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[0,1,0,0,0,0|2,0,0]=3 98 B12R1.21 NC(=O)CCN1CCC(CC1)N Z4170200070 [0,1,0,0,0,0|2,0,0]=3 99 B12R1.21 O=C(O)CCC1CCC(=O)NC1 Z1255439730 [0,1,0,0,0,0|1,0,1]=3 100 B12R1.21 O=C(O)CCC1CCC(CC1)O Z1198728321 [0,1,0,0,0,0|0,0,0]=1 101 B12R1.21 O=C(O)CCN1CCC(CC1)O Z803145326 [0,1,0,0,0,0|1,0,0]=2 102 B12R1.21 O=C(O)CC[C@H]1CC[C@H](CC1)O Z4957401425 [0,1,0,0,0,0|0,0,0]=1 103 B12R1.27 C/N=C(\N)/NCC1CCCCC1 Z1089994006 [0,1,0,0,0,0|3,0,0]=4 104 B12R1.27 C=CC(=O)NCC1CCCCC1 Z276666580 [0,1,0,0,0,0|2,0,0]=3 105 B12R1.27 C=CC(=O)NCC1CCCCS1 Z1413801321 [0,1,0,0,0,0|3,0,0]=4 106 B12R1.27 C=CC(=O)NCC1CCCOC1 Z728924364 [0,1,0,0,0,0|3,0,0]=4 107 B12R1.27 C=CC(=O)NCC1CCCSC1 Z2236362886 [0,1,0,0,0,0|3,0,0]=4 108 B12R1.27 C=CC(=O)NCC1CCOCC1 Z1147504505 [0,1,0,0,0,0|3,0,0]=4 109 B12R1.27 C=CC(=O)NCC1CCSCC1 Z1706024520 [0,1,0,0,0,0|3,0,0]=4 110 B12R1.27 CCC(=O)NCC1CCCCC1 Z32004338 [0,1,0,0,0,0|2,0,0]=3 111 B12R1.27 CCC(N)CCC1CCCCC1 Z1695784019 [0,1,0,0,0,0|2,0,1]=4 112 B12R1.27 CNC(=O)CCC1CCCCC1 Z32016974 [0,1,0,0,0,0|1,0,0]=2 113 B12R1.27 CNC(=O)CCC1CCCCN1 Z2065464268 [0,1,0,0,0,0|2,0,0]=3 114 B12R1.27 CNC(=O)CCC1CCCNC1 Z3300709050 [0,1,0,0,0,0|2,0,0]=3 115 B12R1.27 CNC(=O)NCC1CCCCN1 Z2690949547 [0,1,0,0,0,0|3,0,0]=4 116 B12R1.27 CNC(=O)OCC1CCCCN1 Z2092370236 [0,1,0,0,0,0|3,0,0]=4 117 B12R1.27 COC(=O)CCC1CNCCO1 Z4911721808 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.27 COC(=O)CCN1CCNCC1 Z803145360 [0,1,0,0,0,0|2,0,0]=3 119 B12R1.27 COC(=O)CNC1CCOCC1 Z440603604 [0,1,0,0,0,0|2,0,0]=3 120 B12R1.27 N/C(=N\O)/CCN1CCCCC1 Z57493557 [0,1,0,0,0,0|2,0,0]=3 121 B12R1.27 N/C(=N\O)/CCN1CCOCC1 Z57493560 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.27 NNC(=O)CCN1CCCCC1 Z56968880 [0,1,0,0,0,0|2,0,0]=3 123 B12R1.27 NNC(=O)CCN1CCOCC1 Z56964376 [0,1,0,0,0,0|3,0,0]=4 124 B12R1.27 O=C(CCl)NCC1CCCCC1 Z56896346 [0,1,0,0,0,0|2,0,0]=3 125 B12R1.27 O=C(CCl)NCC1CCOCC1 Z1147504519 [0,1,0,0,0,0|3,0,0]=4 126 B12R1.27 O=C(CO)NCC1CCCCC1 Z228585460 [0,1,0,0,0,0|1,0,0]=2 127 B12R1.43 CC(CC1CCCCC1)C(=O)O Z756390542 [0,1,0,0,0,0|0,0,0]=1 128 B12R1.43 CC(CC1CCCCN1)C(=O)O Z2471214714 [0,1,0,0,0,0|1,0,0]=2 129 B12R1.43 CC(CC1CCCNC1)C(=O)O Z2469986600 [0,1,0,0,0,0|1,0,0]=2 130 B12R1.43 CC(CC1CCNCC1)C(=O)O Z2467420945 [0,1,0,0,0,0|1,0,0]=2 131 B12R1.43 CC(CN1CCCCC1)C(=O)O Z418974874 [0,1,0,0,0,0|1,0,0]=2 132 B12R1.43 CC(CN1CCOCC1)C(=O)O Z57683747 [0,1,0,0,0,0|2,0,0]=3 133 B12R1.43 CC(OC1CCCCC1)C(=O)O Z316258726 [0,1,0,0,0,0|1,0,0]=2 134 B12R1.43 NC(CC1CCCCO1)C(=O)O Z1699857633 [0,1,0,0,0,0|1,0,0]=2 135 B12R1.43 NC(CC1CCOCC1)C(=O)O Z979764268 [0,1,0,0,0,0|1,0,0]=2 136 B12R1.43 NC(CN1CCCCC1)C(=O)O Z1526503304 [0,1,0,0,0,0|1,0,0]=2 137 B12R1.43 NC(CN1CCOCC1)C(=O)O Z1762658242 [0,1,0,0,0,0|2,0,0]=3 138 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O Z995228320 [0,1,0,0,0,0|0,0,0]=1 139 B12R1.43 N[C@@H](CC1CCNCC1)C(=O)O Z4635347562 [0,1,0,0,0,0|1,0,0]=2 140 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O Z995228686 [0,1,0,0,0,0|0,0,0]=1 141 B12R1.43 O=C(O)C(O)CC1CCCCC1 Z1255445171 [0,1,0,0,0,0|0,0,0]=1 142 B12R1.107 C/C(=C\C(=O)O)/C1CCCCC1 Z448247558 [0,1,0,0,0,0|0,0,2]=3 143 B12R1.107 CC(=O)NC(C)C1CCNCC1 Z426042770 [0,1,0,0,0,0|3,0,0]=4 144 B12R1.107 CC(CC(=O)O)C1CCCCC1 Z448247688 [0,1,0,0,0,0|0,0,0]=1 145 B12R1.107 CC(CC(=O)O)C1CCCNC1 Z1278927608 [0,1,0,0,0,0|1,0,0]=2 146 B12R1.107 CC(CC(=O)O)C1CCNCC1 Z1255420933 [0,1,0,0,0,0|1,0,0]=2 147 B12R1.107 CN(CC(=O)N)C1CCNCC1 Z5011212501 [0,1,0,0,0,0|3,0,0]=4 148 B12R1.107 CN(CC(=O)O)C1CCNCC1 Z1695822071 [0,1,0,0,0,0|2,0,0]=3 149 B12R1.107 NC(=O)CC(N)C1CCCCC1 Z1324055641 [0,1,0,0,0,0|1,0,0]=2 150 B12R1.107 NC(=O)CC(N)C1CCOCC1 Z1324054914 [0,1,0,0,0,0|2,0,0]=3 151 B12R1.125 CC1CCCCC1OCC(=O)O Z316259180 [0,1,0,0,0,0|1,0,0]=2 152 B12R1.125 CC1CNCCC1CCC(=O)O Z2235791789 [0,1,0,0,0,0|1,0,0]=2 153 B12R1.125 CN1CCCCC1CCC(=O)O Z1839480698 [0,1,0,0,0,0|1,0,0]=2 154 B12R1.125 NC1CCCCC1CCC(=O)O Z2230911221 [0,1,0,0,0,0|0,0,0]=1 155 B12R1.125 O=C([O-])CCC1COCCC1=O Z4402906946 [0,1,0,0,0,0|1,0,2]=4 156 B12R1.226 CC(=O)NC[C@@H]1C[C@@H](CCN1)C Z4714305745 [0,1,0,0,0,0|3,0,0]=4 157 B12R1.226 CC1CCCC(C1)OCC(=O)O Z362795694 [0,1,0,0,0,0|1,0,0]=2 158 B12R1.226 CN1CCCC(C1)CCC(=O)O Z3244908710 [0,1,0,0,0,0|1,0,0]=2 159 B12R1.226 NC1CCCN(C1)CCC(=O)O Z4449634242 [0,1,0,0,0,0|1,0,0]=2 160 B12R1.226 O=C(O)CCC1CCCC(=O)N1 Z1262514420 [0,1,0,0,0,0|1,0,1]=3 161 B12R1.226 O=C(O)CCC1CCCC(C1)O Z2195333402 [0,1,0,0,0,0|0,0,0]=1 162 B12R1.226 O=C(O)CC[C@H]1CCC[C@H](C1)O Z4606560762 [0,1,0,0,0,0|0,0,0]=1 163 B12R1.891 CS(=O)(=O)CCC1CCCCN1 Z2188172198 [0,1,0,0,0,0|2,0,1]=4 164 B12R1.891 NS(=O)(=O)CCC1CCCCC1 Z1400796472 [0,1,0,0,0,0|1,0,1]=3 165 B12R1.891 NS(=O)(=O)CCC1CCCCN1 Z3156156900 [0,1,0,0,0,0|2,0,1]=4 166 B12R1.891 O=S(=O)(F)CCC1CCCCC1 Z2907445833 [0,1,0,0,0,0|1,0,1]=3 167 B12R1.891 O=S(=O)(F)CCC1CCCCN1 Z3069147322 [0,1,0,0,0,0|2,0,1]=4 168 B12R1.891 O=S(=O)(F)CCC1CCCNC1 Z4297384656 [0,1,0,0,0,0|2,0,1]=4 169 B12R1.891 O=S(=O)(F)CCC1CCNCC1 Z4302465000 [0,1,0,0,0,0|2,0,1]=4 170 B12R1.891 O=S(=O)(F)CCC1CCOCC1 Z2907429169 [0,1,0,0,0,0|2,0,1]=4 171 B12R1.891 O=S(=O)(O)CCN1CCOCC1 Z1079084978 [0,1,0,0,0,0|3,0,0]=4 172 B12R1.3110 CC1(CCOCC1)/C=C/C(=O)O Z1262561088 [0,1,0,0,0,0|1,0,2]=4 173 B12R1.3110 NC1(CCCCC1)CCC(=O)O Z2900673592 [0,1,0,0,0,0|0,0,0]=1 174 B12R1.3110 NC1(CCOCC1)CCC(=O)O Z2935002206 [0,1,0,0,0,0|1,0,0]=2 175 B10R0.4 C#CCCCCCCC(=O)O Z1255435221 [0,0,1,0,0,0|0,0,2]=3 176 B10R0.4 CC(=O)OCCCCCCN Z5197785028 [0,0,1,0,0,0|3,0,0]=4 177 B10R0.4 CCCCCCCCC(=O)N Z296759818 [0,0,1,0,0,0|1,0,0]=2 178 B10R0.4 CCCCCCCCC(=O)O Z104473336 [0,0,1,0,0,0|0,0,0]=1 179 B10R0.4 CCCCCCCCS(=O)C Z1198155780 [0,0,1,0,0,0|2,0,0]=3 180 B10R0.4 CCCCCCOCC(=O)O Z362795556 [0,0,1,0,0,0|1,0,0]=2 181 B10R0.4 CCOCCCCCC(=O)O Z1219750577 [0,0,1,0,0,0|1,0,0]=2 182 B10R0.4 COCCCOCCC(=O)O Z608071756 [0,0,1,0,0,0|2,0,0]=3 183 B10R0.4 COCCOCCCC(=O)O Z316259206 [0,0,1,0,0,0|2,0,0]=3 184 B10R0.4 CSCCCCCCC(=O)O Z1262519805 [0,0,1,0,0,0|1,0,0]=2 185 B10R0.4 NCCCCCCCC(=O)O Z1201625777 [0,0,1,0,0,0|1,0,0]=2 186 B10R0.78 CCCCC(O)CCC(=O)O Z838959646 [0,0,1,0,0,0|1,0,0]=2 187 B10R0.78 CCCNC(=O)CCC(=O)O Z90423791 [0,0,1,0,0,0|2,0,1]=4 188 B12R2.24 CC1CCC2CCCCC2N1 Z3461947675 [0,0,0,1,0,0|2,0,1]=4 189 B12R2.24 CC1CNC2CCCCC2O1 Z405744524 [0,0,0,1,0,0|2,0,1]=4 190 B12R2.24 NC1CCC2CCCCC2C1 Z119993192 [0,0,0,1,0,0|2,0,1]=4 191 