC1CCC(N)C1 F2147-2975 [0,1,0,1,0,0|2,0,0]=4 219 B9R1.7 CSC[C@H]1CC[C@@H](N)C1 F1913-6206 [0,1,0,1,0,0|2,0,0]=4 220 B9R1.7 N#CC[C@H]1CC[C@@H](N)C1 F2147-2757 [0,1,0,1,0,0|1,0,1]=4 221 B9R1.7 NCCC1CNC(=O)C1 F2147-1996 [0,1,0,1,0,0|2,0,0]=4 222 B9R1.7 O=C1CC(CCO)CN1 F2147-1995 [0,1,0,1,0,0|2,0,0]=4 223 B9R1.8 C#CCC1CCCNC1 F1913-5176 [0,1,0,1,0,0|1,0,1]=4 224 B9R1.8 C#CCC1CCNCC1 F1913-5172 [0,1,0,1,0,0|1,0,1]=4 225 B9R1.8 C#CCC1CCOCC1 F1913-5180 [0,1,0,1,0,0|1,0,1]=4 226 B9R1.8 CCCC1CCCNC1 F2167-1864 [0,1,0,1,0,0|1,0,1]=4 227 B9R1.8 CCCC1CCCNC1 F8881-5623 [0,1,0,1,0,0|1,0,1]=4 228 B9R1.8 CNCC1CCCCN1 F1911-1644 [0,1,0,1,0,0|1,0,1]=4 229 B9R1.8 CNCC1CCCNC1 F1911-1656 [0,1,0,1,0,0|2,0,0]=4 230 B9R1.8 CSCC1CCCCN1 F2167-0588 [0,1,0,1,0,0|1,0,1]=4 231 B9R1.8 C\C=C\C1CCCCN1 F2167-7743 [0,1,0,1,0,0|1,0,1]=4 232 B9R1.8 C\C=C\C1CCCNC1 F2167-7744 [0,1,0,1,0,0|1,0,1]=4 233 B9R1.8 C\C=C\C1CCNCC1 F2167-7745 [0,1,0,1,0,0|1,0,1]=4 234 B9R1.8 C\C=C\C1CCNCC1 F2197-5069 [0,1,0,1,0,0|1,0,1]=4 235 B9R1.8 FCCC1CCNCC1 F1907-0962 [0,1,0,1,0,0|1,0,1]=4 236 B9R1.8 NNCC1CCOCC1 F8881-4120 [0,1,0,1,0,0|2,0,0]=4 237 B9R1.8 OCCC1CCOCC1 F1913-7206 [0,1,0,1,0,0|0,0,2]=4 238 B9R1.9 CNCCC1CC(O)C1 F1913-1204 [0,1,0,1,0,0|2,0,0]=4 239 B9R1.9 CNCCC1CC(O)C1 F1913-1205 [0,1,0,1,0,0|2,0,0]=4 240 B9R1.12 BrCCOC1CCCC1 F8889-4580 [0,1,0,1,0,0|1,0,1]=4 241 B9R1.12 C#CCNC1CCCC1 F8881-5113 [0,1,0,1,0,0|1,0,1]=4 242 B9R1.12 C=CCNC1CCOC1 F8888-3769 [0,1,0,1,0,0|2,0,0]=4 243 B9R1.12 C=CCOC1CCNC1 F8881-4953 [0,1,0,1,0,0|2,0,0]=4 244 B9R1.12 C=CCOC1CCNC1 F8887-7769 [0,1,0,1,0,0|2,0,0]=4 245 B9R1.12 CCCCC1CCNC1 F2167-8065 [0,1,0,1,0,0|1,0,1]=4 246 B9R1.12 CCNCC1CCCC1 F8885-5894 [0,1,0,1,0,0|1,0,1]=4 247 B9R1.12 CCNCC1CCCN1 F1911-1651 [0,1,0,1,0,0|1,0,1]=4 248 B9R1.12 CCOCC1CCNC1 F8889-6576 [0,1,0,1,0,0|2,0,0]=4 249 B9R1.12 CCSCC1CCCN1 F2167-0497 [0,1,0,1,0,0|1,0,1]=4 250 B9R1.12 CNCCC1CCOC1 F2147-4123 [0,1,0,1,0,0|2,0,0]=4 251 B9R1.12 CNCCC1CCSC1 F2147-4106 [0,1,0,1,0,0|2,0,0]=4 252 B9R1.12 COCCC1CCNC1 F8881-3544 [0,1,0,1,0,0|2,0,0]=4 253 B9R1.12 CSCCC1CCNC1 F2147-3827 [0,1,0,1,0,0|2,0,0]=4 254 B9R1.12 N#CCCC1CCCN1 