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[1,0,0,0,0,0|2,0,0]=3 57 B6R0.1 CCNC(C)CO m_269862__7865270__15157990 [1,0,0,0,0,0|1,0,0]=2 58 B6R0.1 CCN[C@H](C)CF m_270004__13811084__24715004 [1,0,0,0,0,0|2,0,0]=3 59 B6R0.1 CCN[C@H](C)CN m_269982__22505378__7393392 [1,0,0,0,0,0|2,0,0]=3 60 B6R0.1 CCN[C@H](C)CO m_2230__22399532__22383854 [1,0,0,0,0,0|1,0,0]=2 61 B6R0.1 CCS(=O)CCO m_265282__7088216__4273536 [1,0,0,0,0,0|1,1,0]=3 62 B6R0.1 CCSC(C)C#N m_7__22987770__6057 [1,0,0,0,0,0|2,0,1]=4 63 B6R0.1 CCSC(C)CC m_7__22987770__14247828 [1,0,0,0,0,0|2,0,0]=3 64 B6R0.1 CCSC(C)CO m_7__6338928__5047 [1,0,0,0,0,0|1,0,0]=2 65 B6R0.1 CCS[C@@H](C)CN m_7__20871330__5047 [1,0,0,0,0,0|2,0,0]=3 66 B6R0.1 CC[C@H](N)CSC m_7__20871354__5046 [1,0,0,0,0,0|3,0,0]=4 67 B6R0.1 CNC(=O)CCO m_487__150425__12879784 [1,0,0,0,0,0|1,1,1]=4 68 B6R0.1 CNC(C)CCN m_269982__22505446__14064228 [1,0,0,0,0,0|3,0,0]=4 69 B6R0.1 CNC(C)CCO m_2230__22400640__2463448 [1,0,0,0,0,0|2,0,0]=3 70 B6R0.1 CNC(C)CSC m_269862__7193148__16464016 [1,0,0,0,0,0|3,0,0]=4 71 B6R0.1 CNCC(C)NC m_269982__22505308__14064228 [1,0,0,0,0,0|3,0,0]=4 72 B6R0.1 CN[C@H](C)CCF m_2230__22404666__2463448 [1,0,0,0,0,0|3,0,0]=4 73 B6R0.1 CN[C@H](C)COC m_2230__22399844__2463448 [1,0,0,0,0,0|3,0,0]=4 74 B6R0.1 COC(C)CSC m_62__8635200__876088 [1,0,0,0,0,0|3,0,0]=4 75 B6R0.1 COCC(=NO)C m_4__388124__2677716 [1,0,0,0,0,0|2,0,1]=4 76 B6R0.1 COCC(C)SC m_62__6339274__876088 [1,0,0,0,0,0|3,0,0]=4 77 B6R0.1 CON(C)CCO m_2230__9111768__2463448 [1,0,0,0,0,0|3,0,0]=4 78 B6R0.1 CSC(C)CCO m_7__5819074__5046 [1,0,0,0,0,0|2,0,0]=3 79 B6R0.1 CSCC(=NO)C m_4__388124__15781872 [1,0,0,0,0,0|2,0,1]=4 80 B6R0.1 CSCC(C)CO m_7__6078536__5046 [1,0,0,0,0,0|1,0,0]=2 81 B6R0.1 CSCC(O)CO m_7__6554250__5046 [1,0,0,0,0,0|2,0,0]=3 82 B6R0.3 CC(=NO)C(C)C m_4__388124__66897 [1,0,0,0,0,0|2,0,1]=4 83 B6R0.3 CC(CF)N(C)C m_2230__22408738__2463448 [1,0,0,0,0,0|3,0,0]=4 84 B6R0.3 CC(CO)C(=O)N m_22__58357__16784146 [1,0,0,0,0,0|1,1,1]=4 85 B6R0.3 CCC(=O)N(C)C m_270062__7630680__22005658 [1,0,0,0,0,0|1,1,1]=4 86 B6R0.3 CCC(C)N(C)C m_2230__7462418__2463448 [1,0,0,0,0,0|2,0,0]=3 87 B6R0.3 CCN(C)C(C)C m_270004__8128012__24715004 [1,0,0,0,0,0|2,0,0]=3 88 B6R0.3 CNC(=O)C(C)C m_270062__7630660__13861800 [1,0,0,0,0,0|1,1,1]=4 89 B6R0.3 CNC(=O)[C@@H](C)O m_22__387492__17541882 [1,0,0,0,0,0|1,1,1]=4 90 B6R0.3 CNC(C)C(C)F m_2230__22400592__2463448 [1,0,0,0,0,0|3,0,0]=4 91 B6R0.3 CNC(C)C(C)N m_269982__22505178__14064228 [1,0,0,0,0,0|3,0,0]=4 92 B6R0.3 CNC(C)C(C)O m_269862__7193148__13817824 [1,0,0,0,0,0|2,0,0]=3 93 B6R0.3 CN[C@H](C)[C@H](C)O m_2230__22400278__2463448 [1,0,0,0,0,0|2,0,0]=3 94 B6R0.3 COC(=O)C(C)C m_276436__14076652__14088334 [1,0,0,0,0,0|1,1,1]=4 95 B6R0.3 CON(C)C(C)C m_2230__679026__680832 [1,0,0,0,0,0|3,0,0]=4 96 B6R0.3 CSC(C)C(C)C m_7__6286942__5046 [1,0,0,0,0,0|2,0,0]=3 97 B6R0.3 CSC(C)C(C)O m_7__6286572__5046 [1,0,0,0,0,0|2,0,0]=3 98 B8R0.2 CC(=O)N(C)C(C)CO m_270062__16415470__15585492 [0,1,0,0,0,0|2,0,1]=4 99 B8R0.2 CC(=O)N(C)[C@H](C)CO m_527__9967428__156031 [0,1,0,0,0,0|2,0,1]=4 100 B8R0.2 CC(C)N(C)C(C)CO m_2230__7785428__680832 [0,1,0,0,0,0|2,0,0]=3 101 B8R0.2 CC(CO)C(=O)N(C)C m_22__387202__16784146 [0,1,0,0,0,0|1,1,1]=4 102 B8R0.2 CC(CO)C(=O)N(C)N m_240690__21583792__21409940 [0,1,0,0,0,0|1,1,1]=4 103 B8R0.2 CCC(C)C(C)C(=O)N m_22__58357__8601416 [0,1,0,0,0,0|1,0,2]=4 104 B8R0.2 CCC(O)C(C)C(=O)N m_22__58357__11968256 [0,1,0,0,0,0|0,1,2]=4 105 B8R0.2 CCN(C)C(C)C(C)C m_2230__2161930__2463448 [0,1,0,0,0,0|3,0,0]=4 106 B8R0.2 CCN(C)C(C)C(F)F m_270004__17523488__24715004 [0,1,0,0,0,0|3,0,0]=4 107 B8R0.2 CCS(=O)C(C)C(C)C m_265282__6286948__4273536 [0,1,0,0,0,0|2,1,0]=4 108 B8R0.2 CNC(C)C(C)C(=O)O m_270122__11340508__14683938 [0,1,0,0,0,0|2,0,1]=4 109 B8R0.2 CNC(C)C(O)C(C)C m_2230__22400674__2463448 [0,1,0,0,0,0|2,1,0]=4 110 B8R0.3 C#CCC(C)N(C)CC m_2230__16637570__22383854 [0,1,0,0,0,0|3,0,0]=4 111 B8R0.3 C=CCC(C)C(C)NC m_269862__7193148__7201218 [0,1,0,0,0,0|3,0,0]=4 112 B8R0.3 C=CCN(C)C(C)CC m_2230__7462418__680312 [0,1,0,0,0,0|3,0,0]=4 113 B8R0.3 C=CCN(C)C(C)CO m_2230__7785428__680312 [0,1,0,0,0,0|2,0,1]=4 114 B8R0.3 CC(CF)N(C)CCF m_2230__22408738__22320836 [0,1,0,0,0,0|3,0,0]=4 115 B8R0.3 CC(CF)N(C)CCO m_2230__22408738__6165700 [0,1,0,0,0,0|3,0,0]=4 116 B8R0.3 CC(CN)N(C)CCN m_269982__10894792__13769420 [0,1,0,0,0,0|3,0,0]=4 117 B8R0.3 CC(CN)N(C)CCO m_269982__22515300__13769420 [0,1,0,0,0,0|3,0,0]=4 118 B8R0.3 CC(CO)N(C)CC#N m_2230__7785428__680932 [0,1,0,0,0,0|2,0,1]=4 119 B8R0.3 CC(CO)N(C)CCF m_2230__7785428__22320836 [0,1,0,0,0,0|2,0,0]=3 120 B8R0.3 CC(CO)N(C)CCO m_2230__7785428__6165700 [0,1,0,0,0,0|2,0,0]=3 121 B8R0.3 CCC(=O)N(C)CCO m_270062__12125918__22005658 [0,1,0,0,0,0|1,1,1]=4 122 B8R0.3 CCC(C)C(=NOC)C m_4__461206__66795 [0,1,0,0,0,0|2,0,1]=4 123 B8R0.3 CCC(C)N(C)CC#N m_2230__3014482__14247836 [0,1,0,0,0,0|3,0,0]=4 124 B8R0.3 CCC(C)N(C)CCF m_2230__7462418__22320836 [0,1,0,0,0,0|3,0,0]=4 125 B8R0.3 CCC(C)N(C)CCN m_269982__10894792__14247844 [0,1,0,0,0,0|3,0,0]=4 126 B8R0.3 CCC(C)N(C)CCO m_2230__10210864__2463448 [0,1,0,0,0,0|2,0,0]=3 127 B8R0.3 CCCC(C)C(=NO)C m_4__388124__16645810 [0,1,0,0,0,0|2,0,1]=4 128 B8R0.3 CCCC(C)C(C)NC m_269862__7193148__16645812 [0,1,0,0,0,0|3,0,0]=4 129 B8R0.3 CCCC(C)N(C)CC m_2230__679538__22383854 [0,1,0,0,0,0|3,0,0]=4 130 B8R0.3 CCCN(C)C(C)CC m_2230__2261920__14247836 [0,1,0,0,0,0|3,0,0]=4 131 B8R0.3 CCCN(C)C(C)CF m_2230__2261920__22994052 [0,1,0,0,0,0|3,0,0]=4 132 B8R0.3 CCCN(C)C(C)CO m_2230__7785428__13271112 [0,1,0,0,0,0|2,0,0]=3 133 B8R0.3 CCN(C)C(C)CC#N m_2230__7080758__22383854 [0,1,0,0,0,0|3,0,0]=4 134 B8R0.3 CCN(C)C(C)CCO m_2230__11733728__22383854 [0,1,0,0,0,0|2,0,0]=3 135 B8R0.3 CCN(C)C(C)CNC m_269982__22505106__7393392 [0,1,0,0,0,0|3,0,0]=4 136 B8R0.3 CCN(C)C(C)COC m_2230__2023062__2463448 [0,1,0,0,0,0|2,0,0]=3 137 B8R0.3 CCN(C)C(C)CSC m_2230__5137432__22383854 [0,1,0,0,0,0|2,1,0]=4 138 B8R0.3 CCN(C)[C@@H](C)COC m_2230__22408216__22383854 [0,1,0,0,0,0|2,0,0]=3 139 B8R0.3 CCN(C)[C@H](C)CCO m_2230__22409128__22383854 [0,1,0,0,0,0|2,0,0]=3 140 B8R0.3 CCNC(=O)C(C)CBr m_527__154305__22606894 [0,1,0,0,0,0|1,1,1]=4 141 B8R0.3 CCNC(=O)C(C)CC m_22__57815__505562 [0,1,0,0,0,0|1,1,1]=4 142 B8R0.3 CCNC(=O)C(C)CN m_270006__8379230__11616078 [0,1,0,0,0,0|1,1,1]=4 143 B8R0.3 CCNC(=O)C(C)CO m_22__57815__16784146 [0,1,0,0,0,0|0,1,1]=3 144 B8R0.3 CCNC(=O)C(N)CO m_240690__7350950__12887534 [0,1,0,0,0,0|1,1,1]=4 145 B8R0.3 CCNC(=O)[C@H](N)CO m_240690__7350950__12297580 [0,1,0,0,0,0|1,1,1]=4 146 B8R0.3 CCNC(C)C(C)CC m_2230__8270336__22383854 [0,1,0,0,0,0|2,0,0]=3 147 B8R0.3 CCNC(C)C(C)CO m_2230__8740410__22383854 [0,1,0,0,0,0|1,0,0]=2 148 B8R0.3 CCNC(C)C(C)OC m_269862__7865270__7201638 [0,1,0,0,0,0|3,0,0]=4 149 B8R0.3 CCNC(C)C(C)SC m_270004__23853532__24715004 [0,1,0,0,0,0|3,0,0]=4 150 B8R0.3 CCNC(C)C(O)CC m_2230__22403482__22383854 [0,1,0,0,0,0|1,1,0]=3 151 B8R0.3 CCN[C@@H](C)[C@H](C)OC m_2230__22397856__22383854 [0,1,0,0,0,0|3,0,0]=4 152 B8R0.3 CCN[C@@H](C)[C@H](N)CO m_269982__22505312__7393392 [0,1,0,0,0,0|2,0,0]=3 153 B8R0.3 CCOC(=O)C(C)CBr m_1458__22606896__1327610 [0,1,0,0,0,0|1,1,1]=4 154 B8R0.3 CCOC(=O)C(C)CC m_1458__475836__1327610 [0,1,0,0,0,0|1,1,1]=4 155 B8R0.3 CCOC(=O)C(C)CF m_1458__12111298__1327610 [0,1,0,0,0,0|1,1,1]=4 156 B8R0.3 CCSC(C)C(=O)CC m_7__22987770__1044276 [0,1,0,0,0,0|1,1,1]=4 157 B8R0.3 CCSC(C)C(C)CC m_7__22987770__10953804 [0,1,0,0,0,0|2,0,0]=3 158 B8R0.3 CCSC(C)C(C)CO m_7__22987758__5047 [0,1,0,0,0,0|1,0,0]=2 159 B8R0.3 CCSC(C)C(C)OC m_7__22988026__5047 [0,1,0,0,0,0|3,0,0]=4 160 B8R0.3 CNC(=O)C(C)CCO m_22__387492__14468656 [0,1,0,0,0,0|1,1,1]=4 161 B8R0.3 CNC(=O)C(C)COC m_22__387492__3308154 [0,1,0,0,0,0|1,1,1]=4 162 B8R0.3 CNC(C)C(C)COC m_2230__22400724__2463448 [0,1,0,0,0,0|2,0,0]=3 163 B8R0.3 CNNC(=O)C(C)CO m_240690__21584010__21409940 [0,1,0,0,0,0|1,1,1]=4 164 B8R0.3 COCC(C)C(=NO)C m_4__388124__8365614 [0,1,0,0,0,0|2,0,1]=4 165 B8R0.3 COCC(C)C(=O)OC m_276436__14076652__14094312 [0,1,0,0,0,0|1,1,1]=4 166 B8R0.3 COCC(C)N(C)OC m_2230__679026__12365980 [0,1,0,0,0,0|3,0,0]=4 167 B8R0.3 CON(C)C(C)CCO m_2230__679026__13397858 [0,1,0,0,0,0|3,0,0]=4 168 B8R0.3 CONC(=O)C(C)CO m_22__461212__16784146 [0,1,0,0,0,0|1,1,1]=4 169 B8R0.13 CCC(C)(C)C(C)NC m_2230__11952422__2463448 [0,1,0,0,0,0|3,0,0]=4 170 B8R0.13 CCN(C)C(C)(C)CC m_270004__9479760__24715004 [0,1,0,0,0,0|3,0,0]=4 171 B8R0.13 CCN(C)C(C)(C)CO m_270004__24776684__24715004 [0,1,0,0,0,0|2,0,0]=3 172 B8R0.13 CCS(=O)(=O)C(C)CO m_2714__6338932__862376 [0,1,0,0,0,0|1,1,0]=3 173 B8R0.13 CCS(=O)(=O)[C@@H](C)CN m_273654__23163030__11625778 [0,1,0,0,0,0|2,1,0]=4 174 B8R0.13 CNC(=O)C(C)(C)CO m_240690__7355834__22880072 [0,1,0,0,0,0|1,1,1]=4 175 B8R0.13 CNC(=O)C(C)(N)CO m_240690__7355834__13287642 [0,1,0,0,0,0|1,1,1]=4 176 B8R0.13 CNC(=O)C(C)(O)CO m_22__387492__10684428 [0,1,0,0,0,0|1,1,1]=4 177 B8R0.13 CNC(C)C(C)(C)CO m_269862__7193148__10804052 [0,1,0,0,0,0|2,0,0]=3 178 B8R0.13 COC(=O)C(C)(C)CO m_1458__2759050__483916 [0,1,0,0,0,0|1,1,1]=4 179 B8R0.20 CCC(C#N)N(C)CC