B12R2.24 O=C1C=C2CCOCC2CC1 Z1513655821 [0,0,0,1,0,0|2,0,1]=4 192 B12R2.24 O=C1CCC2CCCCC2N1 Z1255446208 [0,0,0,1,0,0|1,0,0]=2 193 B12R2.24 O=C1CCC2CNCCC2N1 Z2521982072 [0,0,0,1,0,0|2,0,0]=3 194 B12R2.24 O=C1CNC2CCCCC2N1 Z429372672 [0,0,0,1,0,0|2,0,0]=3 195 B12R2.24 O=C1NC[C@@H]2CCNC[C@@H]2N1 Z6052859652 [0,0,0,1,0,0|3,0,0]=4 196 B12R2.24 O=C1NC[C@@H]2CNCC[C@H]2N1 Z4523756533 [0,0,0,1,0,0|3,0,0]=4 197 B12R2.24 O=C1N[C@@H]2CCNC[C@H]2CO1 Z2309887450 [0,0,0,1,0,0|3,0,0]=4 198 B12R2.24 OC1CCC2CCNCC2C1 Z1509087581 [0,0,0,1,0,0|2,0,1]=4 199 B12R2.250 NC(=O)C1OC12CCCCC2 Z1262624515 [0,0,0,1,0,0|2,0,0]=3 200 B12R2.250 O=C(O)C1CC12CCCCC2 Z979743322 [0,0,0,1,0,0|0,0,0]=1 201 B12R2.250 O=C(O)C1CC12CCCNC2 Z2381575916 [0,0,0,1,0,0|1,0,0]=2 202 B12R2.250 O=C(O)C1CC12CCNCC2 Z2309759302 [0,0,0,1,0,0|1,0,0]=2 203 B12R2.250 O=C(O)C1CC12CCOCC2 Z979743428 [0,0,0,1,0,0|1,0,0]=2 204 B12R2.250 O=C(O)C1CC12CCSCC2 Z979743452 [0,0,0,1,0,0|1,0,0]=2 205 B12R2.594 O=C1CC2CCCC(C2)CN1 Z1509223166 [0,0,0,1,0,0|2,0,0]=3 206 B12R2.594 O=C1CC2CCCC(N2)CN1 Z3324747518 [0,0,0,1,0,0|3,0,0]=4 207 B12R2.1391 O=C(O)C1CC2CNCC1C2 Z3485473224 [0,0,0,1,0,0|1,0,0]=2 208 B12R2.1392 CC(=O)C1CC2CCC1CC2 Z1513600185 [0,0,0,1,0,0|1,0,0]=2 209 B12R2.1392 CC(=O)N1CC2CCC1CN2 Z4199017085 [0,0,0,1,0,0|3,0,0]=4 210 B12R2.1392 O=C(O)C1CC2C=CC1NC2 Z1416161621 [0,0,0,1,0,0|1,0,2]=4 211 B12R2.1392 O=C(O)C1CC2CCC1CC2 Z1262512036 [0,0,0,1,0,0|0,0,0]=1 212 B12R2.1392 O=C(O)C1CC2CCC1NC2 Z2235681418 [0,0,0,1,0,0|1,0,0]=2 213 B12R2.1392 O=C(O)C1CN2CCC1CC2 Z274488408 [0,0,0,1,0,0|1,0,0]=2 214 B12R2.1392 O=C(O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 Z2418536635 [0,0,0,1,0,0|0,0,2]=3 215 B12R2.1392 O=C(O)[C@H]1NC2CCC1CC2 Z1398462022 [0,0,0,1,0,0|1,0,0]=2 216 B12R2.2403 O=S1(=O)CCC2N1CCCC2 Z1255357771 [0,0,0,1,0,0|2,0,1]=4 217 B12R2.2918 NC1CCC2(C1)CCCCC2 Z3480665891 [0,0,0,1,0,0|2,0,1]=4 218 B12R2.2918 O=C1CC2(CCCCC2)CN1 Z1255399250 [0,0,0,1,0,0|2,0,0]=3 219 B12R2.2918 O=C1CC2(CCCCC2)NN1 Z2065532764 [0,0,0,1,0,0|3,0,0]=4 220 B12R2.2918 O=C1CC2(CCCNC2)CN1 Z1255458805 [0,0,0,1,0,0|3,0,0]=4 221 B12R2.2918 O=C1CC2(CCNCC2)CN1 Z1295543877 [0,0,0,1,0,0|3,0,0]=4 222 B12R2.2918 O=C1CC2(CCOCC2)CN1 Z1255400620 [0,0,0,1,0,0|3,0,0]=4 223 B12R2.2918 O=C1CC2(CCOCC2)CO1 Z1654815811 [0,0,0,1,0,0|3,0,0]=4 224 B12R2.2918 O=C1CCC2(C1)CCNCC2 Z4606131499 [0,0,0,1,0,0|2,0,0]=3 225 B12R2.2918 O=C1CCC2(N1)CCCCC2 Z1255448896 [0,0,0,1,0,0|1,0,0]=2 226 B12R2.2918 O=C1CCC2(N1)CCCNC2 Z5009823748 [0,0,0,1,0,0|2,0,0]=3 227 B12R2.2918 O=C1CCC2(N1)CCNCC2 Z1255404051 [0,0,0,1,0,0|2,0,0]=3 228 B12R2.2918 O=C1NC2(CCNCC2)CO1 Z1891776567 [0,0,0,1,0,0|3,0,0]=4 229 B12R2.2918 O=C1NC2(CCOCC2)CO1 Z1266873540 [0,0,0,1,0,0|3,0,0]=4 230 B12R2.2918 O=C1NCC2(N1)CCNCC2 Z3244818134 [0,0,0,1,0,0|3,0,0]=4 231 B12R2.2918 O=C1NCC2(O1)CCCNC2 Z1787355749 [0,0,0,1,0,0|2,0,0]=3 232 B12R2.2918 O=C1NCC2(O1)CCNCC2 Z1762997344 [0,0,0,1,0,0|2,0,0]=3 233 B12R2.2918 OC1CCC2(C1)CCNCC2 Z4830338570 [0,0,0,1,0,0|2,0,1]=4 234 B12R2.3190 O=C(O)[C@@H]1C[C@H]2[C@@H]1CCCC2 Z2940093782 [0,0,0,1,0,0|0,0,0]=1 235 B10R1.18 CC(=O)CC1CCNCC1 Z3235039172 [0,0,0,0,1,0|2,0,0]=3 236 B10R1.18 CC(=O)CC1CCOCC1 Z992965782 [0,0,0,0,1,0|2,0,0]=3 237 B10R1.18 CC(=O)CC1COCCN1 Z1649677748 [0,0,0,0,1,0|3,0,0]=4 238 B10R1.18 CC(=O)NC1CCCNC1 Z285140960 [0,0,0,0,1,0|3,0,0]=4 239 B10R1.18 CC(=O)NC1CCNCC1 Z969560560 [0,0,0,0,1,0|3,0,0]=4 240 B10R1.18 CC(N)CC1CCCCC1 Z3235020113 [0,0,0,0,1,0|2,0,1]=4 241 B10R1.18 CC(O)CC1CCCCN1 Z1203731039 [0,0,0,0,1,0|2,0,1]=4 242 B10R1.18 CC(O)CC1CCNCC1 Z3269078967 [0,0,0,0,1,0|2,0,1]=4 243 B10R1.18 N=C(N)CC1CCCCC1 Z803129918 [0,0,0,0,1,0|2,0,0]=3 244 B10R1.18 NC(=NC1CCCCC1)N Z1250080946 [0,0,0,0,1,0|3,0,0]=4 245 B10R1.18 NC(=O)CC1CCCCC1 Z33547160 [0,0,0,0,1,0|1,0,0]=2 246 B10R1.18 NC(=O)CC1CCCCN1 Z370714204 [0,0,0,0,1,0|2,0,0]=3 247 B10R1.18 NC(=O)CC1CCCNC1 Z1318268688 [0,0,0,0,1,0|2,0,0]=3 248 B10R1.18 NC(=O)CC1CCNCC1 Z300072138 [0,0,0,0,1,0|2,0,0]=3 249 B10R1.18 NC(=O)CC1CNCCO1 Z1274804035 [0,0,0,0,1,0|3,0,0]=4 250 B10R1.18 NC(=O)CC1COCCN1 Z2080125157 [0,0,0,0,1,0|3,0,0]=4 251 B10R1.18 NC(=O)CN1CCNCC1 Z169506468 [0,0,0,0,1,0|3,0,0]=4 252 B10R1.18 NC(=O)NC1CCCCC1 Z56896929 [0,0,0,0,1,0|2,0,0]=3 253 B10R1.18 NC(=O)NC1CCCNC1 Z1259341125 [0,0,0,0,1,0|3,0,0]=4 254 B10R1.18 NC(=O)NC1CCNCC1 Z1272096623 [0,0,0,0,1,0|3,0,0]=4 255 B10R1.18 NC(=S)NC1CCCCC1 Z56931891 [0,0,0,0,1,0|2,1,0]=4 256 B10R1.18 O=C(O)C=C1CCCCC1 Z352748084 [0,0,0,0,1,0|0,0,2]=3 257 B10R1.18 O=C(O)C=C1CCOCC1 Z440605394 [0,0,0,0,1,0|1,0,2]=4 258 B10R1.18 O=C(O)C=C1CCSCC1 Z1262528560 [0,0,0,0,1,0|1,0,2]=4 259 B10R1.18 O=C(O)CC1=CCCCC1 Z1138835936 [0,0,0,0,1,0|0,0,2]=3 260 B10R1.18 O=C(O)CC1=CCOCC1 Z1205495477 [0,0,0,0,1,0|1,0,2]=4 261 B10R1.18 O=C(O)CC1C=CCCC1 Z1198264430 [0,0,0,0,1,0|0,0,2]=3 262 B10R1.18 O=C(O)CC1CCCCC1 Z104486044 [0,0,0,0,1,0|0,0,0]=1 263 B10R1.18 O=C(O)CC1CCCCN1 Z3234954063 [0,0,0,0,1,0|1,0,0]=2 264 B10R1.18 O=C(O)CC1CCCCO1 Z432421618 [0,0,0,0,1,0|1,0,0]=2 265 B10R1.18 O=C(O)CC1CCCNC1 Z1272743958 [0,0,0,0,1,0|1,0,0]=2 266 B10R1.18 O=C(O)CC1CCCOC1 Z445215100 [0,0,0,0,1,0|1,0,0]=2 267 B10R1.18 O=C(O)CC1CCOCC1 Z440605396 [0,0,0,0,1,0|1,0,0]=2 268 B10R1.18 O=C(O)CC1CCSCC1 Z826531570 [0,0,0,0,1,0|1,0,0]=2 269 B10R1.18 O=C(O)CC1CNCCO1 Z3241262582 [0,0,0,0,1,0|2,0,0]=3 270 B10R1.18 O=C(O)CC1COCCN1 Z1741981133 [0,0,0,0,1,0|2,0,0]=3 271 B10R1.18 O=C(O)CC1CSCCS1 Z1492186731 [0,0,0,0,1,0|2,0,0]=3 272 B10R1.18 O=C(O)CC1OCCCO1 Z1205495524 [0,0,0,0,1,0|2,0,0]=3 273 B10R1.18 O=C(O)CN1CCCCC1 Z1171978832 [0,0,0,0,1,0|1,0,0]=2 274 B10R1.18 O=C(O)CN1CCNCC1 Z2887863329 [0,0,0,0,1,0|2,0,0]=3 275 B10R1.18 O=C(O)CN1CCOCC1 Z1270246390 [0,0,0,0,1,0|2,0,0]=3 276 B10R1.66 CC(=O)NCC1CCCN1 Z4898465730 [0,0,0,0,1,0|3,0,0]=4 277 B10R1.66 CC(=O)OCC1CCNC1 Z1201627164 [0,0,0,0,1,0|3,0,0]=4 278 B10R1.66 CC(N)CCC1CCCC1 Z1255523280 [0,0,0,0,1,0|2,0,1]=4 279 B10R1.66 NC(=O)CCN1CCCC1 Z1800456308 [0,0,0,0,1,0|2,0,0]=3 280 B10R1.66 NC(=O)CNC1CCCC1 Z90608472 [0,0,0,0,1,0|2,0,0]=3 281 B10R1.66 NC(=O)NCC1CCCC1 Z415672550 [0,0,0,0,1,0|2,0,0]=3 282 B10R1.66 NC(=O)NCC1CCCO1 Z56911934 [0,0,0,0,1,0|3,0,0]=4 283 B10R1.66 O=C(O)C#CC1CCOC1 Z1235950936 [0,0,0,0,1,0|1,0,2]=4 284 B10R1.66 O=C(O)CCC1CCCC1 Z104478044 [0,0,0,0,1,0|0,0,0]=1 285 B10R1.66 O=C(O)CCC1CCCN1 Z2467454523 [0,0,0,0,1,0|1,0,0]=2 286 B10R1.66 O=C(O)CCC1CCCO1 Z362564576 [0,0,0,0,1,0|1,0,0]=2 287 B10R1.66 O=C(O)CCC1CCNC1 Z1198312388 [0,0,0,0,1,0|1,0,0]=2 