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[1,0,1,0,0,0|1,0,0]=3 134 B9R0.13 CCC(CCOC)C(=O)O Z756391352 [1,0,1,0,0,0|1,0,0]=3 135 B9R0.13 CCCCC(CC)C(=O)N Z394696486 [1,0,1,0,0,0|1,0,0]=3 136 B9R0.13 CCCCC(CC)C(=O)O Z104478072 [1,0,1,0,0,0|0,0,0]=2 137 B9R0.13 COC(CCSC)C(=O)O Z1592680734 [1,0,1,0,0,0|2,0,0]=4 138 B9R1.1 C=C1CCC(CC1)CN Z2889982961 [2,0,0,0,0,0|0,0,1]=3 139 B9R1.1 CC1CCC(=NO)CC1 Z49568435 [2,0,0,0,0,0|1,0,1]=4 140 B9R1.1 CC1CCC(CC1)C#N Z415654864 [2,0,0,0,0,0|1,0,1]=4 141 B9R1.1 CC1CCC(CC1)C=O Z1250055138 [2,0,0,0,0,0|0,0,0]=2 142 B9R1.1 CC1CCC(CC1)NN Z927192058 [2,0,0,0,0,0|1,0,1]=4 143 B9R1.1 CC1CCC(NC1)CN Z3492445324 [2,0,0,0,0,0|1,0,1]=4 144 B9R1.1 CCC1CCC(=O)CC1 Z104475572 [2,0,0,0,0,0|1,0,1]=4 145 B9R1.1 CCN1CCC(CC1)O Z197264618 [2,0,0,0,0,0|2,0,0]=4 146 B9R1.1 CC[C@H]1CC[C@@H](CC1)N Z2205958759 [2,0,0,0,0,0|1,0,1]=4 147 B9R1.1 CN1CCC(CC1)C=O Z372839344 [2,0,0,0,0,0|1,0,0]=3 148 B9R1.1 CN1CCC(CC1)CO Z594219182 [2,0,0,0,0,0|1,0,1]=4 149 B9R1.1 CNC1CCC(CC1)O Z138503904 [2,0,0,0,0,0|2,0,0]=4 150 B9R1.1 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[2,0,0,0,0,0|2,0,0]=4 166 B9R1.6 CC(=O)C1CCNCC1 Z1741977299 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.6 CC(=O)C1CCOCC1 Z1178490124 [2,0,0,0,0,0|2,0,0]=4 168 B9R1.6 CC(=O)[C@@H]1CCCCN1 Z1618016835 [2,0,0,0,0,0|2,0,0]=4 169 B9R1.6 CC(=O)[C@H]1CCCCN1 Z2234185612 [2,0,0,0,0,0|2,0,0]=4 170 B9R1.6 CC(O)C1CCCCC1 Z445987098 [2,0,0,0,0,0|1,0,1]=4 171 B9R1.6 C[C@@H](O)C1CCCCC1 Z959151676 [2,0,0,0,0,0|1,0,1]=4 172 B9R1.6 N=C(N)C1CCCCC1 Z317027412 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.6 NC(=O)C1CCCCC1 Z33546516 [2,0,0,0,0,0|1,0,0]=3 174 B9R1.6 NC(=O)C1CCCCN1 Z90122010 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.6 NC(=O)C1CCCNC1 Z85932258 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.6 NC(=O)C1CCNCC1 Z1450533743 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.6 NC(=O)C1CCOCC1 Z82670321 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.6 NC(=O)N1CCCCC1 Z56917364 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.6 O=C(O)C1C=CCCC1 Z57127330 [2,0,0,0,0,0|0,0,2]=4 180 B9R1.6 O=C(O)C1CC=CCC1 Z57921336 [2,0,0,0,0,0|0,0,2]=4 181 B9R1.6 O=C(O)C1CCCCC1 Z104475698 [2,0,0,0,0,0|0,0,0]=2 182 B9R1.6 O=C(O)C1CCCCN1 Z104479780 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.6 O=C(O)C1CCCCO1 Z963633098 [2,0,0,0,0,0|1,0,0]=3 184 B9R1.6 O=C(O)C1CCCNC1 Z324553206 [2,0,0,0,0,0|1,0,0]=3 185 B9R1.6 O=C(O)C1CCCOC1 Z445214062 [2,0,0,0,0,0|1,0,0]=3 186 B9R1.6 O=C(O)C1CCCSC1 Z1198485079 [2,0,0,0,0,0|1,0,0]=3 187 B9R1.6 O=C(O)C1CCCSS1 Z1262517456 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.6 O=C(O)C1CCNCC1 Z104474390 [2,0,0,0,0,0|1,0,0]=3 189 B9R1.6 O=C(O)C1CCOCC1 Z85923421 [2,0,0,0,0,0|1,0,0]=3 190 B9R1.6 O=C(O)C1CCSCC1 Z826531634 [2,0,0,0,0,0|1,0,0]=3 191 B9R1.6 O=C(O)C1CCSCN1 Z1235963996 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.6 O=C(O)C1CNCCN1 Z1273089259 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.6 O=C(O)C1COCCN1 Z1255387606 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.6 O=C(O)C1COCCO1 Z362763682 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.6 O=C(O)C1CSCCS1 Z147642878 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.6 O=C(O)C1SCCCS1 Z275241266 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.6 O=C(O)[C@@H]1CCCCN1 Z1033300646 [2,0,0,0,0,0|1,0,0]=3 198 B9R1.6 OB(O)C1CCCCC1 Z56789446 [2,0,0,0,0,0|1,0,1]=4 199 B11R0.171 CCC(CC)N(C)CCC(=O)O Z1465346855 [0,1,1,0,0,0|2,0,0]=4 200 B11R0.76 CCCCCCC(CC)C(=O)O Z756391282 [0,1,1,0,0,0|1,0,0]=3 201 B11R0.76 CCCCCCC(NC)C(=O)O Z446011802 [0,1,1,0,0,0|2,0,0]=4 202 B11R0.78 CCCC(CCCCN)C(=O)O Z1993522747 [0,1,1,0,0,0|0,0,0]=2 203 B11R0.153 CCCCCC(C(=O)O)C(C)C Z756391622 [0,1,1,0,0,0|1,0,0]=3 204 B11R0.329 CCCCCC(C)(CC)C(=O)O Z995182188 [0,1,1,0,0,0|1,0,0]=3 205 B11R1.83 CCCC1CCC(CC1)C=O Z1268606355 [1,1,0,0,0,0|1,0,0]=3 206 B11R1.83 CCC[C@H]1CC[C@@H](CC1)CN Z4103340391 [1,1,0,0,0,0|1,0,1]=4 207 B11R1.83 CCOC1CCC(CC1)C=O Z1514014437 [1,1,0,0,0,0|1,0,0]=3 208 B11R1.83 NCC1CCN(CC1)CCO Z871836630 [1,1,0,0,0,0|1,0,1]=4 209 B11R1.83 NCCN1CCC(CC1)CO Z380969706 [1,1,0,0,0,0|1,0,1]=4 210 B11R1.336 NC[C@@]1(CC[C@@H](CC1)CO)F Z3952017779 [1,1,0,0,0,0|0,0,1]=3 211 B11R1.19 CC(C)(O)[C@H]1CC[C@H](CC1)N Z4307100631 [1,1,0,0,0,0|1,0,1]=4 212 B11R1.19 CS(=O)(=O)C1CCC(CC1)N Z1258578408 [1,1,0,0,0,0|1,0,1]=4 213 B11R1.19 CS(=O)(=O)[C@H]1CC[C@H](CC1)N Z3299691758 [1,1,0,0,0,0|1,0,1]=4 214 B11R1.19 NC1CCC(CC1)S(=O)(=O)N Z3015401194 [1,1,0,0,0,0|1,0,1]=4 215 B11R1.19 NC1CCC(CC1)S(=O)(=O)O Z1262638230 [1,1,0,0,0,0|1,0,0]=3 216 B11R1.21 CC(=O)N1CCC(C(C1)C)N Z1457415458 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.21 CC1=C(CC(CC1)C(=O)O)C Z1198156483 [1,1,0,0,0,0|0,0,2]=4 218 B11R1.21 CC1CC(CCC1=O)C(=O)O Z1262513284 [1,1,0,0,0,0|1,0,1]=4 219 B11R1.21 CC1CCC(CC1C)C(=O)O Z1250017822 [1,1,0,0,0,0|0,0,0]=2 220 B11R1.21 CC1CCC(CC1N)C(=O)O Z1262537169 [1,1,0,0,0,0|0,0,0]=2 221 B11R1.21 CC1CCC(NC1C)C(=O)O Z2350909288 [1,1,0,0,0,0|1,0,0]=3 222 B11R1.21 C[C@@H]1CN[C@@H](C[C@@H]1C)C(=O)O Z4076052338 [1,1,0,0,0,0|1,0,0]=3 223 B11R1.21 C[C@@H]1C[C@@H](CCN1C)C(=O)O Z2309899010 [1,1,0,0,0,0|1,0,0]=3 224 B11R1.21 NC1CC(CCC1O)C(=O)O Z4296875227 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.21 O=C(O)[C@H]1C[C@@H]([C@@H](CO1)O)O Z3664725069 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.22 C=CC(=O)N1CCC(CC1)N Z1259341080 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.22 CC1CCN(CC1)C(=O)CCl Z56862392 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.22 CN1CCN(CC1)C(=O)CO Z228585842 