F2167-8352 [0,1,0,1,0,0|1,0,1]=4 255 B9R1.12 N#CCCC1CCCO1 F8883-1569 [0,1,0,1,0,0|1,0,1]=4 256 B9R1.12 N#CCCC1CCNC1 F2167-8353 [0,1,0,1,0,0|1,0,1]=4 257 B9R1.15 C#C[C@H]1CCCC[C@@H]1O F1912-1667 [0,1,0,1,0,0|1,0,1]=4 258 B9R1.15 C#C[C@H]1CCCC[C@H]1N F2147-2816 [0,1,0,1,0,0|1,0,1]=4 259 B9R1.15 CC1OCCCC1CO F8884-4721 [0,1,0,1,0,0|0,0,2]=4 260 B9R1.15 CCC1CCCNC1=O F1913-7612 [0,1,0,1,0,0|0,0,0]=2 261 B9R1.15 NCC1CCCNC1=O F8887-7819 [0,1,0,1,0,0|1,0,0]=3 262 B9R1.33 C#CCC1CCCC1=O F8882-5642 [0,1,0,1,0,0|0,0,1]=3 263 B9R1.33 C#CCC1CCCC1O F8883-2005 [0,1,0,1,0,0|1,0,1]=4 264 B9R1.33 C=CCC1CCCC1O F8882-8208 [0,1,0,1,0,0|1,0,0]=3 265 B9R1.33 CCN[C@@H]1CCC[C@H]1O F6545-4623 [0,1,0,1,0,0|0,0,2]=4 266 B9R1.33 COCC1CNCC1C F1907-6434 [0,1,0,1,0,0|2,0,0]=4 267 B9R1.33 O=C1COCC1CCF F1913-7697 [0,1,0,1,0,0|1,0,0]=3 268 B9R1.48 CC1CC(=O)NCCN1 F8880-2316 [0,1,0,1,0,0|2,0,0]=4 269 B9R1.49 CC1CCNC(=O)CO1 F1913-2480 [0,1,0,1,0,0|2,0,0]=4 270 B9R1.49 NC1CCOC(=O)CC1 F2147-2083 [0,1,0,1,0,0|1,0,0]=3 271 B9R1.49 O=C1CCC(O)CCO1 F2147-2084 [0,1,0,1,0,0|1,0,0]=3 272 B9R1.69 CN1CC(O)CCC1=O F1911-5597 [0,1,0,1,0,0|1,0,0]=3 273 B9R1.69 CN1C[C@@H](O)CCC1=O F1911-5598 [0,1,0,1,0,0|1,0,0]=3 274 B9R1.69 CN1C[C@H](O)CCC1=O F1911-5599 [0,1,0,1,0,0|1,0,0]=3 275 B9R1.73 CNCC(F)C1CCC1 F2147-5901 [0,1,0,1,0,0|2,0,0]=4 276 B9R1.73 NCCC(O)C1CCC1 F2189-0826 [0,1,0,1,0,0|1,0,1]=4 277 B9R1.75 CNCC(F)CC1CC1 F2147-5865 [0,1,0,1,0,0|2,0,0]=4 278 B9R1.117 C=CCCC1(F)CNC1 F2147-5999 [0,1,0,1,0,0|2,0,0]=4 279 B9R1.117 CCCCC1(F)CNC1 F2147-5519 [0,1,0,1,0,0|2,0,0]=4 280 B9R1.117 CNCCC1(C)CCC1 F1913-0130 [0,1,0,1,0,0|2,0,0]=4 281 B9R1.134 C#CCC1(O)CCCC1 F8883-3178 [0,1,0,1,0,0|1,0,1]=4 282 B9R1.134 CNCC1(F)CCCC1 F1912-3124 [0,1,0,1,0,0|2,0,0]=4 283 B9R1.134 CNCC1(N)CCCC1 F1911-1681 [0,1,0,1,0,0|2,0,0]=4 284 B9R1.134 CNCC1(O)CCCC1 F8889-2898 [0,1,0,1,0,0|2,0,0]=4 285 B9R1.173 C=CCC1(O)CCC1F F1910-8047 [0,1,0,1,0,0|2,0,0]=4 286 B9R1.5 CC1CSCCNC1=O F2147-1410 [0,1,0,1,0,0|1,0,0]=3 287 B9R1.5 O=C1CCCCC=C1F F2167-4818 [0,1,0,1,0,0|0,0,2]=4 288 B9R1.14 C#CC1CCCN1CC F1913-6406 [0,1,0,1,0,0|1,0,1]=4 289 B9R1.14 C#C[C@@H]1CCC[C@H]1OC