288 B10R1.66 O=C(O)CCC1CCOC1 Z975825286 [0,0,0,0,1,0|1,0,0]=2 289 B10R1.66 O=C(O)CNC1CCCC1 Z359505658 [0,0,0,0,1,0|1,0,0]=2 290 B10R1.66 O=C(O)COC1CC=CC1 Z3281957273 [0,0,0,0,1,0|1,0,2]=4 291 B10R1.66 O=C(O)COC1CCCC1 Z316258762 [0,0,0,0,1,0|1,0,0]=2 292 B10R1.66 O=C(O)COC1CCNC1 Z4875638894 [0,0,0,0,1,0|2,0,0]=3 293 B10R1.66 O=C(O)COC1CCOC1 Z1138838239 [0,0,0,0,1,0|2,0,0]=3 294 B10R1.66 O=C(O)CSC1CCCC1 Z147646804 [0,0,0,0,1,0|1,0,0]=2 295 B10R1.66 O=C([O-])CCN1CCCC1 Z398513132 [0,0,0,0,1,0|1,0,1]=3 296 B12R1.252 CC(=O)NCCC1=CCCCC1 Z69091529 [0,0,0,0,0,1|1,0,2]=4 297 B12R1.252 CC(=O)NCCC1CCCNC1 Z1457132495 [0,0,0,0,0,1|2,0,0]=3 298 B12R1.252 CC(=O)NCCN1CCCCC1 Z2713330537 [0,0,0,0,0,1|2,0,0]=3 299 B12R1.252 CC(=O)NCCN1CCOCC1 Z32409842 [0,0,0,0,0,1|3,0,0]=4 300 B12R1.252 CC(N)COCC1CCCCC1 Z2832158623 [0,0,0,0,0,1|2,0,1]=4 301 B12R1.252 CN(C)CCNC1CCCCC1 Z600428512 [0,0,0,0,0,1|3,0,0]=4 302 B12R1.252 N=C(N)CCCN1CCCCC1 Z1695785893 [0,0,0,0,0,1|3,0,0]=4 303 B12R1.252 N=C(N)CCOC1CCCCC1 Z823287508 [0,0,0,0,0,1|2,0,0]=3 304 B12R1.252 NC(=O)NCCC1=CCCCC1 Z57000542 [0,0,0,0,0,1|1,0,2]=4 305 B12R1.252 NC(=O)NCCN1CCOCC1 Z1262250846 [0,0,0,0,0,1|3,0,0]=4 306 B12R1.252 O=C(O)CCCC1CCCCC1 Z104482928 [0,0,0,0,0,1|0,0,0]=1 307 B12R1.252 O=C(O)CCCC1CCCCN1 Z2106608775 [0,0,0,0,0,1|1,0,0]=2 308 B12R1.252 O=C(O)CCCC1CCCNC1 Z2831439612 [0,0,0,0,0,1|1,0,0]=2 309 B12R1.252 O=C(O)CCCC1CCNCC1 Z2106608777 [0,0,0,0,0,1|1,0,0]=2 310 B12R1.252 O=C(O)CCCC1CCOCC1 Z1209411166 [0,0,0,0,0,1|1,0,0]=2 311 B12R1.252 O=C(O)CCCN1CCCCC1 Z600397690 [0,0,0,0,0,1|1,0,0]=2 312 B12R1.252 O=C(O)CCCN1CCNCC1 Z5247767817 [0,0,0,0,0,1|2,0,0]=3 313 B12R1.252 O=C(O)CCNC1CCCCC1 Z3344728240 [0,0,0,0,0,1|0,0,0]=1 314 B12R1.252 O=C(O)CCNC1CCNCC1 Z1737940641 [0,0,0,0,0,1|1,0,0]=2 315 B12R1.252 O=C(O)CCOC1CCOCC1 Z802587588 [0,0,0,0,0,1|1,0,0]=2 316 B12R1.252 O=C(O)COCC1CCCOC1 Z2684036156 [0,0,0,0,0,1|1,0,0]=2 317 B12R1.252 O=C(O)COCC1CCNCC1 Z3571155173 [0,0,0,0,0,1|1,0,0]=2 318 B12R1.252 O=C(O)CSCC1CCCCO1 Z214812604 [0,0,0,0,0,1|1,0,0]=2 319 B12R1.1343 O=C(O)CCC1CCCCNC1 Z5060031354 [0,0,0,0,0,1|0,0,0]=1 320 B12R1.1343 O=C(O)CCN1CCCCCC1 Z1171978831 [0,0,0,0,0,1|1,0,0]=2 321 B12R1.1343 O=C(O)CCN1CSCCSC1 Z2588062920 [0,0,0,0,0,1|2,0,0]=3 322 B9R0.2 C#CCCCCCC(=O)O Z1205493707 [1,0,1,0,0,0|0,0,2]=4 323 B9R0.2 CCCCCCCC(=O)O Z104495238 [1,0,1,0,0,0|0,0,0]=2 324 B9R0.2 CCCCCNCC(=O)N Z104536260 [1,0,1,0,0,0|2,0,0]=4 325 B9R0.2 CCCCCOCC(=O)O Z409357548 [1,0,1,0,0,0|1,0,0]=3 326 B9R0.2 CCCCSCCC(=O)O Z149304844 [1,0,1,0,0,0|1,0,0]=3 327 B9R0.2 CCNCCCCC(=O)O Z2893830564 [1,0,1,0,0,0|1,0,0]=3 328 B9R0.2 CCOCCOCC(=O)O Z316258972 [1,0,1,0,0,0|2,0,0]=4 329 B9R0.2 COCCNCCC(=O)O Z53116030 [1,0,1,0,0,0|2,0,0]=4 330 B9R0.2 COCCOCCC(=O)O Z316259200 [1,0,1,0,0,0|2,0,0]=4 331 B9R0.2 NCCCCCCC(=O)O Z56896351 [1,0,1,0,0,0|1,0,0]=3 332 B9R0.2 NCCOCCCC(=O)O Z5080450038 [1,0,1,0,0,0|2,0,0]=4 333 B9R0.2 O=C(O)CCNCCCO Z53116999 [1,0,1,0,0,0|2,0,0]=4 334 B9R0.45 CCCCCCCCCO Z104476100 [1,0,1,0,0,0|0,0,1]=3 335 B9R0.45 CCCCCCCNC=O Z1203732044 [1,0,1,0,0,0|1,0,0]=3 336 B9R0.45 CCCCCCNCCO Z137800948 [1,0,1,0,0,0|1,0,1]=4 337 B9R0.45 CCCCOCCCCO Z993012624 [1,0,1,0,0,0|1,0,1]=4 338 B9R0.45 NCCCCCCCCO Z4745386600 [1,0,1,0,0,0|1,0,1]=4 339 B9R0.43 CCN(CC)CCC(=O)O Z1259161971 [1,0,1,0,0,0|1,0,0]=3 340 B9R0.48 CCCN(C)CCC(=O)O Z1259273124 [1,0,1,0,0,0|1,0,0]=3 341 B9R0.48 CN(CCO)CCC(=O)O Z53116523 [1,0,1,0,0,0|2,0,0]=4 342 B9R0.48 COCC(C)NCC(=O)O Z1259273105 [1,0,1,0,0,0|2,0,0]=4 343 B9R1.8 C=CCC1CCCCN1 Z3976272491 [2,0,0,0,0,0|1,0,1]=4 344 B9R1.8 CCCC1CCCCN1 Z1665033554 [2,0,0,0,0,0|1,0,1]=4 345 B9R1.8 CCCC1CCCNC1 Z1404660494 [2,0,0,0,0,0|1,0,1]=4 346 B9R1.8 CCCC1CCNCC1 Z963408928 [2,0,0,0,0,0|1,0,1]=4 347 B9R1.8 CCNC1CCCCC1 Z235346963 [2,0,0,0,0,0|1,0,1]=4 348 B9R1.8 CNCC1CCCCC1 Z102767074 [2,0,0,0,0,0|1,0,1]=4 349 B9R1.8 ClCCN1CCCCC1 Z235354563 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.8 N#CCC1CCCCC1 Z295382924 [2,0,0,0,0,0|1,0,1]=4 351 B9R1.8 NCCC1CCCCC1 Z367451182 [2,0,0,0,0,0|1,0,0]=3 352 B9R1.8 NCCC1CCCCO1 Z432420620 [2,0,0,0,0,0|2,0,0]=4 353 B9R1.8 NCCC1CCNCC1 Z756921054 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.8 NCCC1CCOCC1 Z851015130 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.8 NCCC1CCSCC1 Z2768149804 [2,0,0,0,0,0|2,0,0]=4 356 B9R1.8 O=CC=C1CCCCC1 Z1251356876 [2,0,0,0,0,0|0,0,2]=4 357 B9R1.8 O=CCC1CCCCC1 Z993017728 [2,0,0,0,0,0|0,0,0]=2 358 B9R1.8 O=CCC1CCCCO1 Z1511748073 [2,0,0,0,0,0|1,0,0]=3 359 B9R1.8 O=CCC1CCCOC1 Z1198309923 [2,0,0,0,0,0|1,0,0]=3 360 B9R1.8 O=CCC1CCOCC1 Z1178491139 [2,0,0,0,0,0|1,0,0]=3 361 B9R1.8 OCCC1CCCCC1 Z397587116 [2,0,0,0,0,0|0,0,0]=2 362 B9R1.8 OCCC1CCCCO1 Z1198184633 [2,0,0,0,0,0|1,0,0]=3 363 B9R1.8 OCCC1CCCNC1 Z1263820461 [2,0,0,0,0,0|1,0,0]=3 364 B9R1.8 OCCC1CCCOC1 Z1198309922 [2,0,0,0,0,0|1,0,0]=3 365 B9R1.8 OCCC1CCNCC1 Z336087886 [2,0,0,0,0,0|1,0,0]=3 366 B9R1.8 OCCC1CCOCC1 Z1178491138 [2,0,0,0,0,0|1,0,0]=3 367 B9R1.8 OCCC1CSCCN1 Z1375026565 [2,0,0,0,0,0|2,0,0]=4 368 B9R1.8 OCCN1CCCCC1 Z104479032 [2,0,0,0,0,0|1,0,0]=3 369 B9R1.8 OCCN1CCNCC1 Z104477190 [2,0,0,0,0,0|2,0,0]=4 370 B9R1.8 OCCN1CCOCC1 Z104474266 [2,0,0,0,0,0|2,0,0]=4 371 B9R1.8 OCCN1CCSCC1 Z425793720 [2,0,0,0,0,0|2,0,0]=4 372 B11R0.2 CCCCCCC(C)CC(=O)O Z362824108 [0,1,1,0,0,0|0,0,0]=2 373 B11R0.2 CCCCCCN(C)CC(=O)O Z1259273334 [0,1,1,0,0,0|1,0,0]=3 374 B11R0.30 CC(=O)CCCCCCC(=O)C Z1198162235 [0,1,1,0,0,0|1,0,1]=4 375 B11R0.30 CC(=O)CCCCCCC(=O)O Z1262510893 [0,1,1,0,0,0|0,0,1]=3 376 B11R0.30 CC(=O)NCCCCCC(=O)O Z56914861 [0,1,1,0,0,0|1,0,1]=4 377 B11R0.30 CC(C)CCNCCCC(=O)O Z1696091863 [0,1,1,0,0,0|1,0,0]=3 378 B11R0.30 O=C(O)CCCCCCC(=O)O Z104473456 [0,1,1,0,0,0|1,0,1]=4 379 B11R0.40 COC(=O)CCCCCCCN Z1416203196 [0,1,1,0,0,0|1,0,0]=3 380 B11R0.42 C#CCCCCCC(N)C(=O)O Z4920921873 [0,1,1,0,0,0|0,0,2]=4 381 B11R0.42 CCOCCNCC(C)C(=O)O Z1270387257 [0,1,1,0,0,0|2,0,0]=4 382 B11R0.46 CCCCCN(C)CCC(=O)O Z1459932154 [0,1,1,0,0,0|1,0,0]=3 383 B11R0.111 CCC(N)COCCCC(=O)O Z5332674953 [0,1,1,0,0,0|1,0,0]=3 384 B11R0.147 CCCNC(=O)CCCC(=O)O Z90423792 [0,1,1,0,0,0|1,0,1]=4 385 B11R0.148 CCCCCCCCCC(=O)O Z104474944 [0,1,1,0,0,0|0,0,0]=2 386 B11R0.148 CCCCCCCCNC(=O)C Z1509141066 [0,1,1,0,0,0|1,0,0]=3 387 B11R0.148 CCCCCCCNCC(=O)O Z1259273296 [0,1,1,0,0,0|0,0,0]=2 388 B11R0.148 CNCCCNCCCC(=O)O Z1537009544 [0,1,1,0,0,0|1,0,0]=3 389 B11R0.133 CCCN(CC)C(=O)CC(=O)O Z963468902 [0,1,1,0,0,0|1,0,1]=4 390 