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.22 CNC(=O)C1CCC(CC1)N Z1262237253 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.22 CNC(=O)N1CCC(CC1)N Z3634948443 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.22 CNC(=O)[C@H]1CC[C@H](CC1)N Z3248014579 [1,1,0,0,0,0|1,0,0]=3 232 B11R1.22 COC(=O)C1CCC(CC1)N Z1270446306 [1,1,0,0,0,0|0,0,0]=2 233 B11R1.22 COC(=O)C1CCC(CC1)O Z1201620516 [1,1,0,0,0,0|1,0,0]=3 234 B11R1.22 COC(=O)C1CCC(CN1)F Z4186160352 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.22 COC(=O)C1CCC(CN1)O Z2867491134 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.22 COC(=O)C1CCC(NC1)C Z3211706034 [1,1,0,0,0,0|1,0,0]=3 237 B11R1.22 COC(=O)C1CCN(CC1)C Z103761506 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.22 COC(=O)N1CCC(CC1)N Z319610136 [1,1,0,0,0,0|1,0,0]=3 239 B11R1.22 COC(=O)N1CCC(CC1)O Z371627574 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.22 COC(=O)[C@@H]1CC[C@H](CN1)F Z4438428643 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.22 COC(=O)[C@@H]1CN[C@H](CN1)C Z4824753667 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)N Z1255361219 [1,1,0,0,0,0|0,0,0]=2 243 B11R1.22 COC(=O)[C@H]1CC[C@H](CC1)N Z1255356909 [1,1,0,0,0,0|0,0,0]=2 244 B11R1.166 CC1CC(=O)CCC1C(=O)O Z1262519171 [1,1,0,0,0,0|1,0,1]=4 245 B11R1.166 CC1CC(C(CN1)C(=O)O)C Z3213439686 [1,1,0,0,0,0|1,0,0]=3 246 B11R1.166 CC1CCC(C(=O)N1)C(=O)O Z1262552841 [1,1,0,0,0,0|1,0,1]=4 247 B11R1.166 CC1CCC(C(N1)C)C(=O)O Z2379448768 [1,1,0,0,0,0|1,0,0]=3 248 B11R1.166 CC1CNC(C(C1)C)C(=O)O Z3251990496 [1,1,0,0,0,0|1,0,0]=3 249 B11R1.166 CC1CNC(C(O1)C)C(=O)O Z2380417725 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.166 CN1CC(CCC1C(=O)O)N Z4383496345 [1,1,0,0,0,0|1,0,0]=3 251 B11R1.166 C[C@H]1CNC([C@H](O1)C)C(=O)O Z4685707855 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.220 CC1(CCC(=O)CC1)C(=O)O Z1255438161 [1,1,0,0,0,0|1,0,1]=4 253 B11R1.220 CC1(CCC(CC1)O)C(=O)O Z1262526806 [1,1,0,0,0,0|1,0,0]=3 254 B11R1.220 CC1=CCC(CC1)(C)C(=O)O Z1262511092 [1,1,0,0,0,0|0,0,2]=4 255 B11R1.220 CC1CCC(CC1)(N)C(=O)O Z317024836 [1,1,0,0,0,0|0,0,0]=2 256 B11R1.220 CN1CCC(CC1)(C)C(=O)O Z1762997281 [1,1,0,0,0,0|1,0,0]=3 257 B11R1.220 CN1CCC(CC1)(F)C(=O)O Z3244401818 [1,1,0,0,0,0|1,0,0]=3 258 B11R1.220 NC1CCC(CC1)(N)C(=O)O Z1483956645 [1,1,0,0,0,0|0,0,0]=2 259 B11R1.727 CC1(CCC(CC1)C(=O)O)C Z1227600825 [1,1,0,0,0,0|0,0,0]=2 260 B11R1.727 CC1(CCC(CC1)C(=O)O)O Z1255462988 [1,1,0,0,0,0|0,0,0]=2 261 B11R1.727 CC1(CCC(CN1)C(=O)N)C Z5093991254 [1,1,0,0,0,0|2,0,0]=4 262 B11R1.727 CC1(CCC(CN1)C(=O)O)C Z4986317694 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.727 CC1(CNC(CO1)C(=O)O)C Z1255416501 [1,1,0,0,0,0|2,0,0]=4 264 B11R1.727 CC1(COC(CN1)C(=O)O)C Z3485466720 [1,1,0,0,0,0|2,0,0]=4 265 B11R1.727 C[C@@]1(CC[C@@H](CC1)C(=O)O)O Z1262519032 [1,1,0,0,0,0|0,0,0]=2 266 B11R1.727 C[C@@]1(CC[C@H](CC1)C(=O)O)F Z3772394552 [1,1,0,0,0,0|0,0,0]=2 267 B11R1.727 C[C@@]1(CC[C@H](CC1)C(=O)O)O Z1262516380 [1,1,0,0,0,0|0,0,0]=2 268 B11R1.727 NC(=O)C1CCC(CC1)(F)F Z1198316457 [1,1,0,0,0,0|2,0,0]=4 269 B11R1.727 O=C(O)C1CCS(=O)(=O)CC1 Z826527398 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.44 COC(=O)N1CCC(C1)CN Z2065788223 [0,1,0,0,1,0|1,0,0]=3 271 B11R1.44 COC(=O)[C@@H]1CC[C@@H](C1)C=O Z3033510991 [0,1,0,0,1,0|1,0,1]=4 272 B11R1.124 CNCC1CCN(C1)C(=O)C Z1457031523 [0,1,0,0,1,0|2,0,0]=4 273 B11R1.175 CN(C)[C@@H]1CC[C@@H](C1)C(=O)O Z4129693343 [0,1,0,0,1,0|2,0,0]=4 274 B11R1.175 NC(=O)[C@@H]1CC[C@@H](O1)C(=O)O Z1814367061 [0,1,0,0,1,0|1,0,1]=4 275 B11R1.175 O=C(O)C1CCC(C1)C(=O)O Z274502046 [0,1,0,0,1,0|1,0,1]=4 276 B11R1.175 O=C(O)[C@@H]1CC[C@@H](O1)C(F)F Z5630360403 [0,1,0,0,1,0|2,0,0]=4 277 B11R1.175 O=C(O)[C@H]1CC[C@H](C1)C(=O)O Z1954802631 [0,1,0,0,1,0|1,0,1]=4 278 B11R1.417 NC[C@]1(CC[C@@H](C1)C(=O)O)F Z3682735312 [0,1,0,0,1,0|0,0,0]=2 279 B11R1.417 NC[C@]1(CC[C@H](C1)C(=O)O)F Z3717955439 [0,1,0,0,1,0|0,0,0]=2 280 B11R1.1229 CCC1CCC(C1)(O)C(=O)O Z381410914 [0,1,0,0,1,0|1,0,0]=3 281 B13R1.5 COC(=O)CC1CCC(CC1)CN Z2689515970 [0,1,0,0,0,1|0,0,0]=2 282 B13R1.5 COC(=O)C[C@H]1CC[C@@H](CC1)CN Z1269136602 [0,1,0,0,0,1|0,0,0]=2 283 B13R1.5 O=C(CCl)N[C@H]1CC[C@H](CC1)CO Z2596883775 [0,1,0,0,0,1|2,0,0]=4 284 B13R1.142 CCON1CCC(CC1)CC(=O)O Z2242032460 [0,1,0,0,0,1|2,0,0]=4 285 B13R1.585 CC(C)N1CCC(CC1)CC(=O)O Z3244909198 [0,1,0,0,0,1|2,0,0]=4 286 B13R1.585 NC(=O)C1CCN(CC1)CC(=O)O Z1259335830 [0,1,0,0,0,1|1,0,1]=4 287 B13R1.5266 CCC1CCCC(CC1)(N)C(=O)O Z1258693303 [0,1,0,0,0,1|1,0,0]=3 288 B13R1.8652 NC(=O)C1CCCC(CC1)C(=O)O Z4778991002 [0,1,0,0,0,1|0,0,1]=3 289 B13R1.139 C#CCN1CCC(CC1)C(=O)OC Z103762012 [0,2,0,0,0,0|2,0,0]=4 290 B13R1.139 CNCC1CCN(CC1)C(=O)OC Z1104903301 [0,2,0,0,0,0|1,0,0]=3 291 B13R1.139 COC(=O)C1CCC(CC1)CC=O Z1511808008 [0,2,0,0,0,0|1,0,0]=3 292 B13R1.139 COC(=O)C1CCN(CC1)CCO Z425793340 [0,2,0,0,0,0|2,0,0]=4 293 B13R1.537 CNC(=O)N1CCC(CC1)C(=O)O Z381041258 [0,2,0,0,0,0|1,0,1]=4 294 B13R1.537 COC(=O)C1CCC(CC1)C(=O)O Z374049352 [0,2,0,0,0,0|1,0,1]=4 295 B13R1.537 COC(=O)C1CCN(CC1)C(=O)N Z24651408 [0,2,0,0,0,0|1,0,1]=4 296 B13R1.537 COC(=O)N1CCC(CC1)C(C)N Z1724015895 [0,2,0,0,0,0|1,0,0]=3 297 B13R1.537 COC(=O)[C@H]1CC[C@@H](CC1)C(=O)O Z1201620917 [0,2,0,0,0,0|1,0,1]=4 298 B13R1.537 COC(=O)[C@H]1CC[C@H](CC1)C(=O)O Z1255465549 [0,2,0,0,0,0|1,0,1]=4 299 B13R1.537 NCC(=O)N1CCC(CC1)C(=O)N Z839028652 [0,2,0,0,0,0|2,0,0]=4 300 B13R1.537 O=C(O)C1CCN(CC1)C(=O)CCl Z57053620 [0,2,0,0,0,0|2,0,0]=4 301 B13R1.2863 CCC1CCC(CC1)(N)C(=O)OC Z385439970 [0,2,0,0,0,0|1,0,0]=3 302 B13R1.4785 COC(=O)[C@H]1CC[C@@](CC1)(F)CN Z3790440118 [0,2,0,0,0,0|0,0,0]=2 303 B13R1.338 CC(=O)C1CCC(CC1)C(F)(F)F Z1276728278 [0,2,0,0,0,0|2,0,0]=4 