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CC(C)[C@H]1CC[C@H](CC1)N Z3300621003 [1,0,0,0,0,0|1,0,0]=2 15 B10R1.13 CC(N)C1CCC(CC1)F Z2526705319 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.13 CC(N)C1CCN(CC1)C Z413860142 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.13 CC1CCC(CC1)C(=N)N Z1431905462 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.13 CC1CCC(CN1)C(C)C Z1230088800 [1,0,0,0,0,0|1,0,0]=2 19 B10R1.13 CN(C)[C@H]1CC[C@@H](CC1)N Z3244810239 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.13 CN(C)[C@H]1CC[C@H](CC1)N Z2310699352 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)O Z1205493659 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.13 OC1CCC(CC1)C(F)F Z3015451297 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.25 CCN1CCC(CC1C)N Z825755286 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.25 CC[C@@H]1CC[C@@H](NC1=O)C Z2467219756 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.25 CC[C@@H]1CC[C@H](NC1=O)C Z2472577622 [1,0,0,0,0,0|1,0,2]=4 26 B10R1.25 CNC1CCN(CC1C)C Z825754010 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.61 CC(=O)C1CCCCC1C Z1276728280 [1,0,0,0,0,0|2,0,1]=4 28 B10R1.61 CC(C)C1CCCCC1=O Z993018022 [1,0,0,0,0,0|0,0,2]=3 29 B10R1.61 CC(C)C1CCCCC1O Z992949104 [1,0,0,0,0,0|0,0,0]=1 30 B10R1.61 CC(C)C1CCCNC1=O Z1203747730 [1,0,0,0,0,0|1,0,2]=4 31 B10R1.61 CC(C)C1CNCCN1C Z1250203494 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.61 CN(C)C1CCCCC1=O Z447865324 [1,0,0,0,0,0|1,0,2]=4 33 B10R1.61 CN(C)C1CCCCC1N Z285186990 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.61 O=C(O)C1CCCCC1O Z1080722428 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1O Z3326512742 [1,0,0,0,0,0|2,0,1]=4 36 B12R1.57 CC(C)[C@@H]1CC[C@H](C[C@H]1C=O)C Z1511744535 [0,1,0,0,0,0|0,0,1]=2 37 B12R1.57 CC1CCC(C(C1)CN)C(C)C Z1695784322 [0,1,0,0,0,0|1,0,0]=2 38 B10R0.3 C/C(=C\CO)/CCCC(C)C Z2583205813 [0,0,1,0,0,0|0,0,2]=3 39 B10R0.17 CC(C)N(CCCN)C(C)C Z330914380 [0,0,1,0,0,0|3,0,0]=4 40 B10R0.17 CCCNC(C(=O)O)C(C)C Z445226212 [0,0,1,0,0,0|2,0,1]=4 41 B10R0.17 CNCCN(C(C)C)C(C)C Z139673864 [0,0,1,0,0,0|3,0,0]=4 42 B9R0.1 CC(C)CCCC(C)CN Z5875145536 [1,0,1,0,0,0|1,0,0]=3 43 B9R0.2 CC(C)NCCOCCO Z2017842782 [1,0,1,0,0,0|2,0,0]=4 44 B9R0.5 CCCCCC(O)CCO Z1198158015 [1,0,1,0,0,0|1,0,0]=3 