B11R0.59 CCCC(C)N(C)CCC(=O)O Z1465347640 [0,1,1,0,0,0|1,0,0]=3 391 B11R0.163 CCCCS(=O)C[C@H](N)C(=O)O Z1198151261 [0,1,1,0,0,0|2,0,0]=4 392 B11R1.1 C=CCCN1CCC(CC1)N Z2065788355 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.1 CCCCC1CCC(CC1)N Z839028544 [1,1,0,0,0,0|1,0,1]=4 394 B11R1.16 CCCC(N)C1CCCCC1 Z513797868 [1,1,0,0,0,0|1,0,1]=4 395 B11R1.16 CN(CCO)C1CCCCC1 Z159528828 [1,1,0,0,0,0|1,0,1]=4 396 B11R1.16 CNCC(C)C1CCCCC1 Z2680755428 [1,1,0,0,0,0|2,0,0]=4 397 B11R1.16 NC(CCO)C1CCCCC1 Z979743602 [1,1,0,0,0,0|0,0,1]=3 398 B11R1.16 NC(CCO)C1CCOCC1 Z1688198423 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.17 CC1CCCCN1CCCO Z168932308 [1,1,0,0,0,0|1,0,1]=4 400 B11R1.28 CCCCNC1CCCCC1 Z2218556189 [1,1,0,0,0,0|1,0,1]=4 401 B11R1.28 CCCNCC1CCCCC1 Z57170999 [1,1,0,0,0,0|1,0,1]=4 402 B11R1.28 COCCNC1CCCCC1 Z90501874 [1,1,0,0,0,0|1,0,1]=4 403 B11R1.28 N#CCCOC1CCCCC1 Z317037706 [1,1,0,0,0,0|1,0,1]=4 404 B11R1.28 O=CNCCN1CCOCC1 Z1258521081 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.28 OCCCCC1CCNCC1 Z3234885301 [1,1,0,0,0,0|1,0,1]=4 406 B11R1.28 OCCCNC1CCCCC1 Z3504619196 [1,1,0,0,0,0|0,0,1]=3 407 B11R1.28 OCCCOC1CCCCC1 Z362785378 [1,1,0,0,0,0|0,0,1]=3 408 B11R1.28 OCCCOC1CCNCC1 Z382707290 [1,1,0,0,0,0|1,0,1]=4 409 B11R1.28 OCCNCC1CCCCC1 Z90504645 [1,1,0,0,0,0|0,0,1]=3 410 B11R1.40 CC(C=O)CC1CCCCC1 Z1238838137 [1,1,0,0,0,0|0,0,0]=2 411 B11R1.40 CC(C=O)CC1CCOCC1 Z1238838084 [1,1,0,0,0,0|1,0,0]=3 412 B11R1.40 CC(CO)CC1CCCCC1 Z1238840407 [1,1,0,0,0,0|0,0,1]=3 413 B11R1.40 CC(CO)CC1CCNCC1 Z4511729558 [1,1,0,0,0,0|1,0,1]=4 414 B11R1.40 CC(CO)CC1CCOCC1 Z1238840447 [1,1,0,0,0,0|1,0,1]=4 415 B11R1.40 NC(CO)CC1CCCCC1 Z1201620851 [1,1,0,0,0,0|0,0,1]=3 416 B11R1.40 NC(CO)CC1CCCCO1 Z4777204053 [1,1,0,0,0,0|1,0,1]=4 417 B11R1.40 NCC(O)CC1CCCCC1 Z5195335934 [1,1,0,0,0,0|1,0,1]=4 418 B11R1.20 CC1CCC(=CC(=O)O)CC1 Z352748308 [0,1,0,0,1,0|0,0,2]=4 419 B11R1.20 CC1CCC(CC1)C[N+](=O)[O-] Z3271333405 [0,1,0,0,1,0|1,0,1]=4 420 B11R1.20 CC1CCN(CC1)CC(=O)N Z54847897 [0,1,0,0,1,0|2,0,0]=4 421 B11R1.20 CC1CCN(CC1)CC(=O)O Z197278060 [0,1,0,0,1,0|1,0,0]=3 422 B11R1.20 CN1CCC(CC1)CC(=O)O Z2524805848 [0,1,0,0,1,0|1,0,0]=3 423 B11R1.20 CN1CCN(CC1)CC(=O)O Z57912405 [0,1,0,0,1,0|2,0,0]=4 424 B11R1.20 C[C@@H]1CO[C@H](CO1)CC(=O)O Z4905357119 [0,1,0,0,1,0|2,0,0]=4 425 B11R1.20 NC(=O)CN1CCC(CC1)O Z54505513 [0,1,0,0,1,0|2,0,0]=4 426 B11R1.20 NC(=O)NC1CCC(CC1)O Z198194888 [0,1,0,0,1,0|2,0,0]=4 427 B11R1.20 NC1CCC(CC1)CC(=O)O Z3243726577 [0,1,0,0,1,0|0,0,0]=2 428 B11R1.20 NC1CCN(CC1)CC(=O)O Z1762658240 [0,1,0,0,1,0|1,0,0]=3 429 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O Z1255418104 [0,1,0,0,1,0|0,0,0]=2 430 B11R1.20 O=C(O)CC1CCC(=O)CC1 Z1198235241 [0,1,0,0,1,0|0,0,1]=3 431 B11R1.20 O=C(O)CC1CCC(=O)NC1 Z1416171278 [0,1,0,0,1,0|1,0,1]=4 432 B11R1.20 O=C(O)CN1CCC(CC1)O Z744593184 [0,1,0,0,1,0|1,0,0]=3 433 B11R1.20 O=C(O)CN1CCS(=O)CC1 Z1459993590 [0,1,0,0,1,0|2,0,0]=4 434 B11R1.36 CC(=O)C(C)C1CCCCC1 Z1255356497 [0,1,0,0,1,0|1,0,0]=3 435 B11R1.36 CC(C(=O)N)N1CCCCC1 Z103698666 [0,1,0,0,1,0|2,0,0]=4 436 B11R1.36 CC(C(=O)O)C1CCNCC1 Z3244908692 [0,1,0,0,1,0|1,0,0]=3 437 B11R1.36 CC(C(=O)O)C1CCOCC1 Z1262520886 [0,1,0,0,1,0|1,0,0]=3 438 B11R1.36 CC(C(=O)O)N1CCCCC1 Z1172068155 [0,1,0,0,1,0|1,0,0]=3 439 B11R1.36 CC(C(=O)O)N1CCSCC1 Z359352804 [0,1,0,0,1,0|2,0,0]=4 440 B11R1.36 C[C@@H](C(=O)O)N1CCOCC1 Z1262520045 [0,1,0,0,1,0|2,0,0]=4 441 B11R1.36 NC(=O)C(O)C1CCOCC1 Z979770898 [0,1,0,0,1,0|2,0,0]=4 442 B11R1.36 NC(C(=O)O)C1CC=CCC1 Z3562671618 [0,1,0,0,1,0|0,0,2]=4 443 B11R1.36 NC(C(=O)O)C1CCCCC1 Z752370756 [0,1,0,0,1,0|0,0,0]=2 444 B11R1.36 NC(C(=O)O)C1CCOCC1 Z2895181969 [0,1,0,0,1,0|1,0,0]=3 445 B11R1.36 O=C(O)C(F)C1CCNCC1 Z2733346658 [0,1,0,0,1,0|1,0,0]=3 446 B11R1.36 O=C(O)C(O)C1CCCCC1 Z788000630 [0,1,0,0,1,0|0,0,0]=2 447 B11R1.36 O=C(O)C(O)C1CCCNC1 Z1964357511 [0,1,0,0,1,0|1,0,0]=3 448 B11R1.36 O=C(O)C(O)C1CCNCC1 Z3045554278 [0,1,0,0,1,0|1,0,0]=3 449 B11R1.86 CC(=O)NC1CCCCC1C Z32972082 [0,1,0,0,1,0|2,0,0]=4 450 B11R1.86 CC1CCCCC1CC(=O)O Z352783476 [0,1,0,0,1,0|0,0,0]=2 451 B11R1.86 CC1CCCCC1NC(=O)N Z56985817 [0,1,0,0,1,0|2,0,0]=4 452 B11R1.86 CC1CCCCN1CC(=O)N Z54751033 [0,1,0,0,1,0|2,0,0]=4 453 B11R1.86 CC1CCNCC1CC(=O)O Z2515281558 [0,1,0,0,1,0|1,0,0]=3 454 B11R1.86 CN1CCCCC1CC(=O)O Z2106602368 [0,1,0,0,1,0|1,0,0]=3 455 B11R1.86 NC1CCOCC1CC(=O)O Z2732475544 [0,1,0,0,1,0|1,0,0]=3 456 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Z2235791115 [0,1,0,0,1,0|0,0,0]=2 457 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O Z1262514098 [0,1,0,0,1,0|0,0,0]=2 458 B11R1.157 CC1CCCC(C1)CC(=O)O Z352783434 [0,1,0,0,1,0|0,0,0]=2 459 B11R1.157 CC1CCCN(C1)CC(=O)N Z54749656 [0,1,0,0,1,0|2,0,0]=4 460 B11R1.157 CC1CNCC(C1)CC(=O)O Z2235790824 [0,1,0,0,1,0|1,0,0]=3 461 B11R1.157 CC1CNCC(O1)CC(=O)O Z3991477375 [0,1,0,0,1,0|2,0,0]=4 462 B11R1.157 CC1COCC(O1)CC(=O)O Z5033360121 [0,1,0,0,1,0|2,0,0]=4 463 B11R1.157 CN1CCCC(C1)CC(=O)O Z2310699362 [0,1,0,0,1,0|1,0,0]=3 464 B11R1.157 C[C@@H]1CCC[C@@H](O1)CC(=O)O Z4946669801 [0,1,0,0,1,0|1,0,0]=3 465 B11R1.157 NC(=O)CC1CCCC(C1)N Z4439100400 [0,1,0,0,1,0|1,0,0]=3 466 B11R1.157 NC(=O)CN1CCCC(C1)N Z803145266 [0,1,0,0,1,0|2,0,0]=4 467 B11R1.157 NC1CCCC(C1)CC(=O)O Z5087190945 [0,1,0,0,1,0|0,0,0]=2 468 B11R1.157 NC1CCOC(C1)CC(=O)O Z4579787506 [0,1,0,0,1,0|1,0,0]=3 469 B11R1.157 O=C(O)CC1CCCC(=O)C1 Z907709938 [0,1,0,0,1,0|0,0,1]=3 470 B11R1.157 O=C(O)CC1CCCC(=O)N1 Z1255458725 [0,1,0,0,1,0|1,0,1]=4 471 B11R1.157 O=C(O)CC1CCCC(C1)O Z1262524441 [0,1,0,0,1,0|0,0,0]=2 472 B11R1.509 NS(=O)(=O)CC1CCCCC1 Z734461532 [0,1,0,0,1,0|1,0,1]=4 473 B11R1.509 O=S(=O)(F)CC1CCCCC1 Z991753780 [0,1,0,0,1,0|1,0,1]=4 474 B11R1.928 CC1(CCCCC1)CC(=O)O Z1255466882 [0,1,0,0,1,0|0,0,0]=2 475 B11R1.928 CC1(CCNCC1)CC(=O)O Z5590137993 [0,1,0,0,1,0|1,0,0]=3 476 B11R1.928 NC(=O)CC1(CCCCC1)N Z2941400913 [0,1,0,0,1,0|1,0,0]=3 477 B11R1.928 NC(=O)CC1(CCOCC1)N Z1335657666 [0,1,0,0,1,0|2,0,0]=4 478 B11R1.928 NC1(CCCCC1)CC(=O)O Z1741975256 [0,1,0,0,1,0|0,0,0]=2 479 B11R1.928 NC1(CCNCC1)CC(=O)O Z1624323979 [0,1,0,0,1,0|1,0,0]=3 480 B11R1.928 NC1(CCOCC1)CC(=O)O Z2255110164 [0,1,0,0,1,0|1,0,0]=3 481 B11R1.928 O=C(O)CC1(CCCCC1)O Z982131964 [0,1,0,0,1,0|0,0,0]=2 482 B11R1.928 O=C(O)CC1(CCNCC1)O Z3488912123 [0,1,0,0,1,0|1,0,0]=3 483 B11R1.928 O=C(O)CC1(CCOCC1)O Z982132196 [0,1,0,0,1,0|1,0,0]=3 484 B11R1.25 CNC(=O)CSC1CCCC1 Z18828360 [0,1,0,0,1,0|2,0,0]=4 485 