304 B13R1.338 CC(C)(C)C1CCC(CC1)C(=O)N Z33546927 [0,2,0,0,0,0|2,0,0]=4 305 B13R1.338 CC(C)(C)C1CCC(CC1)C(=O)O Z104477532 [0,2,0,0,0,0|1,0,0]=3 306 B13R1.338 CC(C)(C)C1CCC(NC1)C(=O)O Z3478622137 [0,2,0,0,0,0|2,0,0]=4 307 B13R1.338 NS(=O)(=O)N1CCC(CC1)C(=O)O Z295879432 [0,2,0,0,0,0|2,0,0]=4 308 B13R1.338 O=C(O)C1CCC(CC1)C(F)(F)F Z316121942 [0,2,0,0,0,0|1,0,0]=3 309 B13R1.338 O=C(O)[C@@H]1CC[C@@H](CN1)C(F)(F)F Z3037359431 [0,2,0,0,0,0|2,0,0]=4 310 B13R1.338 O=C(O)[C@H]1CC[C@@H](CC1)C(F)(F)F Z1201624917 [0,2,0,0,0,0|1,0,0]=3 311 B13R1.74 C#CCCN1CCC(CC1)C(=O)O Z4497339354 [0,2,0,0,0,0|2,0,0]=4 312 B13R1.74 CCCCC1CCC(CC1)C(=O)O Z56911948 [0,2,0,0,0,0|1,0,0]=3 313 B13R1.74 CCNCC1CCN(CC1)C(=O)C Z1413667402 [0,2,0,0,0,0|2,0,0]=4 314 B13R1.74 CCNC[C@H]1CC[C@@H](CC1)C(=O)O Z2940646178 [0,2,0,0,0,0|0,0,0]=2 315 B13R1.74 NCCCN1CCC(CC1)C(=O)N Z271005932 [0,2,0,0,0,0|2,0,0]=4 316 B13R1.74 NCCCN1CCC(CC1)C(=O)O Z2901994636 [0,2,0,0,0,0|1,0,0]=3 317 B13R1.3457 CCCC1CCC(CC1)(O)C(=O)O Z788000952 [0,2,0,0,0,0|1,0,0]=3 318 B13R1.8764 CC1(CCC(CC1)C(=O)O)C(=O)O Z1262522644 [0,2,0,0,0,0|1,0,1]=4 319 B13R1.8764 NC1(CCC(CC1)C(F)F)C(=O)O Z2519207971 [0,2,0,0,0,0|1,0,0]=3 320 B11R1.43 NCC1CC(CO1)CC(=O)N Z3483424958 [0,0,1,1,0,0|2,0,0]=4 321 B11R1.43 NCC1CC(CO1)CC(=O)O Z3481962152 [0,0,1,1,0,0|1,0,0]=3 322 B11R1.172 O=C(O)CCCC1CCCC1 Z1209411148 [0,0,1,1,0,0|1,0,0]=3 323 B11R1.172 O=C(O)CCCN1CCCC1 Z763029994 [0,0,1,1,0,0|2,0,0]=4 324 B11R1.172 O=C(O)CCNC1CCCC1 Z910841990 [0,0,1,1,0,0|2,0,0]=4 325 B11R1.172 O=C(O)CCSC1CCCC1 Z102926388 [0,0,1,1,0,0|2,0,0]=4 326 B11R1.172 O=C(O)COCC1CCCC1 Z1255418412 [0,0,1,1,0,0|2,0,0]=4 327 B11R1.172 O=C(O)COCC1CCOC1 Z825745840 [0,0,1,1,0,0|2,0,0]=4 328 B11R1.1071 CCC1(CCCC(=O)N1)CN Z5268525013 [0,0,1,1,0,0|1,0,0]=3 329 B11R1.565 NC1CCCC(CC1)C(=O)O Z3478634516 [0,0,1,1,0,0|2,0,0]=4 330 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Z2306862306 [0,0,1,1,0,0|2,0,0]=4 331 B11R1.143 O=C(O)C1CCCCNC1=O Z2732472146 [0,0,1,1,0,0|1,0,1]=4 332 B11R1.706 O=C(O)C1CCCCCCC1 Z792377154 [0,0,1,1,0,0|1,0,0]=3 333 B11R1.706 O=C(O)C1CCCCCCN1 Z1998612770 [0,0,1,1,0,0|2,0,0]=4 334 B11R1.1074 CCC1(CCCCC1)C(=O)O Z995180910 [0,0,1,1,0,0|1,0,0]=3 335 B11R1.1074 CCC1(CCCCN1)C(=O)O Z3244871896 [0,0,1,1,0,0|0,0,0]=2 336 B11R1.1074 CCC1(CCOCC1)C(=O)O Z1037344038 [0,0,1,1,0,0|2,0,0]=4 337 B11R1.1074 CNC1(CCCCC1)C(=O)O Z446011394 [0,0,1,1,0,0|2,0,0]=4 338 B11R1.1074 COC1(CCCCC1)C(=O)O Z803492292 [0,0,1,1,0,0|2,0,0]=4 339 B11R1.1074 NCC1(CCCCC1)C(=O)O Z3235017457 [0,0,1,1,0,0|2,0,0]=4 340 B11R2.266 NCC1CCC2CC1CO2 Z2903623101 [1,0,0,1,0,0|2,0,0]=4 341 B11R2.266 O=C[C@@H]1CC[C@H]2C[C@@H]1CO2 Z3024996692 [1,0,0,1,0,0|2,0,0]=4 342 B11R2.367 CC1C(=O)C2CCN1CC2 Z4371528740 [1,0,0,1,0,0|2,0,0]=4 343 B11R2.1012 NCC1CCC2(CC1)CC2 Z2738925318 [1,0,0,1,0,0|1,0,1]=4 344 