F1913-7822 [0,1,0,1,0,0|1,0,1]=4 290 B9R1.14 CNC1CCCC1NC F2185-0788 [0,1,0,1,0,0|2,0,0]=4 291 B9R1.17 C=CCCNC1CCC1 F1911-1852 [0,1,0,1,0,0|1,0,0]=3 292 B9R1.17 CCCCCC1CNC1 F8888-2316 [0,1,0,1,0,0|1,0,1]=4 293 B9R1.17 CCCCNC1CCC1 F1911-1669 [0,1,0,1,0,0|1,0,1]=4 294 B9R1.17 CCNCCC1CCC1 F1911-1671 [0,1,0,1,0,0|1,0,1]=4 295 B9R1.17 COCCCC1CNC1 F2167-8076 [0,1,0,1,0,0|2,0,0]=4 296 B9R1.17 COCCNC1CCC1 F1907-0834 [0,1,0,1,0,0|2,0,0]=4 297 B9R1.17 N#CCCCC1CNC1 F2167-7192 [0,1,0,1,0,0|1,0,1]=4 298 B9R1.39 C=CCNC1CCC1F F1910-8114 [0,1,0,1,0,0|2,0,0]=4 299 B9R1.39 C=CCN[C@H]1CC[C@@H]1O F6619-1305 [0,1,0,1,0,0|2,0,0]=4 300 B9R1.39 CCCNC1CCC1F F1910-8113 [0,1,0,1,0,0|1,0,1]=4 301 B9R1.39 CCCN[C@@H]1CC[C@H]1O F6619-0442 [0,1,0,1,0,0|0,0,2]=4 302 B9R1.83 C#CCCCNC1CC1 F1913-1830 [0,1,0,1,0,0|1,0,1]=4 303 B9R1.89 CCC1CCC=CCN1 F1913-5258 [0,1,0,1,0,0|1,0,1]=4 304 B9R1.89 CCC1CCCCCN1 F8880-5088 [0,1,0,1,0,0|1,0,1]=4 305 B9R1.89 CCC1CCNCCO1 F1913-2476 [0,1,0,1,0,0|0,0,2]=4 306 B9R1.89 CCC1CCNCCO1 F1913-2477 [0,1,0,1,0,0|0,0,2]=4 307 B9R1.89 C\C=C1\CCCNCC1 F2167-7748 [0,1,0,1,0,0|1,0,1]=4 308 B9R1.89 FCC1CCCNCC1 F1913-6939 [0,1,0,1,0,0|1,0,1]=4 309 B9R1.89 FCC1CCCNCC1 F1913-7547 [0,1,0,1,0,0|1,0,1]=4 310 B9R1.89 OCC1CCCNCC1 F8881-2497 [0,1,0,1,0,0|0,0,2]=4 311 B9R1.1 C#C[C@H]1CC[C@@H](N)CC1 F1913-6450 [0,1,0,1,0,0|1,0,1]=4 312 B9R1.1 C#C[C@H]1CC[C@H](N)CC1 F2147-2822 [0,1,0,1,0,0|1,0,1]=4 313 B9R1.1 CC=C1CCC(N)CC1 F2167-7746 [0,1,0,1,0,0|1,0,1]=4 314 B9R1.1 CN1CCC(C=O)CC1 F2167-0153 [0,1,0,1,0,0|1,0,0]=3 315 B9R1.1 CO[C@H]1CC[C@H](N)CC1 F1913-7613 [0,1,0,1,0,0|2,0,0]=4 316 B9R1.11 FC(CBr)C1CCCC1 F2147-5585 [0,1,0,1,0,0|1,0,1]=4 317 B9R1.11 NCC(F)C1CCCC1 F1967-9929 [0,1,0,1,0,0|1,0,1]=4 318 B9R1.11 OCC(F)C1CCCC1 F2147-5584 [0,1,0,1,0,0|0,0,2]=4 319 B9R1.79 FC(CBr)CC1CCC1 F2147-5872 [0,1,0,1,0,0|1,0,1]=4 320 B9R1.79 OCC(F)CC1CCC1 F2147-5871 [0,1,0,1,0,0|0,0,2]=4 321 B9R1.118 FC1(CBr)CCCCC1 F1911-2873 [0,1,0,1,0,0|1,0,1]=4 322 B9R1.118 NC1(CCl)CCCCC1 F2185-0714 [0,1,0,1,0,0|1,0,1]=4 323 B9R1.118 NCC1(F)CCCCC1 F8888-2355 [0,1,0,1,0,0|1,0,1]=4 324 B9R1.118 OC1(CBr)CCCCC1 