B11R1.25 COC(=O)CCC1CCCC1 Z18434654 [0,1,0,0,1,0|0,0,0]=2 486 B11R1.25 COC(=O)CCC1CCCO1 Z380302304 [0,1,0,0,1,0|1,0,0]=3 487 B11R1.25 COC(=O)CCN1CCCC1 Z53116276 [0,1,0,0,1,0|1,0,0]=3 488 B11R1.25 COC(=O)CNC1CCCC1 Z235648990 [0,1,0,0,1,0|1,0,0]=3 489 B11R1.35 CC(CC1CCCC1)C(=O)O Z804901352 [0,1,0,0,1,0|0,0,0]=2 490 B11R1.35 CC(NC1CCCC1)C(=O)O Z1801304728 [0,1,0,0,1,0|1,0,0]=3 491 B11R1.35 CC(OC1CCCC1)C(=O)O Z316258764 [0,1,0,0,1,0|1,0,0]=3 492 B11R1.35 CC(SC1CCCC1)C(=O)N Z18828515 [0,1,0,0,1,0|2,0,0]=4 493 B11R1.35 NC(CC1CCCC1)C(=O)O Z1558210079 [0,1,0,0,1,0|0,0,0]=2 494 B11R1.35 NC(CC1CCCO1)C(=O)O Z317025024 [0,1,0,0,1,0|1,0,0]=3 495 B11R1.35 NC(CC1CCOC1)C(=O)O Z2740400903 [0,1,0,0,1,0|1,0,0]=3 496 B11R1.35 NC(CC1CCSC1)C(=O)O Z3465027322 [0,1,0,0,1,0|1,0,0]=3 497 B11R1.35 O=C(O)C(O)CN1CCCC1 Z2310728139 [0,1,0,0,1,0|1,0,0]=3 498 B11R1.75 CC1CCC(O1)CCC(=O)O Z1262470998 [0,1,0,0,1,0|1,0,0]=3 499 B11R1.75 CN1CCC(C1)CCC(=O)O Z5380297895 [0,1,0,0,1,0|1,0,0]=3 500 B11R1.75 NC1CCC(C1)CCC(=O)O Z4390881825 [0,1,0,0,1,0|0,0,0]=2 501 B11R1.75 O=C(O)CCC1CCC(=O)N1 Z1198163513 [0,1,0,0,1,0|1,0,1]=4 502 B11R1.75 O=C(O)CCN1CCC(C1)F Z2733346657 [0,1,0,0,1,0|1,0,0]=3 503 B11R1.77 CN(CC(=O)N)C1CCCC1 Z169488320 [0,1,0,0,1,0|2,0,0]=4 504 B11R1.77 NC(CC(=O)O)C1CCCC1 Z975823288 [0,1,0,0,1,0|0,0,0]=2 505 B11R1.90 CN1CCCC1CCC(=O)O Z2517419474 [0,1,0,0,1,0|1,0,0]=3 506 B11R1.90 O=C(O)CCN1CCCC1=O Z240085326 [0,1,0,0,1,0|1,0,1]=4 507 B11R1.90 O=C(O)CN[C@@H]1COC[C@H]1O Z3399260782 [0,1,0,0,1,0|2,0,0]=4 508 B11R1.90 O=C([O-])CCC1CCCC1=O Z4356981513 [0,1,0,0,1,0|0,0,2]=4 509 B11R1.713 CC(=O)NCC1(CCCC1)O Z1203329531 [0,1,0,0,1,0|2,0,0]=4 510 B11R1.713 NC1(CCCC1)CCC(=O)O Z3085811385 [0,1,0,0,1,0|0,0,0]=2 511 B11R1.713 NC1(CCOC1)CCC(=O)O Z2941795757 [0,1,0,0,1,0|1,0,0]=3 512 B13R1.45 CN(CCC(=O)O)C1CCCCC1 Z1465342168 [0,1,0,0,0,1|0,0,0]=2 513 B13R1.45 CN(CCC(=O)O)C1CCNCC1 Z1824511419 [0,1,0,0,0,1|1,0,0]=3 514 B13R1.45 O=C(O)CCC(=O)N1CCOCC1 Z56899019 [0,1,0,0,0,1|2,0,0]=4 515 B13R1.45 O=C(O)CNC(=O)C1CCCCC1 Z56887666 [0,1,0,0,0,1|0,0,1]=3 516 B13R1.45 O=C(O)CNC(=O)C1CCOCC1 Z351723150 [0,1,0,0,0,1|1,0,1]=4 517 B13R1.149 O=C(O)CCCC1CCCC(=O)N1 Z1262517530 [0,1,0,0,0,1|1,0,1]=4 518 B13R1.348 CN(CC(=O)N)CC1CCCCC1 Z295855514 [0,1,0,0,0,1|1,0,0]=3 519 B13R1.351 CC(OCC1CCCCO1)C(=O)O Z316259278 [0,1,0,0,0,1|1,0,0]=3 520 B13R1.513 CC(=O)NCCC1CCN(CC1)C Z985565284 [0,1,0,0,0,1|2,0,0]=4 521 B13R1.513 CN1CCC(CC1)OCCC(=O)O Z4270856754 [0,1,0,0,0,1|1,0,0]=3 522 B13R1.513 NC1CCN(CC1)CCCC(=O)O Z1683068026 [0,1,0,0,0,1|1,0,0]=3 523 B13R1.718 C=C(C=O)CCOC1CCCCO1 Z4934180074 [0,1,0,0,0,1|2,0,0]=4 524 B13R1.718 C=CC(=O)NCCC1CCCCO1 Z1938433118 [0,1,0,0,0,1|2,0,0]=4 525 B13R1.718 CCC(=O)NCCN1CCCCC1 Z422647640 [0,1,0,0,0,1|2,0,0]=4 526 B13R1.718 CNC(=O)CCOC1CCNCC1 Z1346385349 [0,1,0,0,0,1|2,0,0]=4 527 B13R1.718 COC(=O)CCCN1CCNCC1 Z415713990 [0,1,0,0,0,1|2,0,0]=4 528 B13R1.718 COC(=O)COCC1CCNCC1 Z3571158699 [0,1,0,0,0,1|1,0,0]=3 529 B13R1.718 COC(=O)N/N=C/C1CCCCC1 Z49622335 [0,1,0,0,0,1|1,0,1]=4 530 B13R1.718 O=C(CCl)NCCC1CCCCC1 Z561406170 [0,1,0,0,0,1|1,0,0]=3 531 B13R1.3523 NS(=O)(=O)CCOC1CCCCC1 Z1206904517 [0,1,0,0,0,1|1,0,1]=4 532 B13R1.1711 CNC(=O)CCN1CCCSCC1 Z1535581716 [0,1,0,0,0,1|2,0,0]=4 533 B13R1.1711 COC(=O)CCC1CCCCNC1 Z5174570295 [0,1,0,0,0,1|0,0,0]=2 534 B13R1.1711 NNC(=O)CCN1CCCCCC1 Z56974905 [0,1,0,0,0,1|2,0,0]=4 535 B13R1.6192 CC(OC1CCCCCC1)C(=O)O Z756083816 [0,1,0,0,0,1|1,0,0]=3 536 B13R1.6192 N[C@@H](CC1CCCCCC1)C(=O)O Z1762997304 [0,1,0,0,0,1|0,0,0]=2 537 B13R1.7456 NC(CC(=O)O)C1CCCCCC1 Z3013901756 [0,1,0,0,0,1|0,0,0]=2 538 B13R1.3 CCN1CCN(CC1)CCC(=O)O Z802671570 [0,2,0,0,0,0|2,0,0]=4 539 B13R1.14 C=CC(=O)NCC1CCC(CC1)F Z3037459128 [0,2,0,0,0,0|2,0,0]=4 540 B13R1.14 CC1CCN(CC1)CCC(=O)NN Z55993054 [0,2,0,0,0,0|2,0,0]=4 541 B13R1.14 CNC(=O)CCN1CCC(CC1)O Z368788016 [0,2,0,0,0,0|2,0,0]=4 542 B13R1.14 COC(=O)C#CC1CCC(CC1)N Z4126973355 [0,2,0,0,0,0|0,0,2]=4 543 B13R1.14 COC(=O)CCN1CCC(=O)CC1 Z89287101 [0,2,0,0,0,0|1,0,1]=4 544 B13R1.14 COC(=O)CCN1CCC(CC1)N Z2526408724 [0,2,0,0,0,0|1,0,0]=3 545 B13R1.14 COC(=O)CCN1CCC(CC1)O Z53113471 [0,2,0,0,0,0|1,0,0]=3 546 B13R1.14 COC(=O)CCN1CCN(CC1)C Z53116021 [0,2,0,0,0,0|2,0,0]=4 547 B13R1.132 CC(CC(=O)O)C1CCC(CC1)N Z4390859692 [0,2,0,0,0,0|0,0,0]=2 548 B13R1.133 CN1CCC(CC1)CC(N)C(=O)O Z1813167484 [0,2,0,0,0,0|1,0,0]=3 549 B13R1.11 COC(=O)CC(C)N1CCNCC1 Z431536022 [0,2,0,0,0,0|2,0,0]=4 550 B13R1.11 COC(=O)CC(N)C1CCCCC1 Z1267773681 [0,2,0,0,0,0|0,0,0]=2 551 B13R1.15 C=CC(=O)NCC1CCCC(C1)F Z3172881837 [0,2,0,0,0,0|2,0,0]=4 552 B13R1.15 COC(=O)CCN1CCCC(C1)N Z4496034551 [0,2,0,0,0,0|1,0,0]=3 553 B13R1.42 CCOC(=O)CCC1CCNCC1 Z1483956935 [0,2,0,0,0,0|1,0,0]=3 554 B13R1.42 CCOC(=O)CCN1CCCCC1 Z53115951 [0,2,0,0,0,0|1,0,0]=3 555 B13R1.42 CCOC(=O)CNC1CCCCC1 Z2242131332 [0,2,0,0,0,0|1,0,0]=3 556 B13R1.42 COCC(=O)NCC1CCCCC1 Z32004634 [0,2,0,0,0,0|1,0,0]=3 557 B13R1.135 CC(CN1CCCCC1)C(=O)NN Z56974903 [0,2,0,0,0,0|2,0,0]=4 558 B13R1.135 CN(CC1CCCCC1)C(=O)CCl Z561154538 [0,2,0,0,0,0|2,0,0]=4 559 B13R1.135 CNC(=O)C(N)CC1CCCCC1 Z5507315760 [0,2,0,0,0,0|1,0,0]=3 560 B13R1.135 COC(=O)C(N)CC1CC=CCC1 Z3088187064 [0,2,0,0,0,0|0,0,2]=4 561 B13R1.135 COC(=O)C(N)CC1CCOCC1 Z2768769302 [0,2,0,0,0,0|1,0,0]=3 562 B13R1.135 COC(=O)C(N)CN1CCCCC1 Z2028214408 [0,2,0,0,0,0|1,0,0]=3 563 B13R1.135 COC(=O)C(N)CN1CCOCC1 Z1998636327 [0,2,0,0,0,0|2,0,0]=4 564 B13R1.528 C=CC(=O)NC[C@@H]1CCCC[C@H]1O Z3766092776 [0,2,0,0,0,0|2,0,0]=4 565 B13R1.528 C=CC(=O)NC[C@H]1CCCC[C@@H]1O Z3766086176 [0,2,0,0,0,0|2,0,0]=4 566 B13R1.2045 COC(=O)CCC1(CCCCC1)N Z2900981688 [0,2,0,0,0,0|0,0,0]=2 567 B13R1.2045 O=C(CO)NCC1(CCOCC1)O Z1728989098 [0,2,0,0,0,0|2,0,0]=4 568 B13R1.148 CC1CCCC(C1)OC(C)C(=O)O Z362795716 [0,2,0,0,0,0|1,0,0]=3 569 B13R1.418 CCC(CC1CCCCC1)C(=O)O Z756391340 [0,2,0,0,0,0|0,0,0]=2 570 B13R1.418 CCC(OC1CCCCC1)C(=O)O Z449367048 [0,2,0,0,0,0|1,0,0]=3 571 B13R1.1073 CC(C)(CC1CCCNC1)C(=O)N Z2234185640 [0,2,0,0,0,0|2,0,0]=4 572 B13R1.1073 CC(C)(CC1CCOCC1)C(=O)O Z995179826 [0,2,0,0,0,0|1,0,0]=3 573 B13R1.1073 CC(C)(CN1CCOCC1)C(=O)O Z2682012572 [0,2,0,0,0,0|2,0,0]=4 574 B13R1.1073 CC(C)(NC1CCCCC1)C(=O)O Z2470414961 [0,2,0,0,0,0|1,0,0]=3 575 B13R1.1073 CC(N)(CC1=CCCCC1)C(=O)O Z3712794591 [0,2,0,0,0,0|0,0,2]=4 576 B13R1.147 CC(CC(=O)O)N1CCCC(C1)N Z4453949258 [0,2,0,0,0,0|1,0,0]=3 577 B13R1.201 CC(CC(=O)O)N1CCCCC1=O Z398990438 [0,2,0,0,0,0|1,0,1]=4 578 B13R1.201 CC1CCCCC1N(C)CC(=O)N