B11R2.1012 O=CC1CCC2(CC1)CC2 Z1511808524 [1,0,0,1,0,0|1,0,0]=3 345 B11R2.2086 NCC12CCC(CC1)CN2 Z4573870630 [1,0,0,1,0,0|1,0,1]=4 346 B11R2.2086 NCC12CCC(CC1)CO2 Z5209754718 [1,0,0,1,0,0|0,0,1]=3 347 B11R2.2086 NCC12CCC(CC1)OC2 Z3013893688 [1,0,0,1,0,0|2,0,0]=4 348 B11R2.2086 O=CC12CCC(CC1)OC2 Z3300767517 [1,0,0,1,0,0|2,0,0]=4 349 B11R2.2086 OCC12CCC(CC1)CN2 Z3244520860 [1,0,0,1,0,0|0,0,1]=3 350 B11R2.68 CC1CCC2CC1NC2=O Z1203749581 [1,0,0,1,0,0|1,0,0]=3 351 B11R2.696 CC12CCC(CC1)C(=O)O2 Z5185201929 [1,0,0,1,0,0|0,0,0]=2 352 B11R2.746 N[C@@H]1CC[C@]2([C@@H]1C2)C(=O)O Z4500873137 [1,0,0,1,0,0|0,0,0]=2 353 B11R2.839 O=C(O)C1CCC2CC2C1 Z1509040982 [1,0,0,1,0,0|0,0,0]=2 354 B11R2.1839 CC(O)C12CCC(N1)CC2 Z3210757143 [1,0,0,1,0,0|1,0,1]=4 355 B11R2.1839 NC(=O)C12CCC(N1)CC2 Z2867975581 [1,0,0,1,0,0|1,0,0]=3 356 B11R2.1839 O=C(O)C12CCC(C1)CC2 Z1198162267 [1,0,0,1,0,0|0,0,0]=2 357 B11R2.1839 O=C(O)C12CCC(C1)CO2 Z3334129707 [1,0,0,1,0,0|1,0,0]=3 358 B11R2.1839 O=C(O)C12CCN(C1)CC2 Z2681277226 [1,0,0,1,0,0|1,0,0]=3 359 B11R2.162 NC[C@@H]1C[C@H]2C[C@@H]1C[C@H]2O Z3713600798 [0,0,0,1,1,0|1,0,1]=4 360 B11R2.221 CC1OC2(CCC1C2)CN Z4438974950 [0,0,0,1,1,0|1,0,1]=4 361 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2[C@H]1CC2 Z3484275452 [0,0,0,1,1,0|2,0,0]=4 362 B11R2.845 CC(=O)C1CC2CCC1C2 Z1386913059 [0,0,0,1,1,0|2,0,0]=4 363 B11R2.845 O=C(O)C1CC2C=CC1C2 Z104495016 [0,0,0,1,1,0|1,0,1]=4 364 B11R2.845 O=C(O)C1CC2CCC1C2 Z147433488 [0,0,0,1,1,0|1,0,0]=3 365 B11R2.845 O=C(O)C1CC2CCC1N2 Z2899600133 [0,0,0,1,1,0|2,0,0]=4 366 B11R2.845 O=C(O)C1CN2CCC1C2 Z1262558196 [0,0,0,1,1,0|2,0,0]=4 367 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1O2 Z3301415369 [0,0,0,1,1,0|2,0,0]=4 368 B11R2.845 O=C(O)[C@@H]1C[C@H]2C=C[C@@H]1C2 Z2507795603 [0,0,0,1,1,0|1,0,1]=4 369 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1O2 Z1197865945 [0,0,0,1,1,0|2,0,0]=4 370 B11R2.972 CO[C@@H]1C[C@@]2([C@H]1C2)C(=O)O Z3400577515 [0,0,0,1,1,0|2,0,0]=4 371 B11R2.1868 O=C(O)C1CC2(CC2)CO1 Z2432627355 [0,0,0,1,1,0|2,0,0]=4 372 B11R2.1868 O=C(O)C1CCC2(C1)CC2 Z1205498074 [0,0,0,1,1,0|1,0,0]=3 373 B11R2.1868 O=C(O)C1CCC2(N1)CC2 Z4655556783 [0,0,0,1,1,0|2,0,0]=4 374 B13R2.1846 CCC1CCC2(CC1)CC(=O)N2 Z1238837694 [0,0,0,1,0,1|2,0,0]=4 375 B13R2.5890 O=C(O)CC1CCC2(CC1)CC2 Z2512804106 [0,0,0,1,0,1|1,0,0]=3 376 B13R2.5890 O=C(O)CC1CCC2(CC2)CO1 Z2754492856 [0,0,0,1,0,1|2,0,0]=4 377 B13R2.23344 O=C(O)CC12CCC(CC1)OC2 Z4389249615 [0,0,0,1,0,1|2,0,0]=4 378 B13R2.15286 O=C(CCl)C1CCC2(CC1)CC2 Z2512743272 [0,1,0,1,0,0|2,0,0]=4 379 B13R2.15777 COC(=O)C12CCC(CC1)NC2 Z3589682571 [0,1,0,1,0,0|2,0,0]=4 380 B13R2.15777 COC(=O)C12CCN(CC1)CC2 Z1255392874 [0,1,0,1,0,0|2,0,0]=4 381 B13R2.430 O=C(O)C1CCC2CCCC2N1 Z4173240706 [0,1,0,1,0,0|2,0,0]=4 382 B13R2.430 O=C(O)C1CCC2CCNC2C1 Z2064723018 [0,1,0,1,0,0|0,0,0]=2 383 