m_2230__22392426__2463448 [0,1,0,0,0,0|3,0,0]=4 180 B8R0.20 CCC(C)N(CC)CC m_2230__678900__14247836 [0,1,0,0,0,0|3,0,0]=4 181 B8R0.20 CCC(CC)C(=NO)C m_4__388124__14182434 [0,1,0,0,0,0|2,0,1]=4 182 B8R0.20 CCC(CC)C(C)NC m_269862__7193148__14182436 [0,1,0,0,0,0|3,0,0]=4 183 B8R0.20 CCC(CC)N(C)CC m_2230__10267040__2463448 [0,1,0,0,0,0|3,0,0]=4 184 B8R0.20 CCC(CC)S(=O)CC m_265282__4271638__4273536 [0,1,0,0,0,0|2,1,0]=4 185 B8R0.20 CCC(CO)C(=O)NC m_22__387492__11678640 [0,1,0,0,0,0|1,1,1]=4 186 B8R0.20 CCC(CO)N(C)CC m_2230__10642192__22383854 [0,1,0,0,0,0|2,0,0]=3 187 B8R0.20 CCC(CO)N(C)OC m_2230__679026__12622220 [0,1,0,0,0,0|3,0,0]=4 188 B8R0.20 CCC(SC)C(=O)NO m_527__388132__7633704 [0,1,0,0,0,0|2,0,1]=4 189 B8R0.20 CCN(C)C(CF)CF m_270004__24163680__24715004 [0,1,0,0,0,0|3,0,0]=4 190 B8R0.20 CCN(C)C(CO)CO m_2230__22407890__2463448 [0,1,0,0,0,0|2,0,0]=3 191 B8R0.20 CCN(CC)C(C)CF m_2230__678900__22994052 [0,1,0,0,0,0|3,0,0]=4 192 B8R0.20 CCN(CC)C(C)CN m_269982__7368916__13769420 [0,1,0,0,0,0|3,0,0]=4 193 B8R0.20 CCN(CC)[C@@H](C)CO m_2230__10548330__22383854 [0,1,0,0,0,0|2,0,0]=3 194 B8R0.20 CC[C@@H](CO)N(C)CC m_2230__22407870__2463448 [0,1,0,0,0,0|2,0,0]=3 195 B8R0.20 CC[C@H](C)N(CC)CC m_270004__24170696__24715004 [0,1,0,0,0,0|3,0,0]=4 196 B8R0.20 CC[C@H](C)[C@@H](CO)NC m_2230__18901738__2463448 [0,1,0,0,0,0|1,0,0]=2 197 B8R0.20 CNC(=O)C(CN)CO m_240690__7355834__21393008 [0,1,0,0,0,0|1,1,1]=4 198 B8R0.20 CNC(=O)C(CO)OC m_22__387492__22324112 [0,1,0,0,0,0|1,1,1]=4 199 B8R0.20 CNC(C)C(CO)SC m_2230__22400868__2463448 [0,1,0,0,0,0|2,0,0]=3 200 B8R0.20 CNC(CO)C(=O)OC m_2230__22395932__2463448 [0,1,0,0,0,0|1,1,1]=4 201 B8R0.20 COC(=O)C(CO)OC m_1458__22324114__483916 [0,1,0,0,0,0|1,1,1]=4 202 B8R1.5 CC1CCCCN1C m_2230__678754__2463448 [0,0,0,1,0,0|3,0,0]=4 203 B8R1.5 CC1CNCCN1C m_269982__7368790__14064228 [0,0,0,1,0,0|3,0,0]=4 204 B8R1.5 CC1COCCN1C m_2230__679548__2463448 [0,0,0,1,0,0|2,0,0]=3 205 B8R1.5 CC1CSCCN1C m_2230__5359444__2463448 [0,0,0,1,0,0|2,1,0]=4 206 B8R1.5 C[C@@H]1CCCCN1C m_2230__22409340__2463448 [0,0,0,1,0,0|3,0,0]=4 207 B8R1.5 C[C@H]1COCCN1C m_2230__10745968__2463448 [0,0,0,1,0,0|2,0,0]=3 208 B8R1.11 CC1CCCC1=NO m_4__388124__3351302 [0,0,0,1,0,0|2,0,1]=4 209 B8R1.11 CCC1CCCN1C m_2230__4599928__2463448 [0,0,0,1,0,0|3,0,0]=4 210 B8R1.11 CCN1CCCC1C m_2230__6338494__22383854 [0,0,0,1,0,0|3,0,0]=4 211 B8R1.11 CN1CCCC1CO m_2230__3379024__2463448 [0,0,0,1,0,0|2,0,0]=3 212 B8R1.11 CN1CCC[C@H]1CF m_2230__17313732__2463448 [0,0,0,1,0,0|3,0,0]=4 213 B8R1.11 CNC1CCCC1C m_2230__9296222__2463448 [0,0,0,1,0,0|3,0,0]=4 214 B8R1.11 CNC1CCCC1O m_269862__7193148__15158002 [0,0,0,1,0,0|2,1,0]=4 215 B8R1.11 CNC1COCC1C m_2230__13166314__2463448 [0,0,0,1,0,0|2,0,0]=3 216 B8R1.11 CNC1CSCC1C m_2230__10125964__2463448 [0,0,0,1,0,0|2,1,0]=4 217 B8R1.11 CN[C@@H]1CNC[C@H]1C m_269982__22505224__14064228 [0,0,0,1,0,0|3,0,0]=4 218 B8R1.11 CN[C@H]1CCC[C@H]1C m_2230__22399140__2463448 [0,0,0,1,0,0|3,0,0]=4 219 B8R1.11 CN[C@H]1CCC[C@H]1N m_269982__17754792__14064228 [0,0,0,1,0,0|3,0,0]=4 220 B8R1.11 CN[C@H]1CNC[C@H]1C m_269982__22505270__14064228 [0,0,0,1,0,0|3,0,0]=4 221 B8R1.11 CN[C@H]1COC[C@H]1C m_2230__22403954__2463448 [0,0,0,1,0,0|2,0,0]=3 222 B8R1.11 CS[C@H]1COC[C@H]1F m_62__875850__18327624 [0,0,0,1,0,0|3,0,0]=4 223 B8R1.12 CCC1CCC1=NO m_4__388124__10177946 [0,0,0,1,0,0|2,0,1]=4 224 B8R1.12 CCC1CCN1CC m_270004__10437848__24715004 [0,0,0,1,0,0|3,0,0]=4 225 B8R1.12 CCN1CCC1CF m_270004__17655284__24715004 [0,0,0,1,0,0|3,0,0]=4 226 B8R1.12 CCN1CCC1CO m_270004__24176176__24715004 [0,0,0,1,0,0|2,0,0]=3 227 B8R1.12 CNC1CCC1CO m_269862__7193148__17047872 [0,0,0,1,0,0|2,0,0]=3 228 B8R1.38 CCN(C)C1CCC1 m_2230__5343598__2463448 [0,0,0,1,0,0|3,0,0]=4 229 B8R1.38 CCN(C)C1CNC1 m_269982__22505040__14064228 [0,0,0,1,0,0|3,0,0]=4 230 B8R1.38 CCN(C)C1COC1 m_2230__13570148__22383854 [0,0,0,1,0,0|2,0,0]=3 231 B8R1.38 CCN(C)C1CSC1 m_2230__13465922__22383854 [0,0,0,1,0,0|2,1,0]=4 232 B8R1.38 CCS(=O)C1CCC1 m_265282__10638442__4273536 [0,0,0,1,0,0|2,1,0]=4 233 B8R1.38 CNC(C)C1CCC1 m_2230__22399912__2463448 [0,0,0,1,0,0|3,0,0]=4 234 B8R1.38 CNC(C)C1CCO1 m_269862__7193148__22386440 [0,0,0,1,0,0|2,1,0]=4 235 B8R1.38 CNC(C)C1COC1 m_2230__22399744__2463448 [0,0,0,1,0,0|2,0,0]=3 236 B8R1.38 CNC(C)C1CSC1 m_2230__22403082__2463448 [0,0,0,1,0,0|2,1,0]=4 237 B8R1.38 CON(C)C1COC1 m_2230__679026__14925342 [0,0,0,1,0,0|3,0,0]=4 238 B8R1.39 CCN(C)C1(CC1)C m_2230__19458678__22383854 [0,0,0,1,0,0|3,0,0]=4 239 B8R1.39 CNC(C)C1(CC1)Br m_269862__7193148__10953874 [0,0,0,1,0,0|3,0,0]=4 240 B8R1.39 CNC(C)C1(CC1)C m_269862__7193148__7202290 [0,0,0,1,0,0|3,0,0]=4 241 B8R1.39 CNC(C)C1(CC1)Cl m_269862__7193148__10637916 [0,0,0,1,0,0|3,0,0]=4 242 B8R1.39 CNC(C)C1(CC1)F m_269862__7193148__14924862 [0,0,0,1,0,0|3,0,0]=4 243 B8R1.39 CN[C@@H](C)C1(CC1)O m_2230__22399402__2463448 [0,0,0,1,0,0|2,1,0]=4 244 B8R1.46 CC1CC(=NO)C1C m_4__388124__10542504 [0,0,0,1,0,0|2,0,1]=4 245 B8R1.46 CC1CC(N1C)CO m_2230__15757628__2463448 [0,0,0,1,0,0|2,0,0]=3 246 B8R1.46 CCN1CC(C1C)C m_2230__10547152__22383854 [0,0,0,1,0,0|3,0,0]=4 247 B8R1.50 CC1CCC(N1C)C m_2230__7045078__2463448 [0,0,0,1,0,0|3,0,0]=4 248 B8R1.50 CC1CCN(C1C)C m_2230__6507962__2463448 [0,0,0,1,0,0|3,0,0]=4 249 B8R1.50 C[C@H]1[C@@H](CCN1C)O m_2230__10747766__2463448 [0,0,0,1,0,0|2,0,0]=3 250 B8R1.50 C[C@H]1[C@H](CCN1C)O m_2230__14788854__2463448 [0,0,0,1,0,0|2,0,0]=3 251 B8R1.58 CCC1(CCN1C)C m_2230__22407902__2463448 [0,0,0,1,0,0|3,0,0]=4 252 B8R1.83 CCN(C)C1CC1C m_2230__16770468__22383854 [0,0,0,1,0,0|3,0,0]=4 253 B8R1.83 CCN(C)[C@@H]1C[C@H]1C m_270004__22537872__24715004 [0,0,0,1,0,0|3,0,0]=4 254 B8R0.19 C#CC(C)NC(C)CC m_2230__22399526__16604804 [0,0,0,0,0,1|2,0,1]=4 255 B8R0.19 C#CC(C)N[C@H](C)CO m_2230__22399532__16604804 [0,0,0,0,0,1|1,0,2]=4 256 B8R0.19 C=CC(C)NC(C)CC m_2230__22399842__14247836 [0,0,0,0,0,1|2,0,1]=4 257 B8R0.19 C=CC(C)NC(C)CO m_269862__8259486__15157990 [0,0,0,0,0,1|1,0,2]=4 258 B8R0.19 CC(C#N)N[C@H](C)CO m_2230__22399532__8857992 [0,0,0,0,0,1|2,0,1]=4 259 B8R0.19 CC(C#N)SC(C)CO m_7__6338928__6057 [0,0,0,0,0,1|2,0,1]=4 260 B8R0.19 CC(CF)NC(C)CCl m_2230__22399894__22994052 [0,0,0,0,0,1|3,0,0]=4 261 B8R0.19 CC(CF)N[C@H](C)CF m_2230__22399906__22994052 [0,0,0,0,0,1|3,0,0]=4 262 B8R0.19 CC(CF)N[C@H](C)CO m_2230__22399532__22994052 [0,0,0,0,0,1|2,0,0]=3 263 B8R0.19 CC(CN)N[C@H](C)CN m_269982__22505378__13769420 [0,0,0,0,0,1|3,0,0]=4 264 B8R0.19 CC(CO)NC(=O)CO m_22__564376__7941800 [0,0,0,0,0,1|1,1,1]=4 265 B8R0.19 CC(CO)N[C@H](C)CO m_269862__7194864__15157990 [0,0,0,0,0,1|2,0,0]=3 266 B8R0.19 CC(CO)SC(C)CO m_7__6338928__17610454 [0,0,0,0,0,1|2,0,0]=3 267 B8R0.19 CC(CO)S[C@@H](C)CN m_7__20871330__17610454 [0,0,0,0,0,1|2,0,0]=3 268 B8R0.19 CCC(=O)NC(C)CC m_270062__7594688__22005658 [0,0,0,0,0,1|1,1,1]=4 269 B8R0.19 CCC(=O)NC(C)CO m_270062__7600328__22005658 [0,0,0,0,0,1|0,1,1]=3 270 B8R0.19 CCC(=O)N[C@@H](C)CC m_1626__22088414__605354 [0,0,0,0,0,1|1,1,1]=4 271 B8R0.19 CCC(=O)N[C@H](C)CC m_22__23073296__58887 [0,0,0,0,0,1|1,1,1]=4 272 B8R0.19 CCC(=O)N[C@H](C)CF m_270062__13811086__22005658 [0,0,0,0,0,1|1,1,1]=4 273 B8R0.19 CCC(=O)N[C@H](C)CN m_270006__11615546__8405144 [0,0,0,0,0,1|1,1,1]=4 274 B8R0.19 CCC(=O)OC(C)CC m_276436__14076902__14101862 [0,0,0,0,0,1|1,1,1]=4 275 B8R0.19 CCC(=O)OC(C)CF m_276436__22326972__14101862 [0,0,0,0,0,1|1,1,1]=4 276 B8R0.19 CCC(C)CC(C)NC m_2230__22399368__2463448 [0,0,0,0,0,1|3,0,0]=4 277 B8R0.19 CCC(C)CN(C)CC m_2230__6507312__2463448 [0,0,0,0,0,1|3,0,0]=4 278 B8R0.19 CCC(C)CS(=O)CC m_265282__7021600__4273536 [0,0,0,0,0,1|2,1,0]=4 279 B8R0.19 CCC(C)NC(=O)CO m_22__57678__7941800 [0,0,0,0,0,1|2,0,1]=4 280 B8R0.19 CCC(C)NC(C)C#N m_2230__22392276__14247836 [0,0,0,0,0,1|2,0,1]=4 281 B8R0.19 CCC(C)NC(C)CC m_269862__7192700__7200134 [0,0,0,0,0,1|2,0,0]=3 282 B8R0.19 CCC(C)NC(C)CCl m_2230__22399894__14247836 [0,0,0,0,0,1|2,0,0]=3 283 B8R0.19 CCC(C)NC(C)CF m_2230__22399526__22994052 [0,0,0,0,0,1|2,0,0]=3 284 B8R0.19 CCC(C)NC(C)CO m_269862__7192700__15157990 [0,0,0,0,0,1|1,0,0]=2 285 B8R0.19 CCC(C)N[C@H](C)CF m_2230__22399906__14247836 [0,0,0,0,0,1|2,0,0]=3 286 B8R0.19 CCC(C)N[C@H](C)CN m_269982__22505378__14247844 [0,0,0,0,0,1|2,0,0]=3 287 B8R0.19 CCC(C)N[C@H](C)CO m_269862__7194864__7200134 [0,0,0,0,0,1|1,0,0]=2 288 B8R0.19 CCC(C)SC(C)CO m_7__6338928__14247828 [0,0,0,0,0,1|1,0,0]=2 289 B8R0.19 CCC(C)S[C@@H](C)CN m_7__20871330__14247828 [0,0,0,0,0,1|2,0,0]=3 290 B8R0.19 CCC(N)CN(C)CC m_269982__22504842__7393392 [0,0,0,0,0,1|3,0,0]=4 291 B8R0.19 CCC(O)CN(C)CC m_270004__15766966__24715004 [0,0,0,0,0,1|2,1,0]=4 292 B8R0.19 CCN(C)CC(C)CO m_2230__5903708__22383854 [0,0,0,0,0,1|2,0,0]=3 293 B8R0.19 CCN(C)CC(O)CO m_2230__22399220__2463448 [0,0,0,0,0,1|3,0,0]=4 294 B8R0.19 CCN(C)C[C@@H](O)CO m_2230__22405902__22383854 [0,0,0,0,0,1|3,0,0]=4 295 B8R0.19 CCS(=O)CC(O)CO m_265282__10978846__4273536 [0,0,0,0,0,1|2,1,0]=4 296 B8R0.19 CC[C@@H](C)NC(=O)CO m_22__23073296__7941800 [0,0,0,0,0,1|2,0,1]=4 297 B8R0.19 CNC(=O)N[C@@H](C)CO m_2554__13191904__788506 [0,0,0,0,0,1|1,1,1]=4 