Z324764976 [0,2,0,0,0,0|2,0,0]=4 579 B13R1.347 O=C(O)CS(=O)(=O)N1CCCCC1 Z351064570 [0,2,0,0,0,0|2,0,0]=4 580 B13R1.713 CCC(OC(=O)N)C1CCCCC1 Z1198155507 [0,2,0,0,0,0|2,0,0]=4 581 B13R1.713 CCN(CC(=O)N)C1CCCCC1 Z138297868 [0,2,0,0,0,0|2,0,0]=4 582 B13R1.713 NCC(CC(=O)O)C1CCCCC1 Z2696739934 [0,2,0,0,0,0|0,0,0]=2 583 B13R1.90 CCC1CCCCC1OCC(=O)O Z316259164 [0,2,0,0,0,0|1,0,0]=3 584 B13R1.3575 NC(=O)NCC1CCCCC1(F)F Z2238007563 [0,2,0,0,0,0|2,0,0]=4 585 B13R1.3787 CC1CCCC(N1CCC(=O)O)C Z1465342223 [0,2,0,0,0,0|1,0,0]=3 586 B13R1.3420 CC1CC(CN(C1)CCC(=O)O)N Z4390869670 [0,2,0,0,0,0|1,0,0]=3 587 B11R1.27 CCCCCC1CCC(=O)O1 Z1255430984 [0,0,1,1,0,0|0,0,0]=2 588 B11R1.53 CCC1CCCCC1C(=O)O Z1162465707 [0,0,1,1,0,0|0,0,0]=2 589 B11R1.53 CCC1CCCCN1C(=O)N Z235248554 [0,0,1,1,0,0|2,0,0]=4 590 B11R1.53 CCC1OCCCC1C(=O)O Z1318264671 [0,0,1,1,0,0|1,0,0]=3 591 B11R1.53 CCN1CCCCC1C(=O)O Z803129924 [0,0,1,1,0,0|1,0,0]=3 592 B11R1.53 CCN1CCOCC1C(=O)O Z1582264059 [0,0,1,1,0,0|2,0,0]=4 593 B11R1.53 COC1CCCCC1C(=O)O Z1080715176 [0,0,1,1,0,0|1,0,0]=3 594 B11R1.53 COC1CCNCC1C(=O)O Z4105034441 [0,0,1,1,0,0|2,0,0]=4 595 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Z2915026000 [0,0,1,1,0,0|1,0,0]=3 596 B11R1.57 CCN1CCCC1CC(=O)O Z1695906928 [0,0,1,1,0,0|1,0,0]=3 597 B11R1.57 O=C(O)CN1CCCC1CO Z817025854 [0,0,1,1,0,0|2,0,0]=4 598 B11R1.101 O=C1CCCCCCCCN1 Z1255465322 [0,0,1,1,0,0|1,0,0]=3 599 B11R1.143 NC(=O)C1CCCCCC1N Z1407673034 [0,0,1,1,0,0|2,0,0]=4 600 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Z2306862306 [0,0,1,1,0,0|1,0,0]=3 601 B11R1.172 CC(=O)NCCC1CCCC1 Z318202282 [0,0,1,1,0,0|2,0,0]=4 602 B11R1.172 O=C(O)CCCC1CCCC1 Z1209411148 [0,0,1,1,0,0|0,0,0]=2 603 B11R1.172 O=C(O)CCCN1CCCC1 Z763029994 [0,0,1,1,0,0|1,0,0]=3 604 B11R1.172 O=C(O)CCNC1CCCC1 Z910841990 [0,0,1,1,0,0|1,0,0]=3 605 B11R1.172 O=C(O)CCSC1CCCC1 Z102926388 [0,0,1,1,0,0|1,0,0]=3 606 B11R1.172 O=C(O)CNCC1CCCO1 Z4840900390 [0,0,1,1,0,0|2,0,0]=4 607 B11R1.172 O=C(O)COCC1CCCC1 Z1255418412 [0,0,1,1,0,0|1,0,0]=3 608 B11R1.172 O=C(O)COCC1CCCO1 Z316259308 [0,0,1,1,0,0|2,0,0]=4 609 B11R1.172 O=C(O)COCC1CCOC1 Z825745840 [0,0,1,1,0,0|2,0,0]=4 610 B11R1.172 O=C(O)CSCC1CCCO1 Z239951478 [0,0,1,1,0,0|2,0,0]=4 611 B11R1.193 CCCC1CCCC1C(=O)O Z1434224393 [0,0,1,1,0,0|0,0,0]=2 612 B11R1.193 CCCC1CCNC1C(=O)O Z2217033073 [0,0,1,1,0,0|1,0,0]=3 613 B11R1.193 CCCN1CCCC1C(=O)O Z326520902 [0,0,1,1,0,0|1,0,0]=3 614 B11R1.706 O=C(O)C1CCCCCCC1 Z792377154 [0,0,1,1,0,0|0,0,0]=2 615 B11R1.706 O=C(O)C1CCCCCCN1 Z1998612770 [0,0,1,1,0,0|1,0,0]=3 616 B11R1.742 CC(=O)CN1CCCCCC1 Z56041634 [0,0,1,1,0,0|2,0,0]=4 617 B11R1.742 CC(=O)NC1CCCCCC1 Z32452010 [0,0,1,1,0,0|2,0,0]=4 618 B11R1.742 NC(=O)CC1CCCCCC1 Z1262638694 [0,0,1,1,0,0|1,0,0]=3 619 B11R1.742 NC(=O)CC1CCCNCC1 Z1746998025 [0,0,1,1,0,0|2,0,0]=4 620 B11R1.742 O=C(O)CC1CCCCCC1 Z352783664 [0,0,1,1,0,0|0,0,0]=2 621 B11R1.742 O=C(O)CC1CCCNCC1 Z2830496103 [0,0,1,1,0,0|1,0,0]=3 622 B11R1.742 O=C(O)CN1CCCCCC1 Z1171978829 [0,0,1,1,0,0|1,0,0]=3 623 B11R1.742 O=C(O)CN1CCCNCC1 Z1259161963 [0,0,1,1,0,0|2,0,0]=4 624 B11R1.266 CCC1CC(CCO1)C(=O)O Z1192344099 [0,0,1,1,0,0|1,0,0]=3 625 B11R1.266 CCC1CCCC(N1)C(=O)O Z1612958646 [0,0,1,1,0,0|1,0,0]=3 626 B11R1.266 CCN1CCCC(C1)C(=O)O Z763029984 [0,0,1,1,0,0|1,0,0]=3 627 B11R1.266 CCN1CCOC(C1)C(=O)O Z1459939099 [0,0,1,1,0,0|2,0,0]=4 628 B11R1.266 CC[C@@H]1COC[C@@H](N1)C(=O)O Z4767064022 [0,0,1,1,0,0|2,0,0]=4 629 B11R1.266 COC1CCCC(C1)C(=O)O Z1192182025 [0,0,1,1,0,0|1,0,0]=3 630 B11R1.266 COC1CCNC(C1)C(=O)O Z2768171860 [0,0,1,1,0,0|2,0,0]=4 631 B11R1.266 COC1CNCC(C1)C(=O)O Z5209028633 [0,0,1,1,0,0|2,0,0]=4 632 B11R1.266 N#CC1CCCC(C1)C(=O)O Z1515406065 [0,0,1,1,0,0|1,0,1]=4 633 B11R1.266 N#C[C@H]1CCC[C@H](C1)C(=O)O Z4790589241 [0,0,1,1,0,0|1,0,1]=4 634 B11R1.266 NCC1CC(CCO1)C(=O)O Z5712882945 [0,0,1,1,0,0|2,0,0]=4 635 B11R1.400 N#CC1(CCC1)CCC(=O)O Z1721260678 [0,0,1,1,0,0|1,0,1]=4 636 B11R1.167 CC1CC(C(CN1)C)C(=O)O Z3214138136 [0,0,1,1,0,0|1,0,0]=3 637 B11R1.167 CC1CCC(C(N1)C(=O)O)C Z4075226032 [0,0,1,1,0,0|1,0,0]=3 638 B11R1.495 CC1CCC(N1CC(=O)O)C Z608708802 [0,0,1,1,0,0|1,0,0]=3 639 B11R2.1 O=C1CCC2N1CCNC2 Z4884991057 [1,0,0,1,0,0|2,0,0]=4 640 B11R2.1 O=C1NC[C@@H]2[C@H]1CCCN2 Z1968124423 [1,0,0,1,0,0|2,0,0]=4 641 B11R2.1 O=C1NC[C@H]2[C@@H]1CCCC2 Z2307208665 [1,0,0,1,0,0|1,0,0]=3 642 B11R2.1 O=C1NC[C@H]2[C@@H]1CCCN2 Z3379440575 [1,0,0,1,0,0|2,0,0]=4 643 B11R2.1 O=C1OCC2C1CCNC2 Z4438428292 [1,0,0,1,0,0|2,0,0]=4 644 B11R2.4 NC1CC1C2CCCCC2 Z1259273403 [1,0,0,1,0,0|1,0,1]=4 645 B11R2.12 O=C1NCC12CCCOC2 Z2865012678 [1,0,0,1,0,0|2,0,0]=4 646 B11R2.13 NCC1CC12CCCCC2 Z3247610236 [1,0,0,1,0,0|1,0,1]=4 647 B11R2.13 O=CC1CC12CCCCC2 Z1511870834 [1,0,0,1,0,0|0,0,0]=2 648 B11R2.13 O=CC1CC12CCCOC2 Z3243445308 [1,0,0,1,0,0|1,0,0]=3 649 B11R2.13 O=CC1CC12CCOCC2 Z1999520977 [1,0,0,1,0,0|1,0,0]=3 650 B11R2.13 OCC1CC12CCOCC2 Z1395679784 [1,0,0,1,0,0|1,0,1]=4 651 B11R2.20 C1CCC2CCCCC2C1 Z104474658 [1,0,0,1,0,0|1,0,1]=4 652 B11R2.20 C1CCC2CNCCC2C1 Z3492354682 [1,0,0,1,0,0|2,0,0]=4 653 B11R2.20 C1CCC2OCCNC2C1 Z397586840 [1,0,0,1,0,0|1,0,1]=4 654 B11R2.20 C1CC[C@H]2NCCC[C@H]2C1 Z1203731004 [1,0,0,1,0,0|1,0,1]=4 655 B11R2.20 C1COC2CCNCC2C1 Z1203749248 [1,0,0,1,0,0|1,0,1]=4 656 B11R2.164 NCC1CC2CCC1CC2 Z2380439346 [1,0,0,1,0,0|1,0,1]=4 657 B11R2.164 O=CC1CC2CCC1CC2 Z1511766105 [1,0,0,1,0,0|0,0,0]=2 658 B11R2.164 O=C[C@@H]1C[C@@H]2C=C[C@H]1CC2 Z3215698628 [1,0,0,1,0,0|0,0,2]=4 659 B11R2.164 OCC1CN2CCC1CC2 Z274799154 [1,0,0,1,0,0|1,0,1]=4 660 B11R2.238 C1CCC(OC1)CC2CO2 Z3271405517 [1,0,0,1,0,0|1,0,1]=4 661 B11R2.239 C1CCC(CC1)C2CNC2 Z2216711539 [1,0,0,1,0,0|2,0,0]=4 662 B11R2.357 O=C1CCC2CCCN1C2 Z1509062698 [1,0,0,1,0,0|1,0,0]=3 663 B11R2.357 O=C1CCC2CCNC1C2 Z3013817851 [1,0,0,1,0,0|1,0,0]=3 664 B11R2.357 O=C1NCC2CCCC1N2 Z3487940635 [1,0,0,1,0,0|2,0,0]=4 665 B11R2.357 OC1CCC2CCNC1C2 Z2238768422 [1,0,0,1,0,0|1,0,1]=4 666 B11R2.357 O[C@@H]1CC[C@H]2CCN[C@H]1C2 Z3063687175 [1,0,0,1,0,0|1,0,1]=4 667 B11R2.1037 C1CC2CCNCC(C1)C2 Z3379439950 [1,0,0,1,0,0|2,0,0]=4 668 B11R2.1261 C1CCC2(CC1)CCCN2 Z1526503348 [1,0,0,1,0,0|1,0,1]=4 669 B11R2.1261 C1CCC2(CC1)CCNC2 Z979421238 [1,0,0,1,0,0|2,0,0]=4 670 B11R2.1261 C1COC2(C1)CCNCC2 Z1741975010 [1,0,0,1,0,0|1,0,1]=4 671 B11R2.10 O=C1C[C@@H]2CCNC[C@@H]2N1 Z2941409830 [0,0,0,1,1,0|2,0,0]=4 672 B11R2.10 O=C1C[C@@H]2NCCC[C@@H]2N1 Z2568671488 [0,0,0,1,1,0|2,0,0]=4 673 B11R2.10 O=C1N[C@@H]2CCNC[C@@H]2O1 Z3486109396 [0,0,0,1,1,0|2,0,0]=4 674 B11R2.10 O=C1N[C@H]2CCCC[C@H]2N1 Z3227128710 [0,0,0,1,1,0|2,0,0]=4 675 B11R2.10 O=C1OC2CCCCC2O1 Z1201621064 [0,0,0,1,1,0|1,0,0]=3 676 B11R2.678 O=C1CC2CCCC(C1)C2 Z1255416520 [0,0,0,1,1,0|1,0,0]=3 677 B11R2.678 O=C1CC2CCCC(C1)N2 Z1262564614 [0,0,0,1,1,0|2,0,0]=4 678 B11R2.703 O=C1CC2(N1)CCCCC2 Z1238837545 [0,0,0,1,1,0|1,0,0]=3 679 B11R2.703 O=C1CC2(N1)CCNCC2 Z2143572749 [0,0,0,1,1,0|2,0,0]=4 680 B11R2.703 O=C1CC2(N1)CCOCC2 Z1238837683 [0,0,0,1,1,0|2,0,0]=4 681 B11R2.932 O=C(O)CC1CCC2C1C2 Z1509040790 [0,0,0,1,1,0|0,0,0]=2 682 B11R2.934 O=C(O)CN1CC2CC2C1 Z3377864519 [0,0,0,1,1,0|1,0,0]=3 683 B11R2.1824 O=C(O)[C@H]1[C@H]2CNC[C@@H]1C2 Z5354305391 [0,0,0,1,1,0|1,0,0]=3 684 B11R2.1852 O=C(O)[C@@H]1[C@@H]2[C@H]1OCCC2 Z3002935457 [0,0,0,1,1,0|1,0,0]=3 685 B11R2.1852 O=C(O)[C@H]1[C@@H]2[C@H]1CCNC2 Z4605254163 [0,0,0,1,1,0|1,0,0]=3 686 B11R2.36 O=C1CCC2CNCC2N1 Z1509106290 [0,0,0,1,1,0|2,0,0]=4 687 B11R2.141 O=C(O)C1CC12CCCC2 Z979743296 [0,0,0,1,1,0|0,0,0]=2 688 B11R2.141 O=C(O)C1CC12CCNC2 Z2311216937 [0,0,0,1,1,0|1,0,0]=3 689 B11R2.141 O=C(O)C1CC12CCOC2 Z1124555735 [0,0,0,1,1,0|1,0,0]=3 690 B11R2.359 O=C1CC2CCC(C2)CN1 Z1203749577 [0,0,0,1,1,0|2,0,0]=4 691 B11R2.748 O=C1CC2(CCCC2)CN1 Z1198235316 [0,0,0,1,1,0|2,0,0]=4 692 B11R2.748 O=C1CCC2(N1)CCCC2 Z1258978219 [0,0,0,1,1,0|1,0,0]=3 693 B11R2.748 O=C1CCC2(N1)CCNC2 Z3216186792 [0,0,0,1,1,0|2,0,0]=4 694 B11R2.748 O=C1CNC2(C1)CCCC2 Z2732532265 [0,0,0,1,1,0|2,0,0]=4 695 B11R2.748 O=C1NC2(CCCC2)CO1 Z1266873523 [0,0,0,1,1,0|2,0,0]=4 696 B11R2.748 O=C1NCC2(O1)CCNC2 Z3244909126 [0,0,0,1,1,0|2,0,0]=4 697 B11R2.814 O=C(O)C1CC2C1CCC2 Z1509040895 [0,0,0,1,1,0|0,0,0]=2 698 B11R2.845 CC(=O)C1CC2CCC1C2 Z1386913059 [0,0,0,1,1,0|1,0,0]=3 699 B11R2.845 CC(=O)C1CC2CCC1O2 Z1201052692 [0,0,0,1,1,0|2,0,0]=4 700 B11R2.845 O=C(O)C1CC2C=CC1C2 Z104495016 [0,0,0,1,1,0|0,0,2]=4 701 B11R2.845 O=C(O)C1CC2CCC1C2 Z147433488 [0,0,0,1,1,0|0,0,0]=2 702 B11R2.845 O=C(O)C1CC2CCC1N2 Z2899600133 [0,0,0,1,1,0|1,0,0]=3 703 B11R2.845 O=C(O)C1CN2CCC1C2 Z1262558196 [0,0,0,1,1,0|1,0,0]=3 704 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1O2 Z3301415369 [0,0,0,1,1,0|1,0,0]=3 705 B11R2.845 O=C(O)[C@@H]1C[C@H]2C=C[C@@H]1C2 Z2507795603 [0,0,0,1,1,0|0,0,2]=4 706 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1O2 Z1197865945 [0,0,0,1,1,0|1,0,0]=3 707 B13R2.10 O=C1CC(CN1)C2CCCCC2 Z1270255885 [0,0,0,1,0,1|1,0,0]=3 708 B13R2.10 O=C1CC(CN1)C2CCCNC2 Z1695709192 [0,0,0,1,0,1|2,0,0]=4 709 B13R2.10 O=C1CC(CN1)C2CCNCC2 Z1695709190 [0,0,0,1,0,1|2,0,0]=4 710 B13R2.10 O=C1NC(CO1)C2CCNCC2 Z2886104040 [0,0,0,1,0,1|2,0,0]=4 711 B13R2.10 OC1CNC(C1)C2CCCCC2 Z1267881753 [0,0,0,1,0,1|1,0,1]=4 712 B13R2.72 N=C(N)N1CC[C@H]2[C@@H]1CCCC2 Z2412125623 [0,0,0,1,0,1|2,0,0]=4 713 B13R2.72 O=C(O)C1CCC2N1CCCC2 Z2668441328 [0,0,0,1,0,1|1,0,0]=3 714 B13R2.72 O=C(O)[C@@H]1NC[C@@H]2[C@H]1CCCC2 Z3219251975 [0,0,0,1,0,1|0,0,0]=2 715 B13R2.72 O=C(O)[C@@H]1OC[C@H]2[C@@H]1CCOC2 Z2937461137 [0,0,0,1,0,1|1,0,0]=3 716 B13R2.163 O=C1CCCC2CCCCC2N1 Z1509158921 [0,0,0,1,0,1|1,0,0]=3 717 B13R2.163 O=C1CCC[C@@H]2NCCC[C@H]2N1 Z4656794143 [0,0,0,1,0,1|2,0,0]=4 718 B13R2.423 O=C(O)C1CC1C2CCCCC2 Z975822978 [0,0,0,1,0,1|0,0,0]=2 719 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2CCNCC2 Z3064051067 [0,0,0,1,0,1|1,0,0]=3 720 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2CCOCC2 Z2737465051 [0,0,0,1,0,1|1,0,0]=3 721 B13R2.437 O=C(O)C1CCC12CCOCC2 Z2572597008 [0,0,0,1,0,1|1,0,0]=3 722 B13R2.1287 O=C(O)CC1CN2CCC1CC2 Z3220041516 [0,0,0,1,0,1|1,0,0]=3 723 B13R2.1287 O=C(O)CN1CC2CCC1CN2 Z4966693447 [0,0,0,1,0,1|1,0,0]=3 724 B13R2.3122 O=S1(=O)CCNC2C1CCCC2 Z1172114119 [0,0,0,1,0,1|1,0,1]=4 725 B13R2.11128 O=C1CCOC2(C1)CCNCC2 Z3023573101 [0,0,0,1,0,1|2,0,0]=4 726 B13R2.11128 O=C1CNCC2(N1)CCOCC2 Z3908680977 [0,0,0,1,0,1|2,0,0]=4 727 B13R2.5509 O=C(O)C1CC2CCC1CNC2 Z3771620164 [0,0,0,1,0,1|0,0,0]=2 728 B13R2.5509 O=C(O)C1CC2CCCC1CC2 Z1262522809 [0,0,0,1,0,1|0,0,0]=2 729 B13R2.5509 O=C(O)C1CN2CCCC1CC2 Z5211069993 [0,0,0,1,0,1|1,0,0]=3 730 B13R2.5509 O=C(O)C1CN2CCCN1CC2 Z1528678311 [0,0,0,1,0,1|1,0,0]=3 731 B13R2.13132 O=C1CC2(CCCCCC2)CN1 Z1198235317 [0,0,0,1,0,1|2,0,0]=4 732 B13R2.13132 O=C1CC2(CCCNCC2)CN1 Z3327942380 [0,0,0,1,0,1|2,0,0]=4 733 B13R2.13132 O=C1NCC2(N1)CCCNCC2 Z3396486013 [0,0,0,1,0,1|2,0,0]=4 734 B13R2.13132 O=C1NCC2(O1)CCCNCC2 Z5065206115 [0,0,0,1,0,1|1,0,0]=3 735 B13R2.13972 O=C(O)[C@@H]1C[C@H]2[C@@H]1CCCCC2 Z3486445533 [0,0,0,1,0,1|0,0,0]=2 736 B13R2.5120 CC1CCC2(CC1)CNC(=O)C2 Z1201628057 [0,1,0,1,0,0|2,0,0]=4 737 B13R2.5120 CC1CCC2(CC1)COC(=O)N2 Z1266873436 [0,1,0,1,0,0|2,0,0]=4 738 B13R2.5120 NC1CCC2(CC1)CNC(=O)C2 Z3915177701 [0,1,0,1,0,0|2,0,0]=4 739 B13R2.5120 O=C1CCC2(CC1)CCC(=O)N2 Z1255497803 [0,1,0,1,0,0|1,0,1]=4 740 B13R2.13858 O=C(O)CCC12CCC(C1)CC2 Z3480644025 [0,1,0,1,0,0|0,0,0]=2 741 B13R2.13954 CC12CCN(CC1)CC2C(=O)O Z5229067137 [0,1,0,1,0,0|1,0,0]=3 742 B13R2.57 O=CC1CCC2CCCCC2C1 Z1511766749 [0,1,0,1,0,0|1,0,1]=4 743 B13R2.528 COC(=O)C1CC12CCNCC2 Z1267881729 [0,1,0,1,0,0|1,0,0]=3 744 B13R2.528 COC(=O)C1OC12CCCCC2 Z1198157145 [0,1,0,1,0,0|1,0,0]=3 745 B13R2.528 COC(=O)C1OC12CCCOC2 Z1268605957 [0,1,0,1,0,0|2,0,0]=4 746 B13R2.528 COC(=O)C1OC12CCOCC2 Z1268605936 [0,1,0,1,0,0|2,0,0]=4 747 B13R2.528 O=C(CCl)C1CC12CCCCC2 Z3409615974 [0,1,0,1,0,0|1,0,0]=3 748 B13R2.528 O=C(CCl)C1CC12CCOCC2 Z2471289598 [0,1,0,1,0,0|2,0,0]=4 749 B13R2.5037 O=C1C=CC2(CCCCC2)CC1 Z1255468299 [0,1,0,1,0,0|1,0,0]=3 750 B13R2.5037 O=C1C=CC2(CCOCC2)CC1 Z1354551740 [0,1,0,1,0,0|2,0,0]=4 751 B13R2.5037 O=C1CCC2(CCCCC2)CC1 Z1255383084 [0,1,0,1,0,0|1,0,0]=3 752 B13R2.5037 O=C1CCC2(CCNCC2)CC1 Z1954803451 [0,1,0,1,0,0|2,0,0]=4 753 B13R2.5037 O=C1CCC2(CCOCC2)CC1 Z1255397922 [0,1,0,1,0,0|2,0,0]=4 754 B13R2.6482 NCC1CCC2(O1)CCCCC2 Z1837073488 [0,1,0,1,0,0|1,0,1]=4 755 B13R2.13154 O=C1NCC2(C1=O)CCCCC2 Z3399886024 [0,1,0,1,0,0|1,0,1]=4 756 B13R2.13154 O=C1NCC2(C1O)CCNCC2 Z3307577013 [0,1,0,1,0,0|2,0,0]=4 757 B13R2.13154 O=C1NCC2(C1O)CCOCC2 Z2240998909 [0,1,0,1,0,0|2,0,0]=4 758 B13R2.433 O=C(O)C1CC2CCCC(C2)C1 Z414834580 [0,1,0,1,0,0|0,0,0]=2 759 B13R2.433 O=C(O)C1CC2CCCN(C2)C1 Z5228629247 [0,1,0,1,0,0|1,0,0]=3 760 B13R2.433 O=C(O)[C@@H]1C[C@@H]2CSC[C@@H](C2)C1 Z4521801945 [0,1,0,1,0,0|1,0,0]=3 761 B13R2.433 O=C(O)[C@H]1C[C@H]2C=CC[C@H](C2)C1 Z4478802065 [0,1,0,1,0,0|0,0,2]=4 762 B13R2.433 O=C(O)[C@H]1C[C@H]2CNC[C@H](C2)C1 Z4765703666 [0,1,0,1,0,0|1,0,0]=3 