B13R2.430 O=C(O)C1CCC2COCC2O1 Z5140928823 [0,1,0,1,0,0|2,0,0]=4 384 B13R2.430 O=C(O)C1CCN2CCCC2C1 Z4464852512 [0,1,0,1,0,0|2,0,0]=4 385 B13R2.430 O=C(O)[C@@H]1CC[C@@H]2NCC[C@@H]2C1 Z4667967355 [0,1,0,1,0,0|1,0,0]=3 386 B13R2.430 O=C(O)[C@@H]1CC[C@@H]2OCC[C@@H]2N1 Z4425271190 [0,1,0,1,0,0|2,0,0]=4 387 B13R2.430 O=C(O)[C@@H]1CC[C@H]2CCN[C@H]2C1 Z5057505666 [0,1,0,1,0,0|0,0,0]=2 388 B13R2.430 O=C(O)[C@@H]1CC[C@H]2CNC[C@@H]2O1 Z4895047960 [0,1,0,1,0,0|1,0,0]=3 389 B13R2.12723 CC1OC2(CCC1CC2)C(=O)O Z4365532710 [0,1,0,1,0,0|1,0,0]=3 390 B13R2.428 O=C(O)C1CCC(CC1)C2CC2 Z1262559464 [0,1,0,1,0,0|1,0,0]=3 391 B13R2.428 O=C(O)C1CCN(CC1)C2CC2 Z1901070924 [0,1,0,1,0,0|2,0,0]=4 392 B13R2.13919 O=C(O)C1CCC2(CCC2)CC1 Z1198322185 [0,1,0,1,0,0|1,0,0]=3 393 B13R2.13919 O=C(O)C1CCC2(CCC2)CN1 Z3248106149 [0,1,0,1,0,0|2,0,0]=4 394 B13R2.13919 O=C(O)C1CCC2(CCC2)NC1 Z4179963390 [0,1,0,1,0,0|2,0,0]=4 395 B13R2.13919 O=C(O)C1CCC2(CCC2)OC1 Z3327102561 [0,1,0,1,0,0|2,0,0]=4 396 B13R2.22973 CC(=O)C12CCC(C1(C)C)CC2 Z1513637305 [0,1,0,1,0,0|2,0,0]=4 397 B13R2.22973 CC1(C2CCC1(CC2)C(=O)O)C Z1262526793 [0,1,0,1,0,0|1,0,0]=3 398 B13R2.24801 NCC12CCC(C1)(CO2)C(=O)O Z4074922180 [0,1,0,1,0,0|1,0,0]=3 399 B13R2.24801 O=C(O)C12CCC(C1)(CC2)CO Z1813350388 [0,1,0,1,0,0|1,0,0]=3 400 B13R2.22975 CC12CCC(CC1)(CO2)C(=O)O Z2961660435 [0,1,0,1,0,0|2,0,0]=4 401 B13R2.22975 CC12CCC(CC1)(OC2)C(=O)O Z3379620975 [0,1,0,1,0,0|1,0,0]=3 402 B13R2.22975 NC12CCC(CC1)(CC2)C(=O)O Z3235027662 [0,1,0,1,0,0|1,0,0]=3 403 B13R2.22975 O=C(O)C12CCC(CC1)(CC2)F Z1262513006 [0,1,0,1,0,0|1,0,0]=3 404 B13R3.5902 NC1C2CC3C1(C3C2)C(=O)O Z4168207123 [0,0,0,2,0,0|0,0,0]=2 405 B9R0.43 CCN(CC)CCC(=O)O Z1259161971 [0,0,1,0,1,0|2,0,0]=4 406 B9R0.42 CCC(C)CC(N)C(=O)O Z2306603552 [0,0,1,0,1,0|2,0,0]=4 407 B9R1.21 NC[C@H]1CC[C@H](C1)CN Z1203591890 [1,0,0,0,1,0|1,0,1]=4 408 B9R1.35 CC(=O)N1CCC(C1)N Z1421529530 [1,0,0,0,1,0|2,0,0]=4 409 B9R1.35 CC(=O)N1CC[C@H](C1)N Z4485354356 [1,0,0,0,1,0|2,0,0]=4 410 B9R1.35 CC1C=C(CC1)C(=O)O Z1205494874 [1,0,0,0,1,0|0,0,2]=4 411 B9R1.35 CC1CC(CO1)C(=O)O Z1509040560 [1,0,0,0,1,0|1,0,0]=3 412 B9R1.35 CC1CCC(C1)C(=O)O Z1190318311 [1,0,0,0,1,0|0,0,0]=2 413 B9R1.35 CC1COC(C1)C(=O)O Z2785866738 [1,0,0,0,1,0|1,0,0]=3 414 B9R1.35 CC1NC(CS1)C(=O)O Z317026564 [1,0,0,0,1,0|2,0,0]=4 415 B9R1.35 CN1CCC(C1)C(=O)O Z406683232 [1,0,0,0,1,0|1,0,0]=3 416 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O Z2309921587 [1,0,0,0,1,0|1,0,0]=3 417 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O Z2238277752 [1,0,0,0,1,0|1,0,0]=3 418 B9R1.35 NC(=O)N1CCC(C1)N Z1342879018 [1,0,0,0,1,0|2,0,0]=4 419 B9R1.35 NC(=O)[C@H]1CC[C@H](C1)N Z2238896801 [1,0,0,0,1,0|1,0,0]=3 420 B9R1.35 NC1C=CC(C1)C(=O)O Z1350606478 [1,0,0,0,1,0|0,0,2]=4 421 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O Z2307368779 [1,0,0,0,1,0|0,0,0]=2 