F8884-9180 [0,1,0,1,0,0|1,0,1]=4 325 B9R1.132 CN1CCC(CN)C1=O F2147-3817 [0,1,0,1,0,0|2,0,0]=4 326 B9R1.202 CC1(CO)CCNC1=O F1913-7522 [0,1,0,1,0,0|2,0,0]=4 327 B9R1.202 CCC1(C)CCCC1=O F2167-7957 [0,1,0,1,0,0|0,0,0]=2 328 B9R1.13 NC(=O)OC1CCNC1 F2147-2038 [0,1,0,1,0,0|2,0,0]=4 329 B9R1.13 O=C(O)CC1CCCS1 F2147-4096 [0,1,0,1,0,0|1,0,0]=3 330 B9R1.24 CC1(C)CCCC1C#N F2167-0100 [0,1,0,1,0,0|1,0,1]=4 331 B9R1.24 NCC1CCCS1(=O)=O F2147-4102 [0,1,0,1,0,0|2,0,0]=4 332 B9R1.40 CC1(N)CCCNC1=O F1913-7530 [0,1,0,1,0,0|1,0,0]=3 333 B9R1.41 CC(C)C1CCCC1=O F8881-2940 [0,1,0,1,0,0|0,0,0]=2 334 B9R1.41 CC1NCCC1C(=O)O F1913-1553 [0,1,0,1,0,0|1,0,0]=3 335 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O F1913-3325 [0,1,0,1,0,0|2,0,0]=4 336 B9R1.41 O=C(O)[C@H]1CNC[C@H]1F F1913-3322 [0,1,0,1,0,0|2,0,0]=4 337 B9R1.84 CC(C)CCC1CNC1 F8884-5210 [0,1,0,1,0,0|2,0,0]=4 338 B9R1.84 O=C(O)C=CC1CCC1 F8889-4987 [0,1,0,1,0,0|0,0,2]=4 339 B9R1.84 O=C(O)CCC1CNC1 F2158-1592 [0,1,0,1,0,0|1,0,0]=3 340 B9R1.84 O=C(O)CNC1COC1 F2147-5216 [0,1,0,1,0,0|2,0,0]=4 341 B9R1.148 CC1(C)CCCCNC1 F2148-0047 [0,1,0,1,0,0|2,0,0]=4 342 B9R1.148 O=S1(=O)CCCNCC1 F8881-5809 [0,1,0,1,0,0|2,0,0]=4 343 B9R2.53 O=C1C2CNCC1C2 F8880-2954 [0,0,0,2,0,0|1,0,0]=3 344 B9R2.56 O=CC12COCC1C2 F2147-3648 [0,0,0,2,0,0|1,0,0]=3 345 B9R2.174 C1CNCC2(C1)CC2 F2148-0043 [0,0,0,2,0,0|2,0,0]=4 346 B9R2.17 NC12CC1COC2=O F2147-3037 [0,0,0,2,0,0|2,0,0]=4 347 B9R2.39 NN1CC2CCC1C2 F1908-0393 [0,0,0,2,0,0|2,0,0]=4 348 B9R2.109 NC1CCCC2CC12 F8889-8593 [0,0,0,2,0,0|1,0,1]=4 349 B9R2.1 NC1CC12CCCC2 F2148-2155 [0,0,0,2,0,0|1,0,1]=4 350 B9R2.1 NC1CC12CCCC2 F8887-5069 [0,0,0,2,0,0|1,0,1]=4 351 B9R2.3 C1CC2=[N+](C1)CCC2 F1913-6622 [0,0,0,2,0,0|2,0,0]=4 352 B9R2.7 O=C1CC2CCCC12 F8884-9269 [0,0,0,2,0,0|0,0,0]=2 353 B9R2.173 C1CCC2(C1)CNC2 F8880-6988 [0,0,0,2,0,0|2,0,0]=4 354 B9R2.91 C1CC(C2CNC2)C1 F2167-4511 [0,0,0,2,0,0|2,0,0]=4 355 B9R2.140 CC1CCC12CNC2 F2147-2725 [0,0,0,2,0,0|2,0,0]=4 356 B9R2.157 C1CC1CC2CNC2 F8882-9451 [0,0,0,2,0,0|2,0,0]=4 357 B9R2.5 OC1CCCC12CC2 F1913-1852 [0,0,0,2,0,0|0,0,2]=4 358 B9R2.48 CNC1CCC12CC2 F2147-4388 [0,0,0,2,0,0|2,0,0]=4