763 B13R2.433 O=C(O)[C@H]1C[C@H]2COC[C@H](C2)C1 Z4512542729 [0,1,0,1,0,0|1,0,0]=3 764 B13R2.435 NC(=O)C1CC2CCCCC2N1 Z317075546 [0,1,0,1,0,0|1,0,0]=3 765 B13R2.435 O=C(O)C1CC2CCCCC2N1 Z104507234 [0,1,0,1,0,0|0,0,0]=2 766 B13R2.435 O=C(O)C1CC2CCCCN2C1 Z1318356927 [0,1,0,1,0,0|1,0,0]=3 767 B13R2.435 O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1 Z169856808 [0,1,0,1,0,0|0,0,0]=2 768 B13R2.435 O=C(O)[C@@H]1C[C@@H]2NCCO[C@@H]2C1 Z4602484671 [0,1,0,1,0,0|2,0,0]=4 769 B13R2.440 O=C(O)C1(CC12CCNCC2)Cl Z3876842376 [0,1,0,1,0,0|1,0,0]=3 770 B13R2.440 O=C(O)C1(CC12CCOCC2)Cl Z4465205610 [0,1,0,1,0,0|1,0,0]=3 771 B13R2.12720 CN1CC2(CCCNC2)OC1=O Z3013892871 [0,1,0,1,0,0|2,0,0]=4 772 B13R2.12720 CN1CC2(CCNCC2)OC1=O Z3244871893 [0,1,0,1,0,0|2,0,0]=4 773 B13R2.13740 NC1(CC2CCC1CC2)C(=O)O Z360059682 [0,1,0,1,0,0|0,0,0]=2 774 B13R2.13740 NC1(CN2CCC1CC2)C(=O)O Z1262398492 [0,1,0,1,0,0|1,0,0]=3 775 B13R2.13968 NC(=O)N1CC2(C1)CCCCC2 Z1681183186 [0,1,0,1,0,0|2,0,0]=4 776 B13R2.13968 O=C(O)C1CC2(C1)CCCCC2 Z1258538520 [0,1,0,1,0,0|0,0,0]=2 777 B13R2.13968 O=C(O)C1CC2(C1)CCNCC2 Z3800523226 [0,1,0,1,0,0|1,0,0]=3 778 B13R2.244 N[C@@H]1[C@H]([C@@H]2[C@H]1CCCC2)C(=O)O Z3800861457 [0,1,0,1,0,0|0,0,0]=2 779 B13R2.4014 CC1NC(=O)OC12CCNCC2 Z3352161471 [0,1,0,1,0,0|2,0,0]=4 780 B13R2.4742 NC1CC2CCC1CC2C(=O)O Z4421886310 [0,1,0,1,0,0|0,0,0]=2 781 B13R2.4742 O=C1NC2CCC1CC2C(=O)O Z5398166577 [0,1,0,1,0,0|1,0,1]=4 782 B13R2.11132 CC1CC2(CCO1)CC2C(=O)O Z1192355697 [0,1,0,1,0,0|1,0,0]=3 783 B13R2.8076 NS(=O)(=O)C1CC2CCC1CC2 Z2217316103 [0,1,0,1,0,0|1,0,1]=4 784 B13R2.8076 O=S(=O)(F)C1CC2CCC1CC2 Z1509058801 [0,1,0,1,0,0|1,0,1]=4 785 B9R0.14 CCCC(CC)CC(=O)O Z1198149106 [0,0,1,0,1,0|0,0,0]=2 786 B9R0.4 CC(CC(=O)O)NCCO Z431539096 [0,0,1,0,1,0|2,0,0]=4 787 B9R1.12 C=CCNC1CCCC1 Z607822410 [1,0,0,0,1,0|2,0,0]=4 788 B9R1.12 NCCCC1CCCC1 Z744843730 [1,0,0,0,1,0|1,0,1]=4 789 B9R1.12 O=CCCC1CCCC1 Z993017672 [1,0,0,0,1,0|0,0,0]=2 790 B9R1.12 O=CCCC1CCCO1 Z993017666 [1,0,0,0,1,0|1,0,0]=3 791 B9R1.12 O=CCCC1CCOC1 Z1198305626 [1,0,0,0,1,0|1,0,0]=3 792 B9R1.12 O=CCCC1OCCO1 Z1198155855 [1,0,0,0,1,0|2,0,0]=4 793 B9R1.12 OCCCC1CCCN1 Z979444798 [1,0,0,0,1,0|1,0,1]=4 794 B9R1.12 OCCCC1CCCO1 Z993012576 [1,0,0,0,1,0|1,0,1]=4 795 B9R1.12 OCCNC1CCCC1 Z1162448840 [1,0,0,0,1,0|1,0,1]=4 796 B9R1.12 OCCOC1CCCC1 Z362785380 [1,0,0,0,1,0|1,0,1]=4 797 B9R1.6 CC(=O)C1CCCCN1 Z1954800414 [0,0,0,0,2,0|2,0,0]=4 798 B9R1.6 CC(=O)C1CCCOC1 Z1259153006 [0,0,0,0,2,0|2,0,0]=4 799 B9R1.6 CC(=O)C1CCNCC1 Z1741977299 [0,0,0,0,2,0|2,0,0]=4 800 B9R1.6 CC(=O)C1CCOCC1 Z1178490124 [0,0,0,0,2,0|2,0,0]=4 801 B9R1.6 CC(=O)[C@@H]1CCCCN1 Z1618016835 [0,0,0,0,2,0|2,0,0]=4 802 B9R1.6 CC(=O)[C@H]1CCCCN1 Z2234185612 [0,0,0,0,2,0|2,0,0]=4 803 B9R1.6 CC(O)C1CCCCC1 Z445987098 [0,0,0,0,2,0|1,0,1]=4 804 B9R1.6 C[C@@H](O)C1CCCCC1 Z959151676 [0,0,0,0,2,0|1,0,1]=4 805 B9R1.6 N=C(N)C1CCCCC1 Z317027412 [0,0,0,0,2,0|2,0,0]=4 806 B9R1.6 NC(=O)C1CCCCC1 Z33546516 [0,0,0,0,2,0|1,0,0]=3 807 B9R1.6 NC(=O)C1CCCCN1 Z90122010 [0,0,0,0,2,0|2,0,0]=4 808 B9R1.6 NC(=O)C1CCCNC1 Z85932258 [0,0,0,0,2,0|2,0,0]=4 809 B9R1.6 NC(=O)C1CCNCC1 Z1450533743 [0,0,0,0,2,0|2,0,0]=4 810 B9R1.6 NC(=O)C1CCOCC1 Z82670321 [0,0,0,0,2,0|2,0,0]=4 811 B9R1.6 NC(=O)N1CCCCC1 Z56917364 [0,0,0,0,2,0|2,0,0]=4 812 B9R1.6 O=C(O)C1C=CCCC1 Z57127330 [0,0,0,0,2,0|0,0,2]=4 813 B9R1.6 O=C(O)C1CC=CCC1 Z57921336 [0,0,0,0,2,0|0,0,2]=4 814 B9R1.6 O=C(O)C1CCCCC1 Z104475698 [0,0,0,0,2,0|0,0,0]=2 815 B9R1.6 O=C(O)C1CCCCN1 Z104479780 [0,0,0,0,2,0|1,0,0]=3 816 B9R1.6 O=C(O)C1CCCCO1 Z963633098 [0,0,0,0,2,0|1,0,0]=3 817 B9R1.6 O=C(O)C1CCCNC1 Z324553206 [0,0,0,0,2,0|1,0,0]=3 818 B9R1.6 O=C(O)C1CCCOC1 Z445214062 [0,0,0,0,2,0|1,0,0]=3 819 B9R1.6 O=C(O)C1CCCSC1 Z1198485079 [0,0,0,0,2,0|1,0,0]=3 820 B9R1.6 O=C(O)C1CCCSS1 Z1262517456 [0,0,0,0,2,0|2,0,0]=4 821 B9R1.6 O=C(O)C1CCNCC1 Z104474390 [0,0,0,0,2,0|1,0,0]=3 822 B9R1.6 O=C(O)C1CCOCC1 Z85923421 [0,0,0,0,2,0|1,0,0]=3 823 B9R1.6 O=C(O)C1CCSCC1 Z826531634 [0,0,0,0,2,0|1,0,0]=3 824 B9R1.6 O=C(O)C1CCSCN1 Z1235963996 [0,0,0,0,2,0|2,0,0]=4 825 B9R1.6 O=C(O)C1CNCCN1 Z1273089259 [0,0,0,0,2,0|2,0,0]=4 826 B9R1.6 O=C(O)C1COCCN1 Z1255387606 [0,0,0,0,2,0|2,0,0]=4 827 B9R1.6 O=C(O)C1COCCO1 Z362763682 [0,0,0,0,2,0|2,0,0]=4 828 B9R1.6 O=C(O)C1CSCCS1 Z147642878 [0,0,0,0,2,0|2,0,0]=4 829 B9R1.6 O=C(O)C1SCCCS1 Z275241266 [0,0,0,0,2,0|2,0,0]=4 830 B9R1.6 O=C(O)[C@@H]1CCCCN1 Z1033300646 [0,0,0,0,2,0|1,0,0]=3 831 B9R1.6 OB(O)C1CCCCC1 Z56789446 [0,0,0,0,2,0|1,0,1]=4 832 B9R1.13 CC(=O)CC1CCCO1 Z513734588 [0,0,0,0,2,0|2,0,0]=4 833 B9R1.13 CC(=O)CC1CCOC1 Z1321971717 [0,0,0,0,2,0|2,0,0]=4 834 B9R1.13 CC(=O)NC1CCCC1 Z32413858 [0,0,0,0,2,0|2,0,0]=4 835 B9R1.13 N=C(N)CC1CCCC1 Z2092177104 [0,0,0,0,2,0|2,0,0]=4 836 B9R1.13 NC(=O)CC1CCCC1 Z33546662 [0,0,0,0,2,0|1,0,0]=3 837 B9R1.13 NC(=O)CC1CCCN1 Z1459435572 [0,0,0,0,2,0|2,0,0]=4 838 B9R1.13 NC(=O)CN1CCCC1 Z1184886892 [0,0,0,0,2,0|2,0,0]=4 839 B9R1.13 NC(=O)NC1CCCC1 Z56896930 [0,0,0,0,2,0|2,0,0]=4 840 B9R1.13 O=C(O)C=C1CCCC1 Z352748244 [0,0,0,0,2,0|0,0,2]=4 841 B9R1.13 O=C(O)CC1C=CCC1 Z104507506 [0,0,0,0,2,0|0,0,2]=4 842 B9R1.13 O=C(O)CC1CCCC1 Z104477042 [0,0,0,0,2,0|0,0,0]=2 843 B9R1.13 O=C(O)CC1CCCN1 Z1480642793 [0,0,0,0,2,0|1,0,0]=3 844 B9R1.13 O=C(O)CC1CCNC1 Z1863617764 [0,0,0,0,2,0|1,0,0]=3 845 B9R1.13 O=C(O)CC1CCOC1 Z825745916 [0,0,0,0,2,0|1,0,0]=3 846 B9R1.13 O=C(O)CC1OCCO1 Z1205496445 [0,0,0,0,2,0|2,0,0]=4 847 B9R1.13 O=C(O)CN1CCCC1 Z197269292 [0,0,0,0,2,0|1,0,0]=3 848 B9R1.13 O=C(O)C[C@@H]1CCCO1 Z1862025858 [0,0,0,0,2,0|1,0,0]=3 849 B9R1.13 O=C(O)C[C@H]1CCOC1 Z1205495408 [0,0,0,0,2,0|1,0,0]=3 850 B9R1.13 OB(O)CC1CCCC1 Z1147227856 [0,0,0,0,2,0|1,0,1]=4 851 B9R1.84 O=C(O)/C=C/C1CCC1 Z1868431084 [0,0,0,0,2,0|0,0,2]=4 852 B9R1.84 O=C(O)C#CC1CCC1 Z1235950879 [0,0,0,0,2,0|0,0,2]=4 853 B9R1.84 O=C(O)CNC1CCC1 Z4897302450 [0,0,0,0,2,0|1,0,0]=3 854 B11R1.203 COCCC1CCCCNC1 Z1682072349 [1,0,0,0,0,1|2,0,0]=4 855 B11R1.203 OCCCN1CCCCCC1 Z3069017316 [1,0,0,0,0,1|1,0,1]=4 856 B11R1.203 OCCCN1CCCNCC1 Z3814522399 [1,0,0,0,0,1|1,0,1]=4 857 B11R1.203 OCCCN1CCCOCC1 Z1354854541 [1,0,0,0,0,1|1,0,1]=4 858 B11R1.203 OCCNC1CCCCCC1 Z1862093141 [1,0,0,0,0,1|1,0,1]=4 859 B13R1.337 NC(=O)CNCCC1CCCCC1 Z234895885 [0,0,0,0,0,2|1,0,0]=3 860 B13R1.337 O=C(O)CCCCN1CCCCC1 Z1270387209 [0,0,0,0,0,2|1,0,0]=3 861 B13R1.337 O=C(O)CCCCN1CCOCC1 Z362634334 [0,0,0,0,0,2|2,0,0]=4 862 B13R1.1988 CC(=O)NCCN1CCCCCC1 Z4913683373 [0,0,0,0,0,2|2,0,0]=4