45 B9R0.53 CC(C)CC(C)CC(C)C Z1255415595 [1,0,1,0,0,0|1,0,0]=3 46 B9R0.53 CC(C)CC(C)CC(C)O Z1238571962 [1,0,1,0,0,0|2,0,0]=4 47 B9R0.53 CC(C)CC(N)CC(C)C Z1263714098 [1,0,1,0,0,0|1,0,0]=3 48 B9R0.13 CCCCC(CC)C(=O)O Z104478072 [1,0,1,0,0,0|1,0,1]=4 49 B9R0.33 CCCC(C(=O)O)C(C)C Z756391686 [1,0,1,0,0,0|1,0,1]=4 50 B9R0.43 CCC(CC)NCC(C)C Z90518868 [1,0,1,0,0,0|2,0,0]=4 51 B9R1.1 CC1CCC(CC1)C#N Z415654864 [2,0,0,0,0,0|1,0,1]=4 52 B9R1.1 CC1CCC(CC1)C=O Z1250055138 [2,0,0,0,0,0|1,0,1]=4 53 B9R1.1 CC1CCC(CC1)NN Z927192058 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.1 CC1CCC(NC1)CN Z3492445324 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.1 CCC1CCC(=O)CC1 Z104475572 [2,0,0,0,0,0|1,0,1]=4 56 B9R1.1 CCC1COC(CN1)C Z56968897 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.1 CCN1CCC(CC1)N Z96092729 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.1 CCN1CCC(CC1)O Z197264618 [2,0,0,0,0,0|2,0,0]=4 59 B9R1.1 CC[C@@H]1CC[C@H](NC1)C Z3337244239 [2,0,0,0,0,0|1,0,0]=3 60 B9R1.1 CC[C@H]1CC[C@@H](CC1)N Z2205958759 [2,0,0,0,0,0|1,0,0]=3 61 B9R1.1 CN1CCC(CC1)CO Z594219182 [2,0,0,0,0,0|2,0,0]=4 62 B9R1.1 CNC1CCC(CC1)O Z138503904 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.1 CNC1CCN(CC1)C Z102766804 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.1 CN[C@H]1CC[C@H](CC1)O Z3241259883 [2,0,0,0,0,0|2,0,0]=4 65 B9R1.1 COC1CCC(CC1)N Z2284394857 [2,0,0,0,0,0|2,0,0]=4 66 B9R1.1 COC1CCC(CC1)O Z904962746 [2,0,0,0,0,0|2,0,0]=4 67 B9R1.1 C[C@@H]1CC[C@H](OC1)CN Z3770977955 [2,0,0,0,0,0|2,0,0]=4 68 B9R1.1 C[C@H]1CC[C@@H](CC1)C=O Z1511765971 [2,0,0,0,0,0|1,0,1]=4 69 B9R1.1 N[C@H]1CC[C@@H](CC1)CF Z3035094917 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.1 N[C@H]1CC[C@@H](CC1)CO Z1203582309 [2,0,0,0,0,0|2,0,0]=4 71 B9R1.1 N[C@H]1CC[C@H](CC1)CO Z1203579954 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.1 OCC1CCC(CC1)O Z1255451065 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.6 CC(C)C1CCCCN1 Z1269638432 [2,0,0,0,0,0|1,0,0]=3 74 B9R1.6 CC(C)C1CCCNC1 Z1201627016 [2,0,0,0,0,0|1,0,0]=3 75 B9R1.6 CC(C)C1CCNCC1 Z1262398542 [2,0,0,0,0,0|1,0,0]=3 76 B9R1.6 CC(C)C1CNCCN1 Z1198172518 [2,0,0,0,0,0|2,0,0]=4 77 B9R1.6 CC(C)C1CNCCO1 Z1203831893 [2,0,0,0,0,0|2,0,0]=4 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CNC1CCCCC1C