298 B8R0.19 CNC(=O)N[C@H](C)CO m_68__23349124__22160886 [0,0,0,0,0,1|1,1,1]=4 299 B8R0.19 COC(=O)NC(C)CO m_282070__22207690__22151046 [0,0,0,0,0,1|1,1,1]=4 300 B8R0.19 CON(C)CC(C)CO m_2230__679026__7968764 [0,0,0,0,0,1|3,0,0]=4 301 B8R0.19 C[C@H](CO)NC(=O)CN m_240690__15704534__3025698 [0,0,0,0,0,1|1,1,1]=4 302 B5R0.1 CCCN(C)C m_2230__2261920__2463448 [2,0,0,0,0,0|1,0,0]=3 303 B5R0.1 CCNC(C)C m_269862__7865270__7204804 [2,0,0,0,0,0|1,0,0]=3 304 B5R0.1 CCSC(C)C m_62__2390328__6469026 [2,0,0,0,0,0|1,0,0]=3 305 B5R0.1 CN(C)CCN m_269982__10894792__14064228 [2,0,0,0,0,0|2,0,0]=4 306 B5R0.1 CN(C)CCO m_2230__679202__2463448 [2,0,0,0,0,0|2,0,0]=4 307 B5R0.1 CNCC(C)C m_207__134027__121216 [2,0,0,0,0,0|1,0,0]=3 308 B5R0.1 CS(=O)CCO m_265282__7088216__4273530 [2,0,0,0,0,0|1,1,0]=4 309 B5R0.1 CSCC(C)C m_62__1010136__876088 [2,0,0,0,0,0|1,0,0]=3 310 B5R0.1 CSCC(C)F m_62__875850__16913488 [2,0,0,0,0,0|2,0,0]=4 311 B5R0.1 CSCC(C)O m_7__10953796__5046 [2,0,0,0,0,0|1,0,0]=3 312 B5R0.1 CSC[C@H](C)N m_7__20871336__5046 [2,0,0,0,0,0|2,0,0]=4 313 B5R0.2 CCCC=NO m_4__388124__7831606 [2,0,0,0,0,0|1,0,1]=4 314 B5R0.2 CCCCSC m_62__875776__876088 [2,0,0,0,0,0|2,0,0]=4 315 B5R0.2 CCCNCC m_270004__8288780__24715004 [2,0,0,0,0,0|2,0,0]=4 316 B5R0.2 CCCSCC m_62__875778__6469026 [2,0,0,0,0,0|2,0,0]=4 317 B5R0.2 CCNCCO m_270004__8349608__24715004 [2,0,0,0,0,0|1,0,0]=3 318 B5R0.2 CCSCCF m_7__22987770__22320828 [2,0,0,0,0,0|2,0,0]=4 319 B5R0.2 CCSCCN m_7__20871276__5047 [2,0,0,0,0,0|2,0,0]=4 320 B5R0.2 CCSCCO m_7__22987770__102708 [2,0,0,0,0,0|1,0,0]=3 321 B5R0.2 CSCCCN m_7__20871288__5046 [2,0,0,0,0,0|2,0,0]=4 322 B5R0.2 CSCCCO m_7__10972294__5046 [2,0,0,0,0,0|1,0,0]=3 323 B5R0.3 CCC(C)NC m_2230__22399526__2463448 [2,0,0,0,0,0|2,0,0]=4 324 B5R0.3 CCN(C)CC m_2230__678602__2463448 [2,0,0,0,0,0|2,0,0]=4 325 B5R0.3 CCS(=O)CC m_1498__7021596__7021598 [2,0,0,0,0,0|1,1,0]=4 326 B5R0.3 CNC(C)CCl m_2230__22399894__2463448 [2,0,0,0,0,0|2,0,0]=4 327 B5R0.3 CNC(C)CO m_269862__7193148__15157990 [2,0,0,0,0,0|1,0,0]=3 328 B5R0.3 CN[C@H](C)CF m_2230__22399906__2463448 [2,0,0,0,0,0|2,0,0]=4 329 B5R0.3 CN[C@H](C)CN m_269982__22505378__14064228 [2,0,0,0,0,0|2,0,0]=4 330 B5R0.3 CN[C@H](C)CO m_2230__22399532__2463448 [2,0,0,0,0,0|1,0,0]=3 331 B5R0.3 CSC(C)CO m_7__6338928__5046 [2,0,0,0,0,0|1,0,0]=3 332 B5R0.3 CS[C@@H](C)CN m_7__20871330__5046 [2,0,0,0,0,0|2,0,0]=4 333 B7R0.2 CC(=O)NC(C)CO m_270062__7600328__15585492 [1,1,0,0,0,0|1,0,1]=4 334 B7R0.2 CC(C)NC(C)CCl m_2230__22399894__680832 [1,1,0,0,0,0|2,0,0]=4 335 B7R0.2 CC(C)N[C@H](C)CF m_2230__22399906__680832 [1,1,0,0,0,0|2,0,0]=4 336 B7R0.2 CC(C)N[C@H](C)CN m_269982__22505378__7393356 [1,1,0,0,0,0|2,0,0]=4 337 B7R0.2 CC(C)N[C@H](C)CO m_269862__7194864__7204804 [1,1,0,0,0,0|1,0,0]=3 338 B7R0.2 CC(C)SC(C)CO m_7__6338928__5048 [1,1,0,0,0,0|1,0,0]=3 339 B7R0.2 CC(C)S[C@@H](C)CN m_7__20871330__5048 [1,1,0,0,0,0|2,0,0]=4 340 B7R0.2 CC(CO)CN(C)C m_2230__5903708__2463448 [1,1,0,0,0,0|1,0,0]=3 341 B7R0.2 CCC(C)CN(C)C m_2230__4599284__2463448 [1,1,0,0,0,0|2,0,0]=4 342 B7R0.2 CCC(C)CS(=O)C m_265282__7021600__4273530 [1,1,0,0,0,0|2,0,0]=4 343 B7R0.2 CCC(C)NC(C)C m_269862__7192700__7204804 [1,1,0,0,0,0|2,0,0]=4 344 B7R0.2 CCN(C)CC(C)C m_2230__702774__2463448 [1,1,0,0,0,0|2,0,0]=4 345 B7R0.2 CCN(C)CC(C)O m_2230__5344536__2463448 [1,1,0,0,0,0|2,0,0]=4 346 B7R0.2 CCN(C)C[C@@H](C)O m_270004__16620752__24715004 [1,1,0,0,0,0|2,0,0]=4 347 B7R0.2 CCN(C)C[C@H](C)N m_269982__22504918__7393392 [1,1,0,0,0,0|2,0,0]=4 348 B7R0.2 CCN(C)C[C@H](C)O m_2230__17693280__2463448 [1,1,0,0,0,0|2,0,0]=4 349 B7R0.2 CCS(=O)CC(C)O m_265282__10908418__4273536 [1,1,0,0,0,0|1,1,0]=4 350 B7R0.2 CN(C)C[C@@H](O)CO m_2230__22405902__2463448 [1,1,0,0,0,0|2,0,0]=4 351 B7R0.2 CNC(C)CC(C)C m_2230__22399870__2463448 [1,1,0,0,0,0|2,0,0]=4 352 B7R0.2 CNC(C)CC(C)O m_2230__22399846__2463448 [1,1,0,0,0,0|2,0,0]=4 353 B7R0.2 CN[C@H](C)C[C@@H](C)N m_269982__22505384__14064228 [1,1,0,0,0,0|2,0,0]=4 354 B7R0.2 CS(=O)CC(O)CO m_265282__10978846__4273530 [1,1,0,0,0,0|2,0,0]=4 355 B7R0.2 CSC(C)CC(C)C m_62__875850__10643630 [1,1,0,0,0,0|2,0,0]=4 356 B7R0.3 C#CC(C)CNCC m_270004__24793550__24715004 [1,1,0,0,0,0|1,0,1]=4 357 B7R0.3 C#CCSC(C)CO m_7__6338928__6266 [1,1,0,0,0,0|0,0,2]=4 358 B7R0.3 C=C(CO)CSCC m_7__22987770__15422654 [1,1,0,0,0,0|0,0,2]=4 359 B7R0.3 C=CC(C)CNCC m_270004__17762574__24715004 [1,1,0,0,0,0|1,0,1]=4 360 B7R0.3 C=CC(C)CSCC m_62__23815404__6469026 [1,1,0,0,0,0|1,0,1]=4 361 B7R0.3 C=CC(C)NCCC m_2230__22399842__13271112 [1,1,0,0,0,0|1,0,1]=4 362 B7R0.3 C=CCN[C@H](C)CO m_2230__22399532__680312 [1,1,0,0,0,0|0,0,2]=4 363 B7R0.3 C=CCSC(C)CO m_7__6338928__3427024 [1,1,0,0,0,0|0,0,2]=4 364 B7R0.3 CC(=NO)CCCO m_4__388124__10542364 [1,1,0,0,0,0|1,0,1]=4 365 B7R0.3 CC(CCl)NCCF m_2230__22399894__22320836 [1,1,0,0,0,0|2,0,0]=4 366 B7R0.3 CC(CCl)NCCO m_2230__22399894__6165700 [1,1,0,0,0,0|2,0,0]=4 367 B7R0.3 CC(CO)NCCF m_269862__9706110__15157990 [1,1,0,0,0,0|1,0,0]=3 368 B7R0.3 CC(CO)NCCO m_269862__7193048__15157990 [1,1,0,0,0,0|1,0,0]=3 369 B7R0.3 CC(CO)SCC#N m_7__6338928__5055 [1,1,0,0,0,0|1,0,1]=4 370 B7R0.3 CC(CO)SCCF m_7__6338928__22320828 [1,1,0,0,0,0|1,0,0]=3 371 B7R0.3 CC(CO)SCCN m_7__20871276__17610454 [1,1,0,0,0,0|1,0,0]=3 372 B7R0.3 CC(CO)SCCO m_7__6338928__102708 [1,1,0,0,0,0|1,0,0]=3 373 B7R0.3 CCC(=O)NCCO m_270062__7594790__22005658 [1,1,0,0,0,0|0,1,1]=4 374 B7R0.3 CCC(=O)OCCO m_1458__473508__485506 [1,1,0,0,0,0|0,1,1]=4 375 B7R0.3 CCC(C)CCSC m_62__20058276__876088 [1,1,0,0,0,0|1,0,0]=3 376 B7R0.3 CCC(C)NCCF m_269862__9706110__7200134 [1,1,0,0,0,0|2,0,0]=4 377 B7R0.3 CCC(C)NCCO m_269862__7193048__7200134 [1,1,0,0,0,0|1,0,0]=3 378 B7R0.3 CCC(C)SCCN m_7__20871276__14247828 [1,1,0,0,0,0|2,0,0]=4 379 B7R0.3 CCC(C)SCCO m_7__128807__14247828 [1,1,0,0,0,0|1,0,0]=3 380 B7R0.3 CCC(O)CCSC m_62__16640708__876088 [1,1,0,0,0,0|0,2,0]=4 381 B7R0.3 CCCCC(=NO)C m_4__388124__66742 [1,1,0,0,0,0|1,0,1]=4 382 B7R0.3 CCCCC(C)NC m_269862__7193148__7200136 [1,1,0,0,0,0|2,0,0]=4 383 B7R0.3 CCCCN(C)CC m_270004__8127976__24715004 [1,1,0,0,0,0|2,0,0]=4 384 B7R0.3 CCCNC(=O)CO m_22__58027__7941800 [1,1,0,0,0,0|1,0,1]=4 385 B7R0.3 CCCNC(C)CC m_2230__22399526__13271112 [1,1,0,0,0,0|1,0,0]=3 386 B7R0.3 CCCNC(C)CCl m_2230__22399894__13271112 [1,1,0,0,0,0|1,0,0]=3 387 B7R0.3 CCCNC(C)CO m_269862__7192572__15157990 [1,1,0,0,0,0|0,0,0]=2 388 B7R0.3 CCCN[C@H](C)CF m_2230__22399906__13271112 [1,1,0,0,0,0|1,0,0]=3 389 B7R0.3 CCCN[C@H](C)CN m_269982__22505378__13271120 [1,1,0,0,0,0|1,0,0]=3 390 B7R0.3 CCCN[C@H](C)CO m_2230__22399532__13271112 [1,1,0,0,0,0|0,0,0]=2 391 B7R0.3 CCCSC(C)C#N m_7__22986886__6057 [1,1,0,0,0,0|1,0,1]=4 392 B7R0.3 CCCSC(C)CC m_7__22986886__14247828 [1,1,0,0,0,0|1,0,0]=3 393 B7R0.3 CCCSC(C)CO m_7__6338928__14390332 [1,1,0,0,0,0|0,0,0]=2 394 B7R0.3 CCCS[C@@H](C)CN m_7__20871330__14390332 [1,1,0,0,0,0|1,0,0]=3 395 B7R0.3 CCN(C)CCCF m_2230__22407906__2463448 [1,1,0,0,0,0|2,0,0]=4 396 B7R0.3 CCN(C)CCCN m_269982__21673718__14064228 [1,1,0,0,0,0|2,0,0]=4 397 B7R0.3 CCN(C)CCCO m_2230__6287314__2463448 [1,1,0,0,0,0|2,0,0]=4 398 B7R0.3 CCN(C)CCNC m_269982__10880304__7393392 [1,1,0,0,0,0|2,0,0]=4 399 B7R0.3 CCN(C)CCOC m_2230__10176424__2463448 [1,1,0,0,0,0|2,0,0]=4 400 B7R0.3 CCN(C)CCSC m_2230__11620998__2463448 [1,1,0,0,0,0|2,0,0]=4 401 B7R0.3 CCNCC(C)C#N m_270004__8739464__24715004 [1,1,0,0,0,0|1,0,1]=4 402 B7R0.3 CCNCC(C)CC m_207__121480__7687310 [1,1,0,0,0,0|1,0,0]=3 403 B7R0.3 CCNCC(C)CO m_270004__8291276__24715004 [1,1,0,0,0,0|0,0,0]=2 404 B7R0.3 CCNCC(C)OC m_270004__9164178__24715004 [1,1,0,0,0,0|2,0,0]=4 405 B7R0.3 CCNCC(C)SC m_270004__8299206__24715004 [1,1,0,0,0,0|2,0,0]=4 406 B7R0.3 CCNCC(F)CO m_270004__17069732__24715004 [1,1,0,0,0,0|1,0,0]=3 407 B7R0.3 CCNCC(O)CC m_270004__24336106__24715004 [1,1,0,0,0,0|1,1,0]=4 408 B7R0.3 CCNCC(O)CF m_270004__13905838__24715004 [1,1,0,0,0,0|2,0,0]=4 409 B7R0.3 CCOCC(=NO)C m_4__388124__2759460 [1,1,0,0,0,0|1,0,1]=4 410 B7R0.3 CCOCC(C)NC m_2230__22397432__2463448 [1,1,0,0,0,0|2,0,0]=4 411 B7R0.3 CCS(=O)CCCO m_265282__10972298__4273536 [1,1,0,0,0,0|1,1,0]=4 412 B7R0.3 CCSCC(C)C#N m_7__22987770__22787436 [1,1,0,0,0,0|1,0,1]=4 413 B7R0.3 CCSCC(C)CC m_62__10709932__6469026 [1,1,0,0,0,0|1,0,0]=3 414 B7R0.3 CCSCC(C)CO m_7__6078536__5047 [1,1,0,0,0,0|0,0,0]=2 415 B7R0.3 CCSCC(C)OC m_62__875846__8738872 [1,1,0,0,0,0|2,0,0]=4 416 B7R0.3 CCSCC(F)CC m_62__9787600__6469026 [1,1,0,0,0,0|2,0,0]=4 417 B7R0.3 CCSCC(O)CC m_7__22988104__5047 [1,1,0,0,0,0|1,1,0]=4 418 B7R0.3 CCSCC(O)CF m_7__22987770__13890448 [1,1,0,0,0,0|2,0,0]=4 419 B7R0.3 CCSCC(O)CO m_7__22987770__3173190 [1,1,0,0,0,0|1,0,0]=3 420 B7R0.3 CCSC[C@@H](N)CC m_7__20871354__5047 [1,1,0,0,0,0|2,0,0]=4 421 B7R0.3 CNC(C)CCCN m_269982__22505332__14064228 [1,1,0,0,0,0|2,0,0]=4 422 B7R0.3 CNC(C)CCCO m_2230__22399382__2463448 [1,1,0,0,0,0|2,0,0]=4 423 B7R0.3 CNC(C)CCOC m_2230__22398948__2463448 [1,1,0,0,0,0|2,0,0]=4 424 B7R0.3 CNC(C)CCSC m_2230__22399620__2463448 [1,1,0,0,0,0|2,0,0]=4 425 B7R0.3 CNCCC(C)NC m_269982__22505202__14064228 