422 B9R1.35 O=C(O)C1CCC(C1)F Z1981870592 [1,0,0,0,1,0|1,0,0]=3 423 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O Z2470415380 [1,0,0,0,1,0|2,0,0]=4 424 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O Z802856442 [1,0,0,0,1,0|2,0,0]=4 425 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O Z1201624589 [1,0,0,0,1,0|2,0,0]=4 426 B9R1.35 O=C1CCC(C1)C(=O)O Z1205493622 [1,0,0,0,1,0|1,0,1]=4 427 B9R1.95 CN[C@H]1C[C@H](C1)C(=O)O Z2681202678 [0,0,0,0,2,0|2,0,0]=4 428 B9R1.95 N#C[C@H]1C[C@@H](C1)C(=O)O Z4320204664 [0,0,0,0,2,0|0,0,2]=4 429 B9R1.95 NCC1CC(C1)C(=O)O Z3247510672 [0,0,0,0,2,0|0,0,0]=2 430 B9R1.95 NCC1CN(C1)C(=O)N Z3753017086 [0,0,0,0,2,0|2,0,0]=4 431 B9R1.96 NC[C@@H]1CC[C@@H]1C(=O)O Z4659668967 [0,0,0,0,2,0|0,0,0]=2 432 B11R0.22 CCN(CC)CCNCC(=O)O Z406680012 [0,0,1,0,0,1|2,0,0]=4 433 B11R0.22 CCN(CC)CCSCC(=O)O Z1695703940 [0,0,1,0,0,1|2,0,0]=4 434 B11R1.20 CC1CCC(=CC(=O)O)CC1 Z352748308 [1,0,0,0,0,1|0,0,1]=3 435 B11R1.20 CC1CCC(CC1)C[N+](=O)[O-] Z3271333405 [1,0,0,0,0,1|1,0,1]=4 436 B11R1.20 CC1CCN(CC1)CC(=O)N Z54847897 [1,0,0,0,0,1|2,0,0]=4 437 B11R1.20 CC1CCN(CC1)CC(=O)O Z197278060 [1,0,0,0,0,1|1,0,0]=3 438 B11R1.20 CN1CCC(=CC(=O)O)CC1 Z1891772636 [1,0,0,0,0,1|1,0,1]=4 439 B11R1.20 CN1CCC(CC1)CC(=O)O Z2524805848 [1,0,0,0,0,1|1,0,0]=3 440 B11R1.20 CN1CCN(CC1)CC(=O)O Z57912405 [1,0,0,0,0,1|2,0,0]=4 441 B11R1.20 C[C@@H]1CO[C@H](CO1)CC(=O)O Z4905357119 [1,0,0,0,0,1|2,0,0]=4 442 B11R1.20 NC(=O)NC1CCC(CC1)O Z198194888 [1,0,0,0,0,1|2,0,0]=4 443 B11R1.20 NC1CCC(CC1)CC(=O)O Z3243726577 [1,0,0,0,0,1|0,0,0]=2 444 B11R1.20 NC1CCN(CC1)CC(=O)O Z1762658240 [1,0,0,0,0,1|1,0,0]=3 445 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O Z1255418104 [1,0,0,0,0,1|0,0,0]=2 446 B11R1.20 O=C(O)CC1CCC(=O)CC1 Z1198235241 [1,0,0,0,0,1|1,0,1]=4 447 B11R1.20 O=C(O)CN1CCC(CC1)O Z744593184 [1,0,0,0,0,1|2,0,0]=4 448 B11R1.266 CC(=O)N1CCCC(C1)CN Z1456458952 [0,0,0,0,1,1|2,0,0]=4 449 B11R1.266 CCC1CC(CCO1)C(=O)O Z1192344099 [0,0,0,0,1,1|1,0,0]=3 450 B11R1.266 CCC1CCCC(N1)C(=O)O Z1612958646 [0,0,0,0,1,1|2,0,0]=4 451 B11R1.266 CCN1CCCC(C1)C(=O)O Z763029984 [0,0,0,0,1,1|2,0,0]=4 452 B11R1.266 CCN1CCOC(C1)C(=O)O Z1459939099 [0,0,0,0,1,1|2,0,0]=4 453 B11R1.266 CC[C@@H]1COC[C@@H](N1)C(=O)O Z4767064022 [0,0,0,0,1,1|2,0,0]=4 454 B11R1.266 COC1CCCC(C1)C(=O)O Z1192182025 [0,0,0,0,1,1|2,0,0]=4 455 B11R1.266 COC1CCNC(C1)C(=O)O Z2768171860 [0,0,0,0,1,1|2,0,0]=4 456 B11R1.266 COC1CNCC(C1)C(=O)O Z5209028633 [0,0,0,0,1,1|2,0,0]=4 457 B11R1.266 N#CC1CCCC(C1)C(=O)O Z1515406065 [0,0,0,0,1,1|0,0,2]=4 458 B11R1.266 N#C[C@H]1CCC[C@H](C1)C(=O)O Z4790589241 [0,0,0,0,1,1|0,0,2]=4 459 B11R1.266 NCC1CC(CCO1)C(=O)O Z5712882945 [0,0,0,0,1,1|0,0,0]=2 460 B11R1.266 NCC1CCCN(C1)C(=O)N Z2083000180 [0,0,0,0,1,1|2,0,0]=4 461 B11R1.266 NCC1CN(CCO1)C(=O)N Z4438692383 [0,0,0,0,1,1|2,0,0]=4