Z324553050 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.15 COC1CCCCC1N Z285187676 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.15 COC1CCCCC1O Z425453594 [2,0,0,0,0,0|1,0,0]=3 98 B9R1.15 CO[C@@H]1CCCC[C@@H]1N Z4658510162 [2,0,0,0,0,0|2,0,0]=4 99 B9R1.15 CO[C@@H]1CCCC[C@H]1O Z3344357599 [2,0,0,0,0,0|1,0,0]=3 100 B9R1.15 CS[C@H]1CCCC[C@@H]1N Z2182116696 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.15 NCC1CCCCC1O Z409444222 [2,0,0,0,0,0|1,0,0]=3 102 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Z2306746656 [2,0,0,0,0,0|1,0,0]=3 103 B9R1.15 OCC1CCCCC1O Z1198163949 [2,0,0,0,0,0|1,0,0]=3 104 B9R1.69 CC1CCC(C(=O)C1)C Z1238548176 [2,0,0,0,0,0|0,0,2]=4 105 B9R1.69 CC1CCC(C(C1)C)N Z854046330 [2,0,0,0,0,0|2,0,0]=4 106 B9R1.69 CC1CCC(C(C1)C)O Z854051758 [2,0,0,0,0,0|2,0,0]=4 107 B9R1.69 CC1CCC(C(C1)O)C Z1201617039 [2,0,0,0,0,0|0,0,0]=2 108 B9R1.69 CC1CCC(CC1C)O Z1201617040 [2,0,0,0,0,0|2,0,0]=4 109 B9R1.69 CC1CNC(C(C1)C)C Z1741798374 [2,0,0,0,0,0|2,0,0]=4 110 B9R1.69 NC1CC[C@H]([C@H](C1)O)O Z2936002015 [2,0,0,0,0,0|2,0,0]=4 111 B11R0.153 CCCCCC(C(=O)O)C(C)C Z756391622 [0,1,1,0,0,0|1,0,1]=4 112 B11R1.3 CC(C)C1CCC(CC1)C#N Z995157958 [1,1,0,0,0,0|0,0,1]=3 113 B11R1.3 CC(C)C1CCC(CC1)C=O Z1268606422 [1,1,0,0,0,0|0,0,1]=3 114 B11R1.3 CC(C)C1CCC(CC1)CN Z995157962 [1,1,0,0,0,0|0,0,0]=2 115 B11R1.3 CC(C)C1CCC(CC1)CO Z1255438893 [1,1,0,0,0,0|0,0,0]=2 116 B11R1.3 CC(C)N1CCC(CC1)CN Z3244926550 [1,1,0,0,0,0|1,0,0]=3 117 B11R1.3 CCN1CCC(CC1)C(C)O Z425721880 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.3 CNC1CCC(CC1)C(F)F Z3270911313 [1,1,0,0,0,0|2,0,0]=4 119 B11R1.3 CNC1CCN(CC1)C(C)C Z102766948 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.3 NCC1CCC(CC1)C(F)F Z3299821526 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.19 CC(C)(C)C1CCC(=O)CC1 Z104476590 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.19 CC(C)(C)C1CCC(CC1)O Z104477300 [1,1,0,0,0,0|1,0,0]=3 123 B11R1.19 CC(C)(C)N1CCC(CC1)N Z295882212 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.19 CC(C)(O)C1CCC(CC1)O Z1897566822 [1,1,0,0,0,0|1,0,0]=3 125 B11R1.19 CC(C)(O)[C@H]1CC[C@H](CC1)N Z4307100631 [1,1,0,0,0,0|1,0,0]=3 126 B11R1.19 CC1=CCC(CC1)C(C)(C)O Z1255427148 [1,1,0,0,0,0|0,0,2]=4 127 B11R1.21 CC(C)C1CCC(C(C1)O)C Z1509104319 [1,1,0,0,0,0|0,0,0]=2 128 B11R1.21 CC(C)[C@@H]1C[C@H]([C@@H](CO1)F)N Z5183298884 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.22 CC(CN)N1CCN(CC1)C Z228569070 [1,1,0,0,0,0|2,0,0]=4 130 B11R1.22 CC1CCN(CC1)C(C)CN Z228576914 [1,1,0,0,0,0|1,0,0]=3 131 B11R1.37 CCN1CC[C@H](C[C@H]1CN)C Z2491441332 [1,1,0,0,0,0|2,0,0]=4 132 B11R1.279 CCN1CCC(CC1C)NC Z825755288 [1,1,0,0,0,0|2,0,0]=4 133 B11R1.53 CC(C)C1OCCCC1CN Z1334512825 [1,1,0,0,0,0|2,0,0]=4 134 B11R1.53 CC(C)N1CCCCC1CN Z326202714 [1,1,0,0,0,0|2,0,0]=4 135 B11R1.87 CC(C)(C)C1CCCCC1=O Z104480142 [1,1,0,0,0,0|0,0,2]=4 136 B11R1.87 CC(C)(C)C1CCCCC1N Z239626678 [1,1,0,0,0,0|1,0,0]=3 137 B11R1.87 CC(C)(C)C1CCNCC1O Z1590620290 [1,1,0,0,0,0|1,0,0]=3 138 B11R1.87 CC(C)(C)C1OCCCC1N Z3769318293 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.87 CS(=O)(=O)[C@@H]1CCCC[C@H]1O Z1896447085 [1,1,0,0,0,0|2,0,0]=4 140 B11R1.87 OC1CCCCC1C(F)(F)F Z979440132 [1,1,0,0,0,0|2,0,0]=4 141 B13R1.165 CC(C)[C@@H]1CC[C@@H](C[C@H]1C(=O)O)C Z3774619187 [0,2,0,0,0,0|0,0,0]=2 142 B13R1.7992 CC(C)C1CCC(C(C1O)O)(C)O Z2050571702 [0,2,0,0,0,0|0,0,0]=2 143 B11R1.90 CC(C)CCC1CCCC1N Z813018522 [0,0,1,1,0,0|2,0,0]=4 144 B11R1.124 CC(C)N1CCC(C1)CCN Z2213893402 [0,0,1,1,0,0|2,0,0]=4 145 B11R1.157 CC(C)CC1CC(=O)CCO1 Z1192341315 [0,0,1,1,0,0|1,0,1]=4 146 B11R1.172 CC(C)CCNC1CCCC1 Z90508783 [0,0,1,1,0,0|2,0,0]=4 147 B11R1.172 CC(C)CCOC1CCNC1 Z1367012388 [0,0,1,1,0,0|2,0,0]=4 148 B11R1.342 CC1(CC(CCO1)CCN)C Z3247499553 [0,0,1,1,0,0|2,0,0]=4 149 B11R1.342 CC1(CCCC(C1)CC=O)C Z1198149195 [0,0,1,1,0,0|0,0,2]=4 150 B11R1.342 CC1(CCCC(C1)CCN)C Z2740416911 [0,0,1,1,0,0|1,0,0]=3 151 B11R1.342 CC1(CCOC(C1)CCN)C Z4808650363 [0,0,1,1,0,0|2,0,0]=4 152 B11R1.342 CC1(CNCC(O1)CCO)C Z2065874770 [0,0,1,1,0,0|2,0,0]=4 153 B11R1.424 CC1=C(C(CCC1)(C)C)CO Z1198234378 [0,0,1,1,0,0|0,0,2]=4 154 B11R1.565 CC(C)C1CCCC(CC1)N Z1258694827 [0,0,1,1,0,0|2,0,0]=4 155 B11R1.565 CC1CCNC(CC1)C(C)C Z1217215083 [0,0,1,1,0,0|1,0,0]=3 156 B11R2.34 NC1CCN(CC1)C2CC2 Z223824036 [1,0,0,1,0,0|2,0,0]=4 157 B11R2.64 NC1CCC2CCC1OC2 Z2900673633 [1,0,0,1,0,0|2,0,0]=4 158 B11R2.508 CC1(CN2CCC1CC2)N Z2510916152 [1,0,0,1,0,0|2,0,0]=4 159 B11R2.533 C=C1CC[C@H]2C[C@@H]1C2(C)C Z1201618602 [1,0,0,1,0,0|0,0,2]=4 160 B11R2.533 CC1([C@H]2CC[C@H]([C@@H]1C2)N)C Z4526189782 [1,0,0,1,0,0|1,0,0]=3 