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CCSC(C)C(C)C m_7__6286942__5047 [1,1,0,0,0,0|2,0,0]=4 454 B7R0.5 CCSC(C)C(C)O m_7__22987770__12202248 [1,1,0,0,0,0|1,0,0]=3 455 B7R0.5 CSCC(C)C(C)C m_62__16618958__876088 [1,1,0,0,0,0|2,0,0]=4 456 B7R0.5 C[C@H](CCO)N(C)C m_2230__22409128__2463448 [1,1,0,0,0,0|2,0,0]=4 457 B7R0.7 C#CCC(C)NCC m_2230__22400136__22383854 [1,1,0,0,0,0|2,0,0]=4 458 B7R0.7 C#CCC(C)SCC m_7__22987770__23842164 [1,1,0,0,0,0|2,0,0]=4 459 B7R0.7 C=CCC(C)NCC m_2230__22399836__22383854 [1,1,0,0,0,0|2,0,0]=4 460 B7R0.7 C=CCC(C)SCC m_7__22987770__12913704 [1,1,0,0,0,0|2,0,0]=4 461 B7R0.7 C=CCN(C)CCC m_2230__2261920__680312 [1,1,0,0,0,0|2,0,0]=4 462 B7R0.7 CCCC(=NOC)C m_4__461206__67539 [1,1,0,0,0,0|1,0,1]=4 463 B7R0.7 CCCC(C)C=NO m_4__388124__7831624 [1,1,0,0,0,0|0,0,1]=3 464 B7R0.7 CCCC(C)NCC m_2230__22397382__22383854 [1,1,0,0,0,0|1,0,0]=3 465 B7R0.7 CCCC(C)SCC m_62__875846__10638528 [1,1,0,0,0,0|1,0,0]=3 466 B7R0.7 CCCN(C)CC#N m_2230__2261920__680932 [1,1,0,0,0,0|2,0,0]=4 467 B7R0.7 CCCN(C)CCC m_2230__2261920__13271112 [1,1,0,0,0,0|2,0,0]=4 468 B7R0.7 CCCN(C)CCF m_2230__2261920__22320836 [1,1,0,0,0,0|2,0,0]=4 469 B7R0.7 CCCN(C)CCN m_269982__10894792__13271120 [1,1,0,0,0,0|2,0,0]=4 470 B7R0.7 CCCN(C)CCO m_2230__2261920__6165700 [1,1,0,0,0,0|1,0,0]=3 471 B7R0.7 CCNC(=O)CCO m_487__150428__12879784 [1,1,0,0,0,0|0,1,1]=4 472 B7R0.7 CCNC(C)CC#N m_2230__11757170__22383854 [1,1,0,0,0,0|2,0,0]=4 473 B7R0.7 CCNC(C)CCN m_269982__22505446__7393392 [1,1,0,0,0,0|2,0,0]=4 474 B7R0.7 CCNC(C)CCO m_2230__22400640__22383854 [1,1,0,0,0,0|1,0,0]=3 475 B7R0.7 CCNC(C)CNC m_269982__22505308__7393392 [1,1,0,0,0,0|2,0,0]=4 476 B7R0.7 CCNC(C)COC m_270004__8160850__8844972 [1,1,0,0,0,0|1,0,0]=3 477 B7R0.7 CCNC(C)CSC m_2230__22400632__22383854 [1,1,0,0,0,0|1,1,0]=4 478 B7R0.7 CCN[C@@H](C)CCO m_270004__13469994__24715004 [1,1,0,0,0,0|1,0,0]=3 479 B7R0.7 CCN[C@@H](C)CSC m_270004__23847226__24715004 [1,1,0,0,0,0|1,1,0]=4 480 B7R0.7 CCN[C@H](C)CCF m_2230__22404666__22383854 [1,1,0,0,0,0|2,0,0]=4 481 B7R0.7 CCN[C@H](C)COC m_2230__22399844__22383854 [1,1,0,0,0,0|1,0,0]=3 482 B7R0.7 CCOC(C)SCC m_7__22987770__13420948 [1,1,0,0,0,0|2,0,0]=4 483 B7R0.7 CCSC(C)CCO m_7__22987770__14772890 [1,1,0,0,0,0|1,0,0]=3 484 B7R0.7 CCSC(C)COC m_7__22987770__6339266 [1,1,0,0,0,0|1,0,0]=3 485 B7R0.7 CN(CCN)CCO m_269982__22515300__14439794 [1,1,0,0,0,0|2,0,0]=4 486 B7R0.7 CN(CCO)CCF m_2230__679202__22320836 [1,1,0,0,0,0|2,0,0]=4 487 B7R0.7 CN(CCO)CCO m_2230__679202__6165700 [1,1,0,0,0,0|2,0,0]=4 488 B7R0.7 COCC(C)CSC m_7__20064958__5046 [1,1,0,0,0,0|1,0,0]=3 489 B7R0.11 CCC(C)(C)CNC m_207__134027__6108110 [1,1,0,0,0,0|2,0,0]=4 490 B7R0.11 CCNC(C)(C)CC m_2230__804688__22383854 [1,1,0,0,0,0|2,0,0]=4 491 B7R0.11 CCNC(C)(C)CCl m_2230__22399850__22383854 [1,1,0,0,0,0|2,0,0]=4 492 B7R0.11 CCNC(C)(C)CF m_2230__22399360__22383854 [1,1,0,0,0,0|2,0,0]=4 493 B7R0.11 CCNC(C)(C)CN m_269982__22505310__7393392 [1,1,0,0,0,0|2,0,0]=4 494 B7R0.11 CCNC(C)(C)CO m_2230__3081244__22383854 [1,1,0,0,0,0|1,0,0]=3 495 B7R0.11 CCS(=O)(=O)CCO m_2714__6283136__862376 [1,1,0,0,0,0|1,1,0]=4 496 B7R0.11 CCSC(C)(C)CO m_7__22987538__5047 [1,1,0,0,0,0|1,0,0]=3 497 B7R0.11 CNC(C)(C)CCO m_2230__22483446__2463448 [1,1,0,0,0,0|2,0,0]=4 498 B7R0.11 CNCC(C)(C)CF m_207__134027__23854226 [1,1,0,0,0,0|2,0,0]=4 499 B7R0.11 CSC(C)(C)CCO m_7__22988032__5046 [1,1,0,0,0,0|2,0,0]=4 500 B7R0.11 CSCC(C)(C)CN m_7__20870816__5046 [1,1,0,0,0,0|2,0,0]=4 501 B7R0.11 CSCC(C)(C)CO m_7__15105602__5046 [1,1,0,0,0,0|1,0,0]=3 502 B7R0.12 C#CC(CCC)NC m_2230__22400960__2463448 [1,1,0,0,0,0|1,0,1]=4 503 B7R0.12 C#CC(CO)NCC m_2230__22400962__22383854 [1,1,0,0,0,0|1,0,1]=4 504 B7R0.12 C#CCC(CO)NC m_2230__22404322__2463448 [1,1,0,0,0,0|0,0,2]=4 505 B7R0.12 C=CC[C@@H](CO)NC m_2230__22399868__2463448 [1,1,0,0,0,0|0,0,2]=4 506 B7R0.12 C=C[C@H](CO)NCC m_2230__12111600__22383854 [1,1,0,0,0,0|1,0,1]=4 507 B7R0.12 CCC(CC)CNC m_207__134027__121234 [1,1,0,0,0,0|2,0,0]=4 508 B7R0.12 CCC(CC)CSC m_62__11972460__876088 [1,1,0,0,0,0|2,0,0]=4 509 B7R0.12 CCC(CCO)SC m_7__22987708__5046 [1,1,0,0,0,0|0,0,0]=2 510 B7R0.12 CCC(COC)NC m_269862__7193148__7201452 [1,1,0,0,0,0|2,0,0]=4 511 B7R0.12 CCC(COC)SC m_62__13910614__876088 [1,1,0,0,0,0|2,0,0]=4 512 B7R0.12 CCC(CSC)NC m_269862__7193148__15343962 [1,1,0,0,0,0|2,0,0]=4 513 B7R0.12 CCC(CSC)OC m_62__11244544__876088 [1,1,0,0,0,0|2,0,0]=4 514 B7R0.12 CCCC(=NO)CC m_4__388124__8282454 [1,1,0,0,0,0|1,0,1]=4 515 B7R0.12 CCCC(C#N)NC m_2230__22392280__2463448 [1,1,0,0,0,0|1,0,1]=4 516 B7R0.12 CCCC(CC)NC m_269862__7193148__8281932 [1,1,0,0,0,0|1,0,0]=3 517 B7R0.12 CCCC(CC)SC m_7__9582220__5046 [1,1,0,0,0,0|1,0,0]=3 518 B7R0.12 CCCC(CO)NC m_269862__7193148__15158016 [1,1,0,0,0,0|0,0,0]=2 519 B7R0.12 CCCC(CO)SC m_7__22987698__5046 [1,1,0,0,0,0|0,0,0]=2 520 B7R0.12 CCCN(CC)CC m_2230__2234344__22383854 [1,1,0,0,0,0|2,0,0]=4 521 B7R0.12 CCN(CC)CCO m_2230__678602__6165700 [1,1,0,0,0,0|2,0,0]=4 522 B7R0.12 CCN(CCO)OC m_2230__9111768__22383854 [1,1,0,0,0,0|1,1,0]=4 523 B7R0.12 CCNC(C#N)CO m_270004__24168224__24715004 [1,1,0,0,0,0|1,0,1]=4 524 B7R0.12 CCNC(CC)CC m_270004__8288560__24715004 [1,1,0,0,0,0|2,0,0]=4 525 B7R0.12 CCNC(CC)CF m_2230__22400144__22383854 [1,1,0,0,0,0|2,0,0]=4 526 B7R0.12 CCNC(CC)CN m_269982__22505480__7393392 [1,1,0,0,0,0|2,0,0]=4 527 B7R0.12 CCNC(CC)CO m_2230__13047752__22383854 [1,1,0,0,0,0|1,0,0]=3 528 B7R0.12 CCNC(CF)CF m_2230__22399898__22383854 [1,1,0,0,0,0|2,0,0]=4 529 B7R0.12 CCNC(CN)CN m_269982__10300044__7393392 [1,1,0,0,0,0|2,0,0]=4 530 B7R0.12 CCNC(CN)CO m_269982__22505370__7393392 [1,1,0,0,0,0|1,0,0]=3 531 B7R0.12 CCNC(CO)CO m_2230__10738176__22383854 [1,1,0,0,0,0|1,0,0]=3 532 B7R0.12 CCN[C@@H](CO)CF m_2230__22400244__22383854 [1,1,0,0,0,0|1,0,0]=3 533 B7R0.12 CCSC(CC)CC m_7__2559076__5047 [1,1,0,0,0,0|2,0,0]=4 534 B7R0.12 CCSC(CC)CN m_7__20871318__5047 [1,1,0,0,0,0|2,0,0]=4 535 B7R0.12 CCSC(CC)CO m_7__22987770__12622184 [1,1,0,0,0,0|1,0,0]=3 536 B7R0.12 CCSC(CF)CF m_7__22987770__17626614 [1,1,0,0,0,0|2,0,0]=4 537 B7R0.12 CC[C@@H](CCO)NC m_2230__22403216__2463448 [1,1,0,0,0,0|1,0,0]=3 538 B7R0.12 CC[C@H](COC)NC m_2230__22399910__2463448 [1,1,0,0,0,0|2,0,0]=4 539 B7R0.12 CNC(CO)CCF m_2230__22400124__2463448 [1,1,0,0,0,0|1,0,0]=3 540 B7R0.12 CNC(CO)CCO m_2230__22404146__2463448 [1,1,0,0,0,0|1,0,0]=3 541 B7R0.12 CN[C@@H](CF)COC m_2230__22402942__2463448 [1,1,0,0,0,0|2,0,0]=4 542 B7R0.12 CN[C@@H](CO)COC m_2230__22399896__2463448 [1,1,0,0,0,0|1,0,0]=3 543 B7R0.12 CN[C@@H](CO)CSC m_2230__22400134__2463448 [1,1,0,0,0,0|1,0,0]=3 544 B7R0.13 CCC(C)(C)N(C)C m_2230__9479758__2463448 [1,1,0,0,0,0|2,0,0]=4 545 B7R0.13 CNC(C)(C)C(C)C m_2230__22393868__2463448 [1,1,0,0,0,0|2,0,0]=4 546 B7R0.13 CNC(C)(C)C(C)O m_2230__22393694__2463448 [1,1,0,0,0,0|2,0,0]=4 547 B7R0.13 CSC(C)(C)C(C)C m_7__9329086__5046 [1,1,0,0,0,0|2,0,0]=4 548 B7R0.14 CC(CO)S(=O)(=O)C m_2714__6338932__862380 [1,1,0,0,0,0|1,1,0]=4 549 B7R0.14 CCN(C)C(C)(C)C m_2230__10688896__2463448 [1,1,0,0,0,0|2,0,0]=4 550 B7R0.14 CNC(C)C(C)(C)C m_269862__7193148__7202262 [1,1,0,0,0,0|2,0,0]=4 551 B7R0.14 CNC(C)C(C)(C)F m_2230__22404498__2463448 [1,1,0,0,0,0|2,0,0]=4 552 B7R0.14 CNC(C)C(C)(C)N m_269982__22505200__14064228 [1,1,0,0,0,0|2,0,0]=4 553 B7R0.14 CNC(C)C(C)(C)O m_269862__7193148__14430198 [1,1,0,0,0,0|2,0,0]=4 554 B7R0.14 CN[C@@H](C)C(C)(C)C m_2230__18365186__2463448 [1,1,0,0,0,0|2,0,0]=4 555 B7R0.14 CN[C@@H](C)C(C)(C)O m_2230__22399856__2463448 [1,1,0,0,0,0|2,0,0]=4 556 B7R0.15 C#CC(NC)C(C)C m_2230__22400952__2463448 [1,1,0,0,0,0|2,0,0]=4 557 B7R0.15 CCC(=NO)C(C)C m_4__388124__66796 [1,1,0,0,0,0|0,1,1]=4 558 B7R0.15 CCC(C#N)N(C)C m_2230__22392504__2463448 [1,1,0,0,0,0|2,0,0]=4 559 B7R0.15 CCC(CC)N(C)C m_2230__7460644__2463448 [1,1,0,0,0,0|2,0,0]=4 560 B7R0.15 CCC(CO)N(C)C m_2230__10642192__2463448 [1,1,0,0,0,0|1,1,0]=4 561 B7R0.15 CCC(NC)C(C)O m_2230__22399840__2463448 [1,1,0,0,0,0|1,0,0]=3 562 B7R0.15 CCN(CC)C(C)C m_2230__1080968__22383854 [1,1,0,0,0,0|2,0,0]=4 563 B7R0.15 CC[C@@H](NC)C(C)C m_2230__22399878__2463448 [1,1,0,0,0,0|1,0,0]=3 564 B7R0.15 CNC(C#N)C(C)C m_2230__22394484__2463448 [1,1,0,0,0,0|2,0,0]=4 565 B7R0.15 CNC(CO)C(C)C m_269862__7193148__15158000 [1,1,0,0,0,0|1,0,0]=3 566 B7R0.15 CN[C@@H](CO)[C@@H](C)O m_2230__22404806__2463448 [1,1,0,0,0,0|0,1,0]=3 567 B7R0.15 CN[C@H](CO)C(C)C m_2230__8627184__2463448 [1,1,0,0,0,0|1,0,0]=3 568 B7R0.15 CSC(CN)C(C)C m_7__20871370__5046 [1,1,0,0,0,0|1,0,0]=3 569 B7R0.15 CSC(CO)C(C)C m_7__13607902__5046 [1,1,0,0,0,0|1,0,0]=3 570 B7R0.16 CC(C)C(C)N(C)C m_2230__1932980__2463448 [1,1,0,0,0,0|2,0,0]=4 571 B7R0.16 CC(C)C(C)S(=O)C m_265282__6286948__4273530 [1,1,0,0,0,0|2,0,0]=4 572 B9R0.22 CC(CF)NC(C)(C)CO m_2230__3081244__22994052 [0,1,0,0,0,1|2,0,0]=4 573 B9R0.22 CC(CO)SC(C)(C)CO m_7__22987538__17610454 [0,1,0,0,0,1|2,0,0]=4 574 B9R0.22 CCC(=O)NC(C)(C)CO m_270062__16411242__22005658 [0,1,0,0,0,1|0,1,1]=4 575 B9R0.22 CCC(C)(C)NC(C)CF m_2230__804688__22994052 [0,1,0,0,0,1|2,0,0]=4 576 B9R0.22 CCC(C)NC(C)(C)CC m_2230__804688__14247836 [0,1,0,0,0,1|2,0,0]=4 577 B9R0.22 CCC(C)NC(C)(C)CCl m_2230__22399850__14247836 [0,1,0,0,0,1|2,0,0]=4 578 B9R0.22 CCC(C)NC(C)(C)CF m_2230__22399360__14247836 [0,1,0,0,0,1|2,0,0]=4 579 B9R0.22 CCC(C)NC(C)(C)CN m_269982__22505310__14247844 [0,1,0,0,0,1|2,0,0]=4 580 B9R0.22 CCC(C)NC(C)(C)CO m_2230__3081244__14247836 [0,1,0,0,0,1|1,0,0]=3 581 B9R0.22 CCC(C)SC(C)(C)CO m_7__22987538__14247828 [0,1,0,0,0,1|1,0,0]=3 582 B9R0.22 CCN(C)CC(C)(C)CO m_2230__10688398__22383854 [0,1,0,0,0,1|2,0,0]=4 583 B9R0.22 CCS(=O)(=O)CC(C)CO m_2714__6078498__862376 [0,1,0,0,0,1|1,1,0]=4 584 B9R0.22 CCS(=O)(=O)NC(C)CO m_40__6107942__6289440 [0,1,0,0,0,1|1,1,0]=4 585 B9R0.22 CCS(=O)CC(C)(C)CO m_265282__15105608__4273536 [0,1,0,0,0,1|1,1,0]=4 586 B9R0.26 C#CC(CC)NC(C)CC m_2230__22400958__14247836 [0,1,0,0,0,1|2,0,0]=4 587 B9R0.26 C#CC(CC)NC(C)CF m_2230__22400958__22994052 [0,1,0,0,0,1|2,0,0]=4 588 B9R0.26 C#CC(CO)NC(C)CC m_2230__22400962__14247836 [0,1,0,0,0,1|1,0,1]=4 589 B9R0.26 C=C[C@H](CO)NC(C)CC m_2230__12111600__14247836 [0,1,0,0,0,1|1,0,1]=4 590 B9R0.26 C=C[C@H](CO)NC(C)CO m_269862__12111610__15157990 [0,1,0,0,0,1|2,0,0]=4 591 B9R0.26 CC(CF)NC(CO)CO m_2230__10738176__22994052 [0,1,0,0,0,1|2,0,0]=4 592 B9R0.26 CC(CF)N[C@@H](CO)CF m_2230__22400244__22994052 [0,1,0,0,0,1|2,0,0]=4 593 B9R0.26 CC(CN)NC(CN)CO m_269982__22505370__13769420 [0,1,0,0,0,1|2,0,0]=4 594 B9R0.26 CC(CO)SC(CF)CF m_7__6338928__17626614 [0,1,0,0,0,1|2,0,0]=4 595 B9R0.26 CCC(=O)NC(CC)CO m_270062__16411228__22005658 [0,1,0,0,0,1|0,1,1]=4 596 B9R0.26 CCC(=O)NC(CN)CO m_240690__17321760__7404626 [0,1,0,0,0,1|0,1,1]=4 597 B9R0.26 CCC(=O)NC(CO)CO m_270062__12126550__22005658 [0,1,0,0,0,1|0,1,1]=4 598 B9R0.26 CCC(=O)N[C@@H](CO)CF m_270062__21874580__22005658 [0,1,0,0,0,1|0,1,1]=4 599 B9R0.26 CCC(C#N)NC(C)CCl m_2230__22399894__9105096 [0,1,0,0,0,1|2,0,0]=4 600 B9R0.26 CCC(C#N)N[C@H](C)CF m_2230__22399906__9105096 [0,1,0,0,0,1|2,0,0]=4 601 B9R0.26 CCC(C#N)N[C@H](C)CO m_2230__22399532__9105096 [0,1,0,0,0,1|1,0,0]=3 602 B9R0.26 CCC(C#N)SC(C)CO m_7__6338928__9105088 [0,1,0,0,0,1|1,0,0]=3 603 B9R0.26 CCC(C#N)S[C@@H](C)CN m_7__20871330__9105088 [0,1,0,0,0,1|2,0,0]=4 604 B9R0.26 CCC(C)CC(CC)NC m_269862__7193148__7200520 [0,1,0,0,0,1|2,0,0]=4 605 B9R0.26 CCC(C)CC(CO)NC m_2230__22404684__2463448 [0,1,0,0,0,1|1,0,0]=3 606 B9R0.26 CCC(C)NC(C#N)CC m_2230__22395038__14247836 [0,1,0,0,0,1|2,0,0]=4 607 B9R0.26 CCC(C)NC(C#N)CO m_2230__22395546__14247836 [0,1,0,0,0,1|1,0,1]=4 608 B9R0.26 CCC(C)NC(CC)CC m_270004__8288602__8798310 [0,1,0,0,0,1|2,0,0]=4 609 B9R0.26 CCC(C)NC(CC)CF m_2230__22400144__14247836 [0,1,0,0,0,1|2,0,0]=4 610 B9R0.26 CCC(C)NC(CC)CN m_269982__22505480__14247844 [0,1,0,0,0,1|2,0,0]=4 611 B9R0.26 CCC(C)NC(CC)CO m_2230__22399526__12622220 [0,1,0,0,0,1|1,0,0]=3 612 B9R0.26 CCC(C)NC(CF)CF m_2230__22399526__17626616 [0,1,0,0,0,1|2,0,0]=4 613 B9R0.26 CCC(C)NC(CN)CN m_269982__10300044__14247844 [0,1,0,0,0,1|2,0,0]=4 614 B9R0.26 CCC(C)NC(CN)CO m_269982__22505370__14247844 [0,1,0,0,0,1|1,0,0]=3 615 B9R0.26 CCC(C)NC(CO)CO m_2230__10738176__14247836 [0,1,0,0,0,1|1,0,0]=3 616 B9R0.26 CCC(C)N[C@@H](CC)CO m_269862__9108270__7200134 [0,1,0,0,0,1|1,0,0]=3 617 B9R0.26 CCC(C)N[C@@H](CO)CF m_2230__22400244__14247836 [0,1,0,0,0,1|1,0,0]=3 618 B9R0.26 CCC(C)SC(CC)CC m_7__2559076__14247828 [0,1,0,0,0,1|2,0,0]=4 619 B9R0.26 CCC(C)SC(CC)CN m_7__20871318__14247828 [0,1,0,0,0,1|2,0,0]=4 620 B9R0.26 CCC(CC(C)CO)NC m_2230__22397294__2463448 [0,1,0,0,0,1|1,0,0]=3 621 B9R0.26 CCC(CC)NC(C)CF m_270004__10214060__8798310 [0,1,0,0,0,1|2,0,0]=4 622 B9R0.26 CCC(CC)NC(C)CO m_269862__7192650__15157990 [0,1,0,0,0,1|1,0,0]=3 623 B9R0.26 CCC(CC)N[C@H](C)CF m_270004__13811084__8798310 [0,1,0,0,0,1|2,0,0]=4 624 B9R0.26 CCC(CC)N[C@H](C)CO m_270004__8291226__8798310 [0,1,0,0,0,1|1,0,0]=3 625 B9R0.26 CCC(CC)SC(C)CO m_7__6338928__8740112 [0,1,0,0,0,1|1,0,0]=3 626 B9R0.26 CCC(CC)S[C@@H](C)CN m_7__20871330__8740112 [0,1,0,0,0,1|2,0,0]=4 627 B9R0.26 CCC(CF)NC(C)CF m_2230__22400144__22994052 [0,1,0,0,0,1|2,0,0]=4 628 B9R0.26 CCC(CN)NC(C)CN m_269982__22505480__13769420 [0,1,0,0,0,1|2,0,0]=4 629 B9R0.26 CCC(CN)SC(C)CO m_7__20871318__17610454 [0,1,0,0,0,1|1,0,0]=3 630 B9R0.26 CCC(CO)NC(C)CCl m_2230__22399894__12622220 [0,1,0,0,0,1|1,1,0]=4 631 B9R0.26 CCC(CO)NC(C)CF m_2230__13047752__22994052 [0,1,0,0,0,1|1,1,0]=4 632 B9R0.26 CCC(CO)NC(C)CO m_269862__7192682__15157990 [0,1,0,0,0,1|0,1,0]=3 633 B9R0.26 CCC(CO)N[C@H](C)CF m_2230__22399906__12622220 [0,1,0,0,0,1|1,1,0]=4 634 B9R0.26 CCC(CO)N[C@H](C)CN m_269982__22505378__17567408 [0,1,0,0,0,1|1,1,0]=4 635 B9R0.26 CCC(CO)N[C@H](C)CO m_2230__22399532__12622220 [0,1,0,0,0,1|0,1,0]=3 636 B9R0.26 CCC(CO)SC(C)CO m_7__6338928__12622184 [0,1,0,0,0,1|0,1,0]=3 637 B9R0.26 CCC(CO)S[C@@H](C)CN m_7__20871330__12622184 [0,1,0,0,0,1|1,1,0]=4 638 B9R0.26 CCN(C)CC(CO)CO m_270004__16945746__24715004 [0,1,0,0,0,1|2,0,0]=4 639 B9R0.26 CCN(CC)CC(C)CO m_2230__678602__7968764 [0,1,0,0,0,1|2,0,0]=4 640 B9R0.26 CC[C@@H](CO)NC(C)CO m_269862__9108270__15157990 [0,1,0,0,0,1|0,1,0]=3 641 B9R0.26 C[C@H](CO)NC(CF)CF m_2230__22399532__17626616 [0,1,0,0,0,1|2,0,0]=4 642 B9R0.27 CC(CO)N(C)C(C)CF m_2230__7785428__22994052 [0,1,0,0,0,1|2,0,0]=4 643 B9R0.27 CCC(=O)N(C)C(C)CO m_270062__16415470__22005658 [0,1,0,0,0,1|0,1,1]=4 644 B9R0.27 CCC(=O)N(C)[C@H](C)CO m_527__9967428__156120 [0,1,0,0,0,1|0,1,1]=4 645 B9R0.27 CCC(C)N(C)C(C)CO m_2230__7785428__14247836 [0,1,0,0,0,1|1,0,0]=3 646 B9R0.27 CCN(C)C(=O)C(C)CO m_22__554376__16784146 [0,1,0,0,0,1|2,0,0]=4 647 B9R0.34 C#CCC(C)NC(C)CC m_2230__22399526__23842172 [0,1,0,0,0,1|2,0,0]=4 648 B9R0.34 C#CCC(C)NC(C)CO m_269862__24485300__15157990 [0,1,0,0,0,1|1,0,1]=4 649 B9R0.34 C#CCC(C)N[C@H](C)CO m_2230__22399532__23842172 [0,1,0,0,0,1|1,0,1]=4 650 B9R0.34 C#CCC(C)SC(C)CO m_7__6338928__23842164 [0,1,0,0,0,1|1,0,1]=4 651 B9R0.34 C=CCC(C)NC(C)CC m_269862__8258616__7200134 [0,1,0,0,0,1|2,0,0]=4 652 B9R0.34 C=CCC(C)NC(C)CO m_269862__8258616__15157990 [0,1,0,0,0,1|1,0,1]=4 653 B9R0.34 C=CCC(C)N[C@H](C)CO m_2230__22399532__12913708 [0,1,0,0,0,1|1,0,1]=4 654 B9R0.34 C=CCC(C)SC(C)CO m_7__6338928__12913704 [0,1,0,0,0,1|1,0,1]=4 655 B9R0.34 CC#CC(C)N[C@H](C)CO m_2230__22399532__22381658 [0,1,0,0,0,1|1,0,1]=4 656 B9R0.34 CC#CC(C)SC(C)CO m_7__6338928__22381648 [0,1,0,0,0,1|1,0,1]=4 657 B9R0.34 CC(CCN)N[C@H](C)CN m_269982__22505378__16969680 [0,1,0,0,0,1|2,0,0]=4 658 B9R0.34 CC(CCO)N[C@H](C)CF m_270004__13811084__13397824 [0,1,0,0,0,1|2,0,0]=4 659 B9R0.34 CC(CCO)N[C@H](C)CO m_2230__22399532__13397858 [0,1,0,0,0,1|1,0,0]=3 660 B9R0.34 CC(CCO)S[C@@H](C)CN m_7__20871330__14772890 [0,1,0,0,0,1|2,0,0]=4 661 B9R0.34 CC(CCl)NC(C)CCO m_2230__22399894__13397858 [0,1,0,0,0,1|2,0,0]=4 662 B9R0.34 CC(CF)NC(C)CCO m_2230__22400640__22994052 [0,1,0,0,0,1|2,0,0]=4 663 B9R0.34 CC(CF)N[C@H](C)CCF m_2230__22404666__22994052 [0,1,0,0,0,1|2,0,0]=4 664 B9R0.34 CC(CN)NC(C)CCN m_269982__22505446__13769420 [0,1,0,0,0,1|2,0,0]=4 665 B9R0.34 CC(CO)CN(C)CCF m_2230__5903708__22320836 [0,1,0,0,0,1|2,0,0]=4 666 B9R0.34 CC(CO)CN(C)CCN m_269982__22517724__14439794 [0,1,0,0,0,1|2,0,0]=4 667 B9R0.34 CC(CO)CN(C)CCO m_2230__679202__7968764 [0,1,0,0,0,1|2,0,0]=4 668 B9R0.34 CC(CO)NC(=O)CCBr m_270062__7600328__20844442 [0,1,0,0,0,1|0,1,1]=4 669 B9R0.34 CC(CO)NC(=O)CCO m_487__515764__12879784 [0,1,0,0,0,1|0,1,1]=4 670 B9R0.34 CC(CO)NC(C)CCO m_269862__7198430__15157990 [0,1,0,0,0,1|1,0,0]=3 671 B9R0.34 CC(CO)SC(C)CCO m_7__6338928__14772890 [0,1,0,0,0,1|1,0,0]=3 672 B9R0.34 CCC(=O)NC(C)CCO m_270062__7625244__22005658 [0,1,0,0,0,1|0,1,1]=4 673 B9R0.34 CCC(=O)NC(C)COC m_1626__22054634__605354 [0,1,0,0,0,1|0,1,1]=4 674 B9R0.34 CCC(=O)N[C@@H](C)COC m_1626__22070066__605354 [0,1,0,0,0,1|0,1,1]=4 675 B9R0.34 CCC(=O)N[C@H](C)COC m_270062__12126196__22005658 [0,1,0,0,0,1|0,1,1]=4 676 B9R0.34 CCC(=O)OC(C)COC m_276436__14078006__14101862 [0,1,0,0,0,1|0,1,1]=4 677 B9R0.34 CCC(=O)O[C@@H](C)COC m_276436__15063888__14101862 [0,1,0,0,0,1|0,1,1]=4 678 B9R0.34 CCC(C)CC(C)CSC m_62__15767402__876088 [0,1,0,0,0,1|1,1,0]=4 679 B9R0.34 CCC(C)CN(C)CCO m_2230__4599284__6165700 [0,1,0,0,0,1|2,0,0]=4 680 B9R0.34 CCC(C)NC(C)CC#N m_2230__11757170__14247836 [0,1,0,0,0,1|2,0,0]=4 681 B9R0.34 CCC(C)NC(C)CCN m_269982__22505446__14247844 [0,1,0,0,0,1|2,0,0]=4 682 B9R0.34 CCC(C)NC(C)CCO m_269862__7198430__7200134 [0,1,0,0,0,1|1,0,0]=3 683 B9R0.34 CCC(C)NC(C)CNC m_269982__22505308__14247844 [0,1,0,0,0,1|2,0,0]=4 684 B9R0.34 CCC(C)NC(C)COC m_2230__22399526__12365980 [0,1,0,0,0,1|1,0,0]=3 685 B9R0.34 CCC(C)NC(C)CSC m_269862__7198390__7200134 [0,1,0,0,0,1|1,1,0]=4 686 B9R0.34 CCC(C)N[C@H](C)CCF m_2230__22404666__14247836 [0,1,0,0,0,1|2,0,0]=4 687 B9R0.34 CCC(C)N[C@H](C)COC m_2230__22399844__14247836 [0,1,0,0,0,1|1,0,0]=3 688 B9R0.34 CCC(C)SC(C)CCO m_7__5819074__14247828 [0,1,0,0,0,1|1,0,0]=3 689 B9R0.34 CCC(C)SC(C)COC m_7__22987942__14247828 [0,1,0,0,0,1|1,0,0]=3 690 B9R0.34 CCC(F)CN(C)CCO m_2230__679202__9787608 [0,1,0,0,0,1|2,0,0]=4 691 B9R0.34 CCC(N)CN(C)CCO m_269982__22504842__10880280 [0,1,0,0,0,1|2,0,0]=4 692 B9R0.34 CCC(O)CN(C)CCO m_2230__15766958__6165700 [0,1,0,0,0,1|1,1,0]=4 693 B9R0.34 CCCC(=O)NC(C)CO m_270062__7600328__17814498 [0,1,0,0,0,1|0,1,1]=4 694 B9R0.34 CCCC(C)NC(C)CC m_2230__22399526__9818502 [0,1,0,0,0,1|2,0,0]=4 695 B9R0.34 CCCC(C)NC(C)CCl m_2230__22399894__9818502 [0,1,0,0,0,1|2,0,0]=4 696 B9R0.34 CCCC(C)NC(C)CF m_2230__22397382__22994052 [0,1,0,0,0,1|2,0,0]=4 697 B9R0.34 CCCC(C)NC(C)CO m_269862__8257236__15157990 [0,1,0,0,0,1|1,0,0]=3 698 B9R0.34 CCCC(C)N[C@H](C)CF m_2230__22399906__9818502 [0,1,0,0,0,1|2,0,0]=4 699 B9R0.34 CCCC(C)N[C@H](C)CN m_272690__11349326__11346328 [0,1,0,0,0,1|2,0,0]=4 700 B9R0.34 CCCC(C)N[C@H](C)CO m_2230__22399532__9818502 [0,1,0,0,0,1|1,0,0]=3 701 B9R0.34 CCCC(C)SC(C)CC m_7__14428530__14247828 [0,1,0,0,0,1|2,0,0]=4 702 B9R0.34 CCCC(C)SC(C)CO m_7__6338928__6493860 [0,1,0,0,0,1|1,0,0]=3 703 B9R0.34 CCCC(C)S[C@@H](C)CN m_7__20871330__6493860 [0,1,0,0,0,1|2,0,0]=4 704 B9R0.34 CCCN(C)CC(C)CO m_2230__5903708__13271112 [0,1,0,0,0,1|2,0,0]=4 705 B9R0.34 CCN(C)CC(C)CCO m_2230__22406006__22383854 [0,1,0,0,0,1|2,0,0]=4 706 B9R0.34 CCN(C)CC(C)COC m_2230__21584870__22383854 [0,1,0,0,0,1|2,0,0]=4 707 B9R0.34 CCNC(=O)NC(C)CO m_487__515764__16733542 [0,1,0,0,0,1|0,1,1]=4 708 B9R0.34 CCNC(=O)N[C@@H](C)CO m_2554__13191904__951600 [0,1,0,0,0,1|0,1,1]=4 709 B9R0.34 CCNC(=O)N[C@H](C)CO m_68__23349124__85388 [0,1,0,0,0,1|0,1,1]=4 710 B9R0.34 CCNC(C)CC(C)CC m_2230__22399368__22383854 [0,1,0,0,0,1|2,0,0]=4 711 B9R0.34 CCOC(=O)NC(C)CO m_282070__22207690__22150950 [0,1,0,0,0,1|0,1,1]=4 712 B9R0.34 CCOC(C)SC(C)CO m_7__6338928__13420948 [0,1,0,0,0,1|1,0,0]=3 713 B9R0.34 CCOC(C)S[C@@H](C)CN m_7__20871330__13420948 [0,1,0,0,0,1|2,0,0]=4 714 B9R0.34 CCS(=O)CC(C)COC m_265282__20064962__4273536 [0,1,0,0,0,1|1,1,0]=4 715 B9R0.34 CC[C@@H](N)CN(C)CCO m_269982__22515300__25012496 [0,1,0,0,0,1|2,0,0]=4 716 B9R0.34 CNCC(=O)N[C@H](C)CO m_240690__15704534__7368582 [0,1,0,0,0,1|0,1,1]=4 717 B9R0.34 CNCC(C)NC(C)CN m_269982__22505308__13769420 [0,1,0,0,0,1|2,0,0]=4 718 B9R0.34 COCC(=O)NC(C)CO m_270062__7600328__15529360 [0,1,0,0,0,1|0,1,1]=4 719 B9R0.34 COCC(C)NC(C)CCl m_2230__22399894__12365980 [0,1,0,0,0,1|2,0,0]=4 720 B9R0.34 COCC(C)NC(C)CF m_270004__10214060__8844972 [0,1,0,0,0,1|2,0,0]=4 721 B9R0.34 COCC(C)N[C@H](C)CF m_270004__13811084__8844972 [0,1,0,0,0,1|2,0,0]=4 722 B9R0.34 COCC(C)N[C@H](C)CN m_269982__22505378__12365986 [0,1,0,0,0,1|2,0,0]=4 723 B9R0.34 COCC(C)N[C@H](C)CO m_2230__22399532__12365980 [0,1,0,0,0,1|1,0,0]=3 724 B9R0.34 COCC(C)SC(C)CO m_7__6338928__6339266 [0,1,0,0,0,1|1,0,0]=3 725 B9R0.34 COC[C@@H](C)NC(C)CF m_2230__22399844__22994052 [0,1,0,0,0,1|2,0,0]=4 726 B9R0.34 COC[C@@H](C)NC(C)CO m_269862__8260304__15157990 [0,1,0,0,0,1|1,0,0]=3 727 B9R0.34 CSCC(=O)NC(C)CO m_527__564612__237535 [0,1,0,0,0,1|0,1,1]=4 728 B9R0.34 CSCC(C)NC(C)CF m_2230__22400632__22994052 [0,1,0,0,0,1|2,0,0]=4 729 B9R0.34 CSCC(C)NC(C)CO m_269862__7198390__15157990 [0,1,0,0,0,1|1,0,0]=3 730 B9R0.34 CSCC(C)N[C@H](C)CF m_270004__13811084__15781876 [0,1,0,0,0,1|2,0,0]=4 731 B9R0.34 CSCC(C)N[C@H](C)CO m_269862__7194864__16464016 [0,1,0,0,0,1|1,0,0]=3 732 B9R0.34 C[C@H](CO)NC(=O)CCN m_240690__15704534__3025680 [0,1,0,0,0,1|0,1,1]=4 733 B9R0.42 CC(=O)C(C)SC(C)CO m_7__6506312__17610454 [0,1,0,0,0,1|1,0,1]=4 734 B9R0.42 CC(C)C(C)N[C@H](C)CF m_270004__13811084__8334612 [0,1,0,0,0,1|2,0,0]=4 735 B9R0.42 CC(C)C(C)N[C@H](C)CN m_272690__11349326__11346054 [0,1,0,0,0,1|2,0,0]=4 736 B9R0.42 CC(C)C(C)N[C@H](C)CO m_269862__7194864__7200270 [0,1,0,0,0,1|1,0,0]=3 737 B9R0.42 CC(C)C(C)S[C@@H](C)CN m_7__20871330__9435972 [0,1,0,0,0,1|2,0,0]=4 738 B9R0.42 CC(CF)NC(C)C(C)C m_270004__10214060__8334612 [0,1,0,0,0,1|2,0,0]=4 739 B9R0.42 CC(CF)N[C@@H](C)C(C)C m_2230__22399838__22994052 [0,1,0,0,0,1|2,0,0]=4 740 B9R0.42 CC(CF)N[C@H](C)[C@H](C)O m_2230__22400278__22994052 [0,1,0,0,0,1|2,0,0]=4 741 B9R0.42 CC(CO)CN(C)C(C)C m_2230__5903708__680832 [0,1,0,0,0,1|2,0,0]=4 742 B9R0.42 CC(CO)NC(=O)C(C)C m_270062__7600328__13861800 [0,1,0,0,0,1|0,1,1]=4 743 B9R0.42 CC(CO)NC(=O)[C@@H](C)F m_22__564376__24597924 [0,1,0,0,0,1|0,1,1]=4 744 B9R0.42 CC(CO)NC(=O)[C@@H](C)O m_22__564376__17541882 [0,1,0,0,0,1|0,1,1]=4 745 B9R0.42 CC(CO)NC(C)C(C)C m_269862__7193022__15157990 [0,1,0,0,0,1|1,0,0]=3 746 B9R0.42 CC(CO)NC(C)C(F)F m_269862__12915860__15157990 [0,1,0,0,0,1|2,0,0]=4 747 B9R0.42 CC(CO)N[C@H](C)[C@@H](C)O m_269862__21631390__15157990 [0,1,0,0,0,1|1,0,0]=3 748 B9R0.42 CC(CO)SC(C)C(C)C m_7__6338928__9435972 [0,1,0,0,0,1|1,0,0]=3 749 B9R0.42 CC(N)C(=O)N[C@H](C)CO m_240690__15704534__3025692 [0,1,0,0,0,1|0,1,1]=4 750 B9R0.42 CCC(=O)N[C@@H](C)[C@H](C)O m_22__24192042__58887 [0,1,0,0,0,1|0,1,1]=4 751 B9R0.42 CCC(=O)N[C@H](C)[C@@H](C)O m_270062__21631394__22005658 [0,1,0,0,0,1|0,1,1]=4 752 B9R0.42 CCC(C)NC(C)C(=O)O m_273456__11063432__13259262 [0,1,0,0,0,1|1,0,1]=4 753 B9R0.42 CCC(C)NC(C)C(C)C m_269862__7192700__7200270 [0,1,0,0,0,1|2,0,0]=4 754 B9R0.42 CCC(C)NC(C)C(F)F m_2230__22394972__14247836 [0,1,0,0,0,1|2,0,0]=4 755 B9R0.42 CCC(C)N[C@@H](C)C(C)C m_2230__22399838__14247836 [0,1,0,0,0,1|2,0,0]=4 756 B9R0.42 CCC(C)N[C@H](C)[C@H](C)O m_2230__22400278__14247836 [0,1,0,0,0,1|1,0,0]=3 757 B9R0.42 CCC(C)SC(C)C(C)C m_7__6286942__14247828 [0,1,0,0,0,1|2,0,0]=4 758 B9R0.6 CC(C)C(C)N(C)CCO m_2230__1932980__6165700 [0,2,0,0,0,0|2,0,0]=4 759 B9R0.6 CC(C)N(C)C(C)CCO m_2230__11733728__680832 [0,2,0,0,0,0|2,0,0]=4 760 B9R0.6 CCNC(C)C(C)C(=O)O m_270122__11340508__22567416 [0,2,0,0,0,0|1,0,1]=4 761 B9R0.6 CCNC(C)C(O)C(C)C m_2230__22400674__22383854 [0,2,0,0,0,0|1,1,0]=4 762 B9R0.25 CCN(C)C(C)C(C)(C)O m_2230__10707092__22383854 [0,2,0,0,0,0|2,0,0]=4 763 B9R0.28 CC(C)S(=O)(=O)C(C)CO m_2714__6338932__11944520 [0,2,0,0,0,0|1,1,0]=4 764 B9R0.29 CCC(C)[C@H](NC)C(F)F m_2230__22394620__2463448 [0,2,0,0,0,0|2,0,0]=4 765 B9R0.29 CCN(C(=O)C)[C@@H](C)CO m_270062__16415072__15585492 [0,2,0,0,0,0|1,1,0]=4 766 B9R0.29 CCN(C(=O)C)[C@H](C)CO m_22__10429776__58844 [0,2,0,0,0,0|1,1,0]=4 767 B9R0.29 CCN(C)[C@@H](CO)C(C)C m_270004__20819272__24715004 [0,2,0,0,0,0|2,0,0]=4 768 B9R0.29 CCN(C)[C@H](CO)C(C)C m_270004__25072858__24715004 [0,2,0,0,0,0|2,0,0]=4 769 B9R0.32 CCS(=O)(=O)C(C)C(C)O m_2714__6286576__862376 [0,2,0,0,0,0|1,1,0]=4 770 B9R0.41 CCC(CO)N(C)C(C)C m_2230__10642192__680832 [0,2,0,0,0,0|2,0,0]=4 771 B9R0.41 CCC(NC)C(O)C(C)C m_2230__22399120__2463448 [0,2,0,0,0,0|1,1,0]=4 772 B9R0.8 C#CCCN(C)C(C)CO m_2230__7785428__9420240 [0,2,0,0,0,0|2,0,0]=4 773 B9R0.8 C#CCSC(C)C(C)CO m_7__22987758__6266 [0,2,0,0,0,0|1,0,1]=4 774 B9R0.8 C=CCCN(C)C(C)CO m_2230__7785428__8929530 [0,2,0,0,0,0|2,0,0]=4 775 B9R0.8 C=CCNC(C)C(C)CC m_2230__8270336__680312 [0,2,0,0,0,0|2,0,0]=4 776 B9R0.8 C=CCNC(C)C(C)CO m_2230__8740410__680312 [0,2,0,0,0,0|1,0,1]=4 777 B9R0.8 C=CCNC(C)C(O)CC m_2230__22403482__680312 [0,2,0,0,0,0|1,1,0]=4 778 B9R0.8 C=CCSC(C)C(C)CC m_7__22987946__10953804 [0,2,0,0,0,0|2,0,0]=4 779 B9R0.8 C=CCSC(C)C(C)CO m_7__22987758__3427024 [0,2,0,0,0,0|1,0,1]=4 780 B9R0.8 CC#CCN(C)C(C)CO m_2230__7785428__5581034 [0,2,0,0,0,0|2,0,0]=4 781 B9R0.8 CC(CO)C(=O)NCCF m_22__9706072__16784146 [0,2,0,0,0,0|0,1,1]=4 782 B9R0.8 CC(CO)C(=O)NCCN m_240690__3025612__21409940 [0,2,0,0,0,0|0,1,1]=4 783 B9R0.8 CC(CO)C(=O)NCCO m_22__57745__16784146 [0,2,0,0,0,0|0,1,1]=4 784 B9R0.8 CC(CO)C(C)NCC#N m_2230__8740410__680932 [0,2,0,0,0,0|1,0,1]=4 785 B9R0.8 CC(CO)C(C)NCCF m_2230__8740410__22320836 [0,2,0,0,0,0|1,0,0]=3 786 B9R0.8 CC(CO)C(C)NCCO m_2230__8740410__6165700 [0,2,0,0,0,0|1,0,0]=3 787 B9R0.8 CC(CO)C(C)SCC#N m_7__22987758__5055 [0,2,0,0,0,0|1,0,1]=4 788 B9R0.8 CC(CO)C(C)SCCF m_7__22987758__22320828 [0,2,0,0,0,0|1,0,0]=3 789 B9R0.8 CC(CO)C(C)SCCO m_7__22987758__102708 [0,2,0,0,0,0|1,0,0]=3 790 B9R0.8 CC(CO)N(C)CCC#N m_2230__7785428__680296 [0,2,0,0,0,0|2,0,0]=4 791 B9R0.8 CC(CO)N(C)CCCF m_2230__7785428__16896936 [0,2,0,0,0,0|2,0,0]=4 792 B9R0.8 CC(CO)N(C)CCCO m_2230__7785428__680950 [0,2,0,0,0,0|2,0,0]=4 793 B9R0.8 CC=CCN(C)C(C)CO m_2230__7785428__681024 [0,2,0,0,0,0|2,0,0]=4 794 B9R0.8 CCC(=O)C(C)SCCO m_7__128807__1044276 [0,2,0,0,0,0|0,1,1]=4 795 B9R0.8 CCC(C)C(C)NCC#N m_2230__8270336__680932 [0,2,0,0,0,0|2,0,0]=4 796 B9R0.8 CCC(C)C(C)NCCF m_2230__8270336__22320836 [0,2,0,0,0,0|2,0,0]=4 797 B9R0.8 CCC(C)C(C)NCCN m_272690__11349186__11345984 [0,2,0,0,0,0|2,0,0]=4 798 B9R0.8 CCC(C)C(C)NCCO m_2230__8270336__6165700 [0,2,0,0,0,0|1,0,0]=3 799 B9R0.8 CCC(C)C(C)SCCN m_7__20871276__10953804 [0,2,0,0,0,0|2,0,0]=4 800 B9R0.8 CCC(C)C(C)SCCO m_7__128807__10953804 [0,2,0,0,0,0|1,0,0]=3 801 B9R0.8 CCC(C)N(C)CCCO m_2230__7462418__680950 [0,2,0,0,0,0|2,0,0]=4 802 B9R0.8 CCC(C)N(C)CCOC m_2230__7462418__666874 [0,2,0,0,0,0|2,0,0]=4 803 B9R0.8 CCC(O)C(C)NCC#N m_2230__22403482__680932 [0,2,0,0,0,0|1,1,0]=4 804 B9R0.8 CCC(O)C(C)NCCF m_2230__22403482__22320836 [0,2,0,0,0,0|1,1,0]=4 805 B9R0.8 CCC(O)C(C)NCCO m_2230__22403482__6165700 [0,2,0,0,0,0|0,1,0]=3 806 B9R0.8 CCCCN(C)C(C)CO m_2230__7785428__22993830 [0,2,0,0,0,0|2,0,0]=4 807 B9R0.8 CCCNC(=O)C(C)CO m_22__58027__16784146 [0,2,0,0,0,0|0,1,1]=4 808 B9R0.8 