161 B11R2.533 CC1=CC[C@@H]2C[C@H]1C2(C)C Z1255386675 [1,0,0,1,0,0|0,0,2]=4 162 B11R2.533 CC1=CC[C@H]2C[C@@H]1C2(C)C Z1255427385 [1,0,0,1,0,0|0,0,2]=4 163 B11R2.746 CC(C)[C@@]12CC[C@@H]([C@@H]1C2)N Z4020196461 [1,0,0,1,0,0|1,0,0]=3 164 B11R2.1839 CC(N)C12CCC(C1)CC2 Z3445164898 [1,0,0,1,0,0|1,0,0]=3 165 B11R2.1839 CC(O)C12CCC(N1)CC2 Z3210757143 [1,0,0,1,0,0|2,0,0]=4 166 B11R2.2357 CC1([C@@H]2C=C[C@]1(CC2)C)C Z2379088819 [1,0,0,1,0,0|0,0,2]=4 167 B11R2.36 CN1CC[C@@H]2CCN[C@@H]2C1 Z2865591256 [1,0,0,1,0,0|2,0,0]=4 168 B11R2.36 NC1CCC2CCCC2C1 Z1259341392 [1,0,0,1,0,0|2,0,0]=4 169 B11R2.118 CN1CC2CCC1C(C2)N Z2379966241 [1,0,0,1,0,0|2,0,0]=4 170 B11R2.222 NC1CC2CCC1(C2)CO Z3478535964 [1,0,0,1,0,0|2,0,0]=4 171 B11R2.222 N[C@@H]1C[C@@H]2CC[C@]1(C2)CO Z3485122069 [1,0,0,1,0,0|2,0,0]=4 172 B11R2.1 CC1CNC2C1CCCC2 Z1202249435 [1,0,0,1,0,0|1,0,0]=3 173 B11R2.1 NC1COC2C1CCCC2 Z2313089042 [1,0,0,1,0,0|1,0,0]=3 174 B11R2.55 O=C1CCCCC1C2CC2 Z1233201574 [1,0,0,1,0,0|0,0,2]=4 175 B11R2.813 CC(=O)C12CCCCC1O2 Z1513596244 [1,0,0,1,0,0|1,0,1]=4 176 B11R2.845 CC(=O)C1CC2CCC1O2 Z1201052692 [1,0,0,1,0,0|1,0,1]=4 177 B11R2.845 CC(N)C1CC2CCC1C2 Z56821445 [1,0,0,1,0,0|2,0,0]=4 178 B9R1.35 CC1COC(O1)C(C)C Z1198154966 [1,0,0,0,1,0|2,0,0]=4 179 B9R1.35 CN(C)[C@@H]1CC[C@@H](C1)N Z2568756766 [1,0,0,0,1,0|2,0,0]=4 180 B9R1.22 CO[C@@H]1C[C@@H](C[C@@H]1O)N Z4130649749 [1,0,0,0,1,0|2,0,0]=4 181 B9R1.41 CC(C)C1CCCC1=O Z993018308 [1,0,0,0,1,0|0,0,2]=4 182 B9R1.41 CC(C)C1CCCC1N Z3278384105 [1,0,0,0,1,0|1,0,0]=3 183 B9R1.41 CN(C)C1CCCC1N Z271010464 [1,0,0,0,1,0|2,0,0]=4 184 B9R1.41 CN(C)[C@@H]1CCC[C@H]1N Z3033962105 [1,0,0,0,1,0|2,0,0]=4 185 B9R1.41 CN(C)[C@@H]1CNC[C@@H]1O Z2310717305 [1,0,0,0,1,0|2,0,0]=4 186 B9R1.41 CN(C)[C@H]1CCC[C@@H]1N Z1753033013 [1,0,0,0,1,0|2,0,0]=4 187 B11R1.20 CC(C)CN1CCC(CC1)N Z235344783 [1,0,0,0,0,1|2,0,0]=4 188 B11R1.20 CC(C)OC1CCC(CC1)N Z2650510339 [1,0,0,0,0,1|1,0,0]=3 189 B11R1.20 CC(N)CN1CCC(CC1)C Z271007610 [1,0,0,0,0,1|2,0,0]=4 190 B11R1.86 CC(C)CC1CCCCC1N Z3406095613 [1,0,0,0,0,1|1,0,0]=3 191 B11R1.86 CC(C)CC1CNCCC1O Z5041247022 [1,0,0,0,0,1|1,0,0]=3 192 B11R1.86 CC(C)CC1COCCC1O Z1860395874 [1,0,0,0,0,1|1,0,0]=3 193 B11R1.86 CC(C)CC1OCCCC1N Z1723549276 [1,0,0,0,0,1|2,0,0]=4 194 B11R1.86 CN(C)CC1CCCCC1O Z56755628 [1,0,0,0,0,1|1,0,0]=3