CCCNC(C)C(C)CC m_269862__7192572__7200196 [0,2,0,0,0,0|2,0,0]=4 809 B9R0.8 CCCNC(C)C(C)CO m_2230__8740410__13271112 [0,2,0,0,0,0|1,0,0]=3 810 B9R0.8 CCCNC(C)C(O)CC m_2230__22403482__13271112 [0,2,0,0,0,0|1,1,0]=4 811 B9R0.8 CCCN[C@@H](C)[C@H](N)CO m_269982__22505312__13271120 [0,2,0,0,0,0|2,0,0]=4 812 B9R0.8 CCCSC(C)C(C)CC m_7__22986886__10953804 [0,2,0,0,0,0|2,0,0]=4 813 B9R0.8 CCCSC(C)C(C)CO m_7__22987758__14390332 [0,2,0,0,0,0|1,0,0]=3 814 B9R0.8 CCN(C)C(C)CCCO m_2230__22407882__22383854 [0,2,0,0,0,0|2,0,0]=4 815 B9R0.8 CCNCC(C)C(C)CC m_270004__23851126__24715004 [0,2,0,0,0,0|2,0,0]=4 816 B9R0.8 CCNCC(O)C(C)CC m_270004__8295360__24715004 [0,2,0,0,0,0|1,1,0]=4 817 B9R0.8 CCNNC(=O)C(C)CO m_240690__21583724__21409940 [0,2,0,0,0,0|0,1,1]=4 818 B9R0.8 CCONC(=O)C(C)CO m_22__303688__16784146 [0,2,0,0,0,0|0,1,1]=4 819 B9R0.8 COC(C)C(C)NCCO m_269862__7193048__7201638 [0,2,0,0,0,0|2,0,0]=4 820 B9R0.8 COC(C)C(C)SCCO m_7__22988026__102708 [0,2,0,0,0,0|2,0,0]=4 821 B9R0.8 COCCN(C)C(C)CO m_2230__7785428__666874 [0,2,0,0,0,0|2,0,0]=4 822 B9R0.8 COCSC(C)C(C)CO m_7__22987758__6762 [0,2,0,0,0,0|1,0,0]=3 823 B9R0.8 COCSC(C)C(C)OC m_7__22988026__6762 [0,2,0,0,0,0|2,0,0]=4 824 B9R0.8 CO[C@@H](C)[C@H](C)NCCO m_2230__22397856__6165700 [0,2,0,0,0,0|2,0,0]=4 825 B9R0.8 CSCCN(C)C(C)CO m_2230__7785428__681390 [0,2,0,0,0,0|2,0,0]=4 826 B9R0.8 CSCSC(C)C(C)CO m_7__22987758__10542644 [0,2,0,0,0,0|1,0,0]=3 827 B9R0.8 C[C@H](NCCF)[C@H](N)CO m_269982__22505312__22320816 [0,2,0,0,0,0|2,0,0]=4 828 B9R0.8 C[C@H](NCCN)[C@H](N)CO m_269982__22505312__14439794 [0,2,0,0,0,0|2,0,0]=4 829 B9R0.8 C[C@H](NCCO)[C@H](N)CO m_269982__22505312__10880280 [0,2,0,0,0,0|2,0,0]=4 830 B9R0.12 C=CCN(CC)[C@@H](C)CO m_2230__10548330__680312 [0,2,0,0,0,0|2,0,0]=4 831 B9R0.12 CCC(C)C(C=NO)OC m_4__388124__10684566 [0,2,0,0,0,0|1,0,1]=4 832 B9R0.12 CCC(C)N(CC)CCO m_2230__10210864__22383854 [0,2,0,0,0,0|2,0,0]=4 833 B9R0.12 CCC(C)N(CCO)OC m_2230__9111768__14247836 [0,2,0,0,0,0|2,0,0]=4 834 B9R0.12 CCC(COC)N(C)CC m_2230__22408302__22383854 [0,2,0,0,0,0|2,0,0]=4 835 B9R0.12 CCC(CSC)N(C)CC m_2230__8266056__22383854 [0,2,0,0,0,0|2,0,0]=4 836 B9R0.12 CCCN(CC)[C@@H](C)CO m_2230__10548330__13271112 [0,2,0,0,0,0|2,0,0]=4 837 B9R0.12 CCN(CC#N)[C@@H](C)CO m_2230__10548330__680932 [0,2,0,0,0,0|2,0,0]=4 838 B9R0.12 CCN(CCF)[C@@H](C)CO m_2230__10548330__22320836 [0,2,0,0,0,0|2,0,0]=4 839 B9R0.12 CCN(CCO)[C@@H](C)CO m_2230__10548330__6165700 [0,2,0,0,0,0|1,1,0]=4 840 B9R0.12 CCN[C@H](CO)[C@@H](C)CC m_2230__18901738__22383854 [0,2,0,0,0,0|1,0,0]=3 841 B9R0.12 CC[C@H](C)N(CC)CCO m_2230__22408030__6165700 [0,2,0,0,0,0|2,0,0]=4 842 B9R0.19 CCC(C)(C)N(C)CCO m_2230__9479758__6165700 [0,2,0,0,0,0|2,0,0]=4 843 B9R0.19 CCNC(=O)C(C)(C)CO m_240690__7350950__22880072 [0,2,0,0,0,0|0,1,1]=4 844 B9R0.19 CCNC(=O)C(C)(N)CO m_240690__7350950__13287642 [0,2,0,0,0,0|0,1,1]=4 845 B9R0.19 CCNC(=O)C(C)(O)CO m_22__57815__10684428 [0,2,0,0,0,0|0,1,1]=4 846 B9R0.19 CCNC(C)C(C)(C)CC m_269862__7865270__10718614 [0,2,0,0,0,0|2,0,0]=4 847 B9R0.19 CCNC(C)C(C)(C)CO m_2230__22403178__22383854 [0,2,0,0,0,0|1,0,0]=3 848 B9R0.19 CCOC(=O)C(C)(C)CO m_1458__2759050__486190 [0,2,0,0,0,0|0,1,1]=4 849 B9R0.19 CCS(=O)(=O)C(C)CCO m_2714__6165224__862376 [0,2,0,0,0,0|1,1,0]=4 850 B9R0.23 C=C(C)CN(C)C(C)CO m_2230__7785428__666852 [0,2,0,0,0,0|2,0,0]=4 851 B9R0.23 CC(=O)CN(C)C(C)CO m_2230__7785428__12369270 [0,2,0,0,0,0|2,0,0]=4 852 B9R0.23 CC(=O)NC(C)C(C)CO m_270062__16414716__15585492 [0,2,0,0,0,0|1,0,1]=4 853 B9R0.23 CC(C)CN(C)C(C)CO m_2230__7785428__681214 [0,2,0,0,0,0|2,0,0]=4 854 B9R0.23 CC(C)NC(=O)C(C)CO m_22__4929926__16784146 [0,2,0,0,0,0|0,1,1]=4 855 B9R0.23 CC(C)NC(C)C(C)CO m_2230__8740410__680832 [0,2,0,0,0,0|1,0,0]=3 856 B9R0.23 CC(C)N[C@@H](C)[C@H](N)CO m_269982__22505312__7393356 [0,2,0,0,0,0|2,0,0]=4 857 B9R0.23 CC(C)SC(C)C(C)CO m_7__22987758__5048 [0,2,0,0,0,0|1,0,0]=3 858 B9R0.23 CC(CO)N(C)CC(F)F m_2230__7785428__8371038 [0,2,0,0,0,0|2,0,0]=4 859 B9R0.23 CC(F)CN(C)C(C)CO m_2230__7785428__16970752 [0,2,0,0,0,0|2,0,0]=4 860 B9R0.23 CC(O)CN(C)C(C)CO m_2230__7785428__9736146 [0,2,0,0,0,0|2,0,0]=4 861 B9R0.23 CCC(C)C(C)NC(C)C m_2230__8270336__680832 [0,2,0,0,0,0|2,0,0]=4 862 B9R0.23 CCC(C)N(C)CC(C)O m_2230__7462418__9736146 [0,2,0,0,0,0|2,0,0]=4 863 B9R0.23 CCC(O)C(C)NC(C)C m_2230__22403482__680832 [0,2,0,0,0,0|1,1,0]=4 864 B9R0.23 CCN(C)[C@H](C)CC(=O)O m_270122__22530920__22567416 [0,2,0,0,0,0|2,0,0]=4 865 B9R0.35 C=CCC(C)C(C)NCC m_269862__7865270__7201218 [0,2,0,0,0,0|2,0,0]=4 866 B9R0.35 CC(CCN)N(C)CCO m_269982__22515300__16969680 [0,2,0,0,0,0|2,0,0]=4 867 B9R0.35 CC(CCO)N(C)CCF m_2230__11733728__22320836 [0,2,0,0,0,0|2,0,0]=4 868 B9R0.35 CC(CCO)N(C)CCO m_2230__679202__13397858 [0,2,0,0,0,0|2,0,0]=4 869 B9R0.35 CCCC(C)C(C)NCC m_2230__22398864__22383854 [0,2,0,0,0,0|2,0,0]=4 870 B9R0.35 CCCC(C)N(C)CCO m_2230__679538__6165700 [0,2,0,0,0,0|2,0,0]=4 871 B9R0.35 CCCN(C)C(C)CCO m_2230__2261920__13397858 [0,2,0,0,0,0|2,0,0]=4 872 B9R0.35 CCCN(C)C(C)COC m_2230__2261920__12365980 [0,2,0,0,0,0|2,0,0]=4 873 B9R0.35 CCCN(C)[C@@H](C)COC m_2230__22408216__13271112 [0,2,0,0,0,0|2,0,0]=4 874 B9R0.35 CCCN(C)[C@H](C)CCO m_2230__22409128__13271112 [0,2,0,0,0,0|2,0,0]=4 875 B9R0.35 CCNC(=O)C(C)CCO m_22__57815__14468656 [0,2,0,0,0,0|0,1,1]=4 876 B9R0.35 CCNC(=O)C(C)COC m_22__57815__3308154 [0,2,0,0,0,0|0,1,1]=4 877 B9R0.35 CCNC(C)C(C)CCCl m_270004__8160850__24722624 [0,2,0,0,0,0|2,0,0]=4 878 B9R0.35 CCNC(C)C(C)COC m_2230__22400724__22383854 [0,2,0,0,0,0|1,0,0]=3 879 B9R0.35 CCOC(=O)C(C)COC m_1458__3308160__1327610 [0,2,0,0,0,0|0,1,1]=4 880 B9R0.35 CNCC(C)N(C)CCO m_269982__22505106__10880280 [0,2,0,0,0,0|2,0,0]=4 881 B9R0.35 COCC(C)N(C)CCN m_269982__10894792__12365986 [0,2,0,0,0,0|2,0,0]=4 882 B9R0.35 COCC(C)N(C)CCO m_2230__679202__12365980 [0,2,0,0,0,0|2,0,0]=4 883 B9R0.35 COC[C@H](C)N(C)CCF m_2230__22408216__22320836 [0,2,0,0,0,0|2,0,0]=4 884 B9R0.35 COC[C@H](C)N(C)CCO m_2230__22408216__6165700 [0,2,0,0,0,0|2,0,0]=4 885 B9R0.35 CSCC(C)N(C)CCO m_2230__5137432__6165700 [0,2,0,0,0,0|2,0,0]=4 886 B9R0.35 C[C@H](CCO)N(C)CCF m_2230__22409128__22320836 [0,2,0,0,0,0|2,0,0]=4 887 B9R0.35 C[C@H](CCO)N(C)CCO m_2230__22409128__6165700 [0,2,0,0,0,0|2,0,0]=4 888 B9R0.37 CCC(C#N)N(C)CCO m_2230__22392504__6165700 [0,2,0,0,0,0|2,0,0]=4 889 B9R0.37 CCC(CC)N(C)CCO m_2230__7837978__2463448 [0,2,0,0,0,0|2,0,0]=4 890 B9R0.37 CCC(CO)N(C)CCF m_2230__10642192__22320836 [0,2,0,0,0,0|2,0,0]=4 891 B9R0.37 CCC(CO)N(C)CCN m_269982__10894792__17567408 [0,2,0,0,0,0|2,0,0]=4 892 B9R0.37 CCC(CO)N(C)CCO m_2230__10642192__6165700 [0,2,0,0,0,0|1,1,0]=4 893 B9R0.37 CCCC(C)C(CC)NC m_269862__7193148__7201552 [0,2,0,0,0,0|2,0,0]=4 894 B9R0.37 CCCC(C)C(CO)NC m_2230__11682290__2463448 [0,2,0,0,0,0|1,0,0]=3 895 B9R0.37 CCCC(O)C(CO)NC m_2230__22399994__2463448 [0,2,0,0,0,0|0,1,0]=3 896 B9R0.37 CCCN(C)C(CC)CO m_2230__2261920__12622220 [0,2,0,0,0,0|2,0,0]=4 897 B9R0.37 CCN(CC)C(C)CCO m_2230__678900__13397858 [0,2,0,0,0,0|2,0,0]=4 898 B9R0.37 CCN(CC)C(C)COC m_270004__8132928__24715004 [0,2,0,0,0,0|2,0,0]=4 899 B9R0.37 CCNC(=O)C(CC)CO m_22__57815__11678640 [0,2,0,0,0,0|0,1,1]=4 900 B9R0.37 CCNC(=O)C(CN)CO m_240690__7350950__21393008 [0,2,0,0,0,0|0,1,1]=4 901 B9R0.37 CCNC(=O)C(CO)OC m_22__57815__22324112 [0,2,0,0,0,0|0,1,1]=4 902 B9R0.37 CCNC(C)C(CC)CC m_2230__8737788__22383854 [0,2,0,0,0,0|2,0,0]=4 903 B9R0.37 CCNC(C)C(CO)SC m_2230__22400868__22383854 [0,2,0,0,0,0|1,0,0]=3 904 B9R0.37 CCOC(=O)C(CO)OC m_1458__22324114__1327610 [0,2,0,0,0,0|0,1,1]=4 905 B9R0.37 CCOC(=O)[C@H](CO)NC m_2230__22395860__2463448 [0,2,0,0,0,0|0,1,1]=4 906 B9R0.60 CC(CO)S(=O)(=O)CCF m_2714__6338932__8846984 [0,2,0,0,0,0|1,1,0]=4 907 B9R0.60 CC(CO)S(=O)(=O)CCO m_2714__6338932__3173174 [0,2,0,0,0,0|1,1,0]=4 908 B9R0.60 CCN(C)C(C)(C)CCO m_270004__24776920__24715004 [0,2,0,0,0,0|2,0,0]=4 909 B9R0.60 CCN(C)C(C)(C)COC m_2230__10435710__22383854 [0,2,0,0,0,0|2,0,0]=4 910 B9R0.31 CCS(=O)(=O)C(C)(C)CO m_2714__10428524__862376 [0,2,0,0,0,0|1,1,0]=4 911 B9R0.71 CCC(NC)C(C)(C)CC m_269862__7193148__12864910 [0,2,0,0,0,0|2,0,0]=4 912 B9R0.36 CCC(CO)N(CC)CC m_2230__678900__12622220 [0,2,0,0,0,0|2,0,0]=4 913 B9R0.36 CCN(CC)C(CO)CO m_270004__24170042__24715004 [0,2,0,0,0,0|2,0,0]=4 914 B9R0.36 CC[C@@H](CO)N(CC)CC m_270004__24170884__24715004 [0,2,0,0,0,0|2,0,0]=4 915 B7R1.1 CCN1CCCC1 m_2230__678722__22383854 [1,0,0,1,0,0|2,0,0]=4 916 B7R1.1 CNC1CCCC1 m_207__134027__121596 [1,0,0,1,0,0|2,0,0]=4 917 B7R1.1 CSC1CCCC1 m_62__875850__10178584 [1,0,0,1,0,0|2,0,0]=4 918 B7R1.1 CSC1CCOC1 m_62__875850__10903820 [1,0,0,1,0,0|2,0,0]=4 919 B7R1.1 ON=C1CCCC1 m_4__388124__66759 [1,0,0,1,0,0|1,0,1]=4 920 B7R1.2 CC1CCN(C1)C m_2230__6813990__2463448 [1,0,0,1,0,0|2,0,0]=4 921 B7R1.2 CN1CC[C@@H](C1)O m_2230__3351214__2463448 [1,0,0,1,0,0|2,0,0]=4 922 B7R1.3 CN1CCCCC1 m_2230__679042__2463448 [1,0,0,1,0,0|2,0,0]=4 923 B7R1.3 CN1CCOCC1 m_2230__665308__2463448 [1,0,0,1,0,0|2,0,0]=4 924 B7R1.4 CC1CCCN1C m_2230__6338494__2463448 [1,0,0,1,0,0|2,0,0]=4 925 B7R1.5 CCNC1CC1C m_270004__8294846__24715004 [1,0,0,1,0,0|2,0,0]=4 926 B7R1.5 CSCC1CC1C m_62__12216592__876088 [1,0,0,1,0,0|2,0,0]=4 927 B7R1.5 CSC[C@@H]1C[C@H]1C m_62__875850__23861442 [1,0,0,1,0,0|2,0,0]=4 928 B7R1.6 CCNC1COC1 m_269862__7865270__7931470 [1,0,0,1,0,0|1,0,0]=3 929 B7R1.6 CCNC1CSC1 m_270004__13270386__24715004 [1,0,0,1,0,0|1,1,0]=4 930 B7R1.6 CCSC1CCC1 m_7__10684076__5047 [1,0,0,1,0,0|2,0,0]=4 931 B7R1.6 CCSC1CNC1 m_7__22987816__5047 [1,0,0,1,0,0|2,0,0]=4 932 B7R1.6 CCSC1COC1 m_7__13420946__5047 [1,0,0,1,0,0|1,0,0]=3 933 B7R1.6 CCSC1CSC1 m_7__20064714__5047 [1,0,0,1,0,0|1,1,0]=4 934 B7R1.6 CNCC1COC1 m_207__134027__22332602 [1,0,0,1,0,0|1,0,0]=3 935 B7R1.6 CSCC1CCC1 m_62__6007776__876088 [1,0,0,1,0,0|2,0,0]=4 936 B7R1.6 CSCC1COC1 m_62__875850__16613884 [1,0,0,1,0,0|1,0,0]=3 937 B7R1.8 CCN1CC[C@H]1C m_270004__24224170__24715004 [1,0,0,1,0,0|2,0,0]=4 938 B7R1.8 CN1CCC1CO m_2230__13428546__2463448 [1,0,0,1,0,0|2,0,0]=4 939 B7R1.10 CC1CC(=NO)C1 m_4__388124__10542474 [1,0,0,1,0,0|1,0,1]=4 940 B7R1.10 CCN1CC(C1)C m_270004__9576442__24715004 [1,0,0,1,0,0|2,0,0]=4 941 B7R1.15 CC1CN(C1C)C m_2230__10547152__2463448 [1,0,0,1,0,0|2,0,0]=4 942 B7R1.21 CCNC1(CC1)C m_2230__22404332__22383854 [1,0,0,1,0,0|2,0,0]=4 943 B7R1.21 CNCC1(CC1)C m_207__134027__9439020 [1,0,0,1,0,0|2,0,0]=4 944 B7R1.22 CC(=NO)C1CC1 m_4__388124__66854 [1,0,0,1,0,0|1,0,1]=4 945 B7R1.22 CCN(C)C1CC1 m_2230__804672__2463448 [1,0,0,1,0,0|2,0,0]=4 946 B7R1.22 CN[C@@H](C)C1CC1 m_2230__22400112__2463448 [1,0,0,1,0,0|2,0,0]=4 947 B7R1.25 CNC1(CCC1)C m_2230__22404308__2463448 [1,0,0,1,0,0|2,0,0]=4 948 B7R1.27 CNC1(CC1C)C m_2230__22397712__2463448 [1,0,0,1,0,0|2,0,0]=4 949 B7R1.12 CC1CC1N(C)C m_2230__16770468__2463448 [1,0,0,1,0,0|2,0,0]=4 950 B7R1.18 CN(C)C1CCC1 m_2230__6008210__2463448 [1,0,0,1,0,0|2,0,0]=4 951 B7R1.18 CN(C)C1COC1 m_2230__13570148__2463448 [1,0,0,1,0,0|2,0,0]=4 952 B7R1.19 CN(C)C1(CC1)C m_2230__19458678__2463448 [1,0,0,1,0,0|2,0,0]=4 953 B9R1.2 CCC1CN(CCS1)C m_2230__6287584__2463448 [0,0,0,1,0,1|2,0,0]=4 954 B9R1.2 CN1CCCC(C1)CO m_2230__678750__2463448 [0,0,0,1,0,1|2,0,0]=4 955 B9R1.21 CCN1CC[C@H](C1)CO m_2230__17547532__22383854 [0,0,0,1,0,1|2,0,0]=4 956 B9R1.23 CC1CC(CN1C)CO m_2230__15269176__2463448 [0,0,0,1,0,1|2,0,0]=4 957 B9R1.23 CCN1C[C@@H]([C@H](C1)O)C m_2230__13613406__22383854 [0,0,0,1,0,1|2,0,0]=4 958 B9R1.23 CCN1C[C@H]([C@@H](C1)O)C m_2230__15264148__22383854 [0,0,0,1,0,1|2,0,0]=4 959 B9R1.48 CC1COCCN(C1)C m_2230__13161110__2463448 [0,0,0,1,0,1|2,0,0]=4 960 B9R1.69 CC1CN(CCC1O)C m_2230__22405928__2463448 [0,0,0,1,0,1|2,0,0]=4 961 B9R1.69 C[C@H]1CN(CC[C@@H]1O)C m_2230__21246392__2463448 [0,0,0,1,0,1|2,0,0]=4 962 B9R1.78 CC(CO)N[C@@H]1C[C@@H]1F m_269862__14595886__15157990 [0,0,0,1,0,1|2,0,0]=4 963 B9R1.78 CC(CO)N[C@@H]1C[C@H]1C m_269862__12364724__15157990 [0,0,0,1,0,1|1,0,0]=3 964 B9R1.78 CC(CO)N[C@@H]1C[C@H]1O m_269862__23835522__15157990 [0,0,0,1,0,1|2,0,0]=4 965 B9R1.78 CC(CO)N[C@H]1C[C@H]1F m_269862__17757774__15157990 [0,0,0,1,0,1|2,0,0]=4 966 B9R1.78 CCC(=O)N[C@@H]1C[C@H]1O m_270062__23835526__22005658 [0,0,0,1,0,1|0,1,1]=4 967 B9R1.78 CCC(C)N[C@@H]1C[C@@H]1F m_269862__14595886__7200134 [0,0,0,1,0,1|2,0,0]=4 968 B9R1.78 CCC(C)N[C@@H]1C[C@H]1C m_269862__12364724__7200134 [0,0,0,1,0,1|2,0,0]=4 969 B9R1.78 CCC(C)N[C@@H]1C[C@H]1O m_269862__23835522__7200134 [0,0,0,1,0,1|1,0,0]=3 970 B9R1.78 CCC(C)N[C@H]1C[C@H]1F m_269862__17757774__7200134 [0,0,0,1,0,1|2,0,0]=4 971 B9R1.79 CC(CCl)NC1CCC1 m_2230__22399894__7832192 [0,0,0,1,0,1|2,0,0]=4 972 B9R1.79 CC(CCl)NC1COC1 m_2230__22399894__14925342 [0,0,0,1,0,1|2,0,0]=4 973 B9R1.79 CC(CO)NC1CCC1 m_269862__10892244__15157990 [0,0,0,1,0,1|1,0,0]=3 974 B9R1.79 CC(CO)SC1CCC1 m_7__10684076__17610454 [0,0,0,1,0,1|1,0,0]=3 975 B9R1.79 CC(CO)SC1CNC1 m_7__22987816__17610454 [0,0,0,1,0,1|2,0,0]=4 976 B9R1.79 CC(CO)SC1COC1 m_7__13420946__17610454 [0,0,0,1,0,1|2,0,0]=4 977 B9R1.79 CC(CO)SC1CSC1 m_7__20064714__17610454 [0,0,0,1,0,1|2,0,0]=4 978 B9R1.79 CCC(=O)NC1COC1 m_270062__16411944__22005658 [0,0,0,1,0,1|0,1,1]=4 979 B9R1.79 CCC(C)NC1CCC1 m_269862__10892244__7200134 [0,0,0,1,0,1|2,0,0]=4 980 B9R1.79 CCC(C)NC1COC1 m_2230__22399526__14925342 [0,0,0,1,0,1|1,0,0]=3 981 B9R1.79 CCC(C)SC1CCC1 m_7__10684076__14247828 [0,0,0,1,0,1|2,0,0]=4 982 B9R1.79 CCC(C)SC1CNC1 m_7__22987816__14247828 [0,0,0,1,0,1|2,0,0]=4 983 B9R1.79 CCC(C)SC1COC1 m_7__13420946__14247828 [0,0,0,1,0,1|1,0,0]=3 984 B9R1.79 CCC(C)SC1CSC1 m_7__20064714__14247828 [0,0,0,1,0,1|1,1,0]=4 985 B9R1.79 CCN(C)CC1COC1 m_2230__20847590__22383854 [0,0,0,1,0,1|2,0,0]=4 986 B9R1.79 C[C@@H](CN)SC1CCC1 m_7__20871330__13420952 [0,0,0,1,0,1|2,0,0]=4 987 B9R1.79 C[C@@H](CN)SC1COC1 m_7__20871330__10173692 [0,0,0,1,0,1|2,0,0]=4 988 B9R1.79 C[C@H](CF)NC1CCC1 m_2230__22399906__7832192 [0,0,0,1,0,1|2,0,0]=4 989 B9R1.79 C[C@H](CF)NC1COC1 m_2230__22399906__14925342 [0,0,0,1,0,1|2,0,0]=4 990 B9R1.79 C[C@H](CO)NC1CCC1 m_2230__22399532__7832192 [0,0,0,1,0,1|1,0,0]=3 991 B9R1.79 C[C@H](CO)NC1COC1 m_2230__22399532__14925342 [0,0,0,1,0,1|2,0,0]=4 992 B9R1.113 CC(CF)NC1(CC1)C m_2230__22404332__22994052 [0,0,0,1,0,1|2,0,0]=4 993 B9R1.113 CC(CO)NC1(CC1)C m_269862__8317012__15157990 [0,0,0,1,0,1|1,0,0]=3 994 B9R1.113 CCC(C)NC1(CC1)C m_2230__22404332__14247836 [0,0,0,1,0,1|2,0,0]=4 995 B9R1.125 CN1CCC(C1)(C)CO m_2230__13473350__2463448 [0,0,0,1,0,1|2,0,0]=4 996 B9R1.3 CC1C(CCCN1C)O m_2230__10719784__2463448 [0,1,0,1,0,0|2,0,0]=4 997 B9R1.3 CC1COCC(N1C)C m_2230__12911698__2463448 [0,1,0,1,0,0|2,0,0]=4 998 B9R1.3 C[C@@H]1[C@@H](CCCN1C)O m_2230__13038652__2463448 [0,1,0,1,0,0|2,0,0]=4 999 B9R1.3 C[C@H]1OCCN([C@@H]1C)C m_2230__22408752__2463448 [0,1,0,1,0,0|2,0,0]=4 1000 B9R1.41 CC(O)[C@H]1CCCN1C m_2230__12057664__2463448 [0,1,0,1,0,0|2,0,0]=4 1001 B9R1.96 CC(C)N1CCC1CO m_2230__13428546__680832 [0,1,0,1,0,0|2,0,0]=4 1002 B9R1.96 CCN1CCC1C(C)O m_270004__24177142__24715004 [0,1,0,1,0,0|2,0,0]=4 1003 B9R1.101 CC(CO)N(C)C1CC1 m_2230__16644704__2463448 [0,1,0,1,0,0|2,0,0]=4 1004 B9R1.110 CC(C)N(C)C1COC1 m_2230__13570148__680832 [0,1,0,1,0,0|2,0,0]=4 1005 B9R1.132 CCN1CCC(C1C)C m_2230__6507962__22383854 [0,1,0,1,0,0|2,0,0]=4 1006 B9R1.132 CCN1CC[C@@H]([C@@H]1C)O m_2230__14788854__22383854 [0,1,0,1,0,0|1,1,0]=4 1007 B9R1.132 CCN1CC[C@@H]([C@H]1C)O m_2230__10747766__22383854 [0,1,0,1,0,0|1,1,0]=4 1008 B9R1.132 CO[C@H]1CCN([C@H]1C)C m_2230__19736304__2463448 [0,1,0,1,0,0|2,0,0]=4 1009 B9R1.132 C[C@H]1CC[C@H](N1C)CO m_2230__12910002__2463448 [0,1,0,1,0,0|2,0,0]=4 1010 B9R1.4 CCCN1CCC1CO m_2230__13428546__13271112 [0,1,0,1,0,0|2,0,0]=4 1011 B9R1.4 CCN1CCC1COC m_2230__10478002__22383854 [0,1,0,1,0,0|2,0,0]=4 1012 B9R1.4 CCNC1CCC1CC m_269862__7865270__10177948 [0,1,0,1,0,0|2,0,0]=4 1013 B9R1.4 CCNC1CCC1CO m_269862__7865270__17047872 [0,1,0,1,0,0|1,0,0]=3 1014 B9R1.4 CCN[C@@H]1CC[C@H]1CF m_270004__23853708__24715004 [0,1,0,1,0,0|2,0,0]=4 1015 B9R1.4 CCN[C@H]1CC[C@H]1CO m_270004__23853202__24715004 [0,1,0,1,0,0|1,0,0]=3 1016 B9R1.4 OCC1CCN1CCF m_2230__13428546__22320836 [0,1,0,1,0,0|2,0,0]=4 1017 B9R1.4 OCCN1CCC1CO m_2230__13428546__6165700 [0,1,0,1,0,0|2,0,0]=4 1018 B9R1.5 CC1CCOCCN1C m_2230__13439614__2463448 [0,1,0,1,0,0|2,0,0]=4 1019 B9R1.5 CC1COCCCN1C m_2230__24525948__2463448 [0,1,0,1,0,0|2,0,0]=4 1020 B9R1.5 C[C@@H]1COCCCN1C m_2230__21997220__2463448 [0,1,0,1,0,0|2,0,0]=4 1021 B9R1.11 CCN(C)C1CCOC1 m_2230__14794696__2463448 [0,1,0,1,0,0|2,0,0]=4 1022 B9R1.11 CCN(C)C1CCSC1 m_2230__7834660__22383854 [0,1,0,1,0,0|2,0,0]=4 1023 B9R1.11 CNC(C)C1CCOC1 m_269862__7193148__7201524 [0,1,0,1,0,0|2,0,0]=4 1024 B9R1.15 CC1COCCC1=NO m_4__388124__9582750 [0,1,0,1,0,0|0,1,1]=4 1025 B9R1.15 CCC1COCCN1C m_2230__4978178__2463448 [0,1,0,1,0,0|2,0,0]=4 1026 B9R1.15 CCN1CCOCC1C m_2230__679548__22383854 [0,1,0,1,0,0|2,0,0]=4 1027 B9R1.15 CCN1CCOC[C@@H]1C m_2230__10745968__22383854 [0,1,0,1,0,0|2,0,0]=4 1028 B9R1.15 CN1CCCCC1CO m_2230__804372__2463448 [0,1,0,1,0,0|2,0,0]=4 1029 B9R1.15 CN1CCNCC1CO m_269982__12889570__14064228 [0,1,0,1,0,0|2,0,0]=4 1030 B9R1.15 CN1CCNC[C@H]1CO m_269982__23466534__14064228 [0,1,0,1,0,0|2,0,0]=4 1031 B9R1.15 CN1CCOCC1CF m_2230__17068944__2463448 [0,1,0,1,0,0|2,0,0]=4 1032 B9R1.15 CN1CCOCC1CO m_2230__15779506__2463448 [0,1,0,1,0,0|2,0,0]=4 1033 B9R1.15 CN1CCSCC1CO m_2230__7964058__2463448 [0,1,0,1,0,0|2,0,0]=4 1034 B9R1.15 CNC1CCCCC1C m_269862__7193148__7200292 [0,1,0,1,0,0|2,0,0]=4 1035 B9R1.15 CNC1CCCC[C@H]1F m_269862__7193148__16655726 [0,1,0,1,0,0|2,0,0]=4 1036 B9R1.15 CNC1CCNCC1C m_269982__17670816__14064228 [0,1,0,1,0,0|2,0,0]=4 1037 B9R1.15 CNC1CCOCC1C m_269862__7193148__9582752 [0,1,0,1,0,0|1,0,0]=3 1038 B9R1.15 CNC1CNCCC1C m_269982__22505482__14064228 [0,1,0,1,0,0|2,0,0]=4 1039 B9R1.15 CNC1COCCC1C m_269862__7193148__15475114 [0,1,0,1,0,0|1,0,0]=3 1040 B9R1.15 CN[C@@H]1CCCC[C@H]1N m_269982__11506054__14064228 [0,1,0,1,0,0|2,0,0]=4 1041 B9R1.15 CN[C@H]1CCCC[C@H]1N m_269982__15500706__14064228 [0,1,0,1,0,0|2,0,0]=4 1042 B9R1.15 CN[C@H]1CCOC[C@H]1N m_269982__17754790__14064228 [0,1,0,1,0,0|2,0,0]=4 1043 B9R1.15 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