0 B9R1.8 C#CCC1CCCCN1 Z3036653487 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.8 C#CCC1CCCNC1 Z2379866313 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.8 C#CCC1CCNCC1 Z3048841829 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.8 C#CCN1CCCCC1 Z103698760 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.8 C=CCC1CCCCN1 Z3976272491 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.8 CCCC1CCCCN1 Z1665033554 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.8 CCCC1CCCNC1 Z1404660494 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.8 CCCC1CCNCC1 Z963408928 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.8 CCNC1CCCCC1 Z235346963 [0,0,0,0,0,0|1,0,1]=2 9 B9R1.8 CCNC1CCCOC1 Z2432621390 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.8 CCOC1CCCNC1 Z334959362 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.8 CCOC1CCNCC1 Z274503162 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.8 CNCC1CCCCC1 Z102767074 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.8 CNCC1CCNCC1 Z3302817319 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.8 COCC1CCCCN1 Z2238934630 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.8 COCC1CCCNC1 Z317037142 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.8 COCC1CCNCC1 Z1267773745 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.8 ClCCN1CCCCC1 Z235354563 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.8 N#CCC1CCCCC1 Z295382924 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.8 N#CCC1CCCNC1 Z2507870625 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.8 N#CCC1CCNCC1 Z1642389481 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.8 N#CCC1CCOCC1 Z979763954 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.8 N#CCN1CCCCC1 Z169223032 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.8 NCCC1CCCCC1 Z367451182 [0,0,0,0,0,0|2,0,1]=3 24 B9R1.8 NCCC1CCCCO1 Z432420620 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.8 NCCC1CCNCC1 Z756921054 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.8 NCCC1CCOCC1 Z851015130 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.8 NCCC1CCSCC1 Z2768149804 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.8 O=C=NC1CCOCC1 Z1037339760 [0,0,0,0,0,0|1,0,2]=3 29 B9R1.8 O=CC=C1CCCCC1 Z1251356876 [0,0,0,0,0,0|1,0,1]=2 30 B9R1.8 O=CCC1CCCCC1 Z993017728 [0,0,0,0,0,0|1,0,0]=1 31 B9R1.8 O=CCC1CCCCO1 Z1511748073 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.8 O=CCC1CCCOC1 Z1198309923 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.8 O=CCC1CCOCC1 Z1178491139 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.8 OCCC1CCCCC1 Z397587116 [0,0,0,0,0,0|1,0,2]=3 35 B9R1.8 OCCC1CCCCO1 Z1198184633 [0,0,0,0,0,0|2,0,2]=4 36 B9R1.8 OCCC1CCCNC1 Z1263820461 [0,0,0,0,0,0|2,0,2]=4 37 B9R1.8 OCCC1CCCOC1 Z1198309922 [0,0,0,0,0,0|2,0,2]=4 38 B9R1.8 OCCC1CCNCC1 Z336087886 [0,0,0,0,0,0|2,0,2]=4 39 B9R1.8 OCCC1CCOCC1 Z1178491138 [0,0,0,0,0,0|2,0,2]=4 40 B9R1.8 OCCN1CCCCC1 Z104479032 [0,0,0,0,0,0|2,0,2]=4 41 B8R1.2 BrC=C1CCNCC1 Z4355559318 [1,0,0,0,0,0|2,0,1]=4 42 B8R1.2 BrCC1CCCCO1 Z104484248 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.2 C#CC1CCCCC1 Z1255457380 [1,0,0,0,0,0|1,0,1]=3 44 B8R1.2 C#CC1CCCCN1 Z2940715353 [1,0,0,0,0,0|2,0,1]=4 45 B8R1.2 C#CC1CCCNC1 Z1741980183 [1,0,0,0,0,0|2,0,1]=4 46 B8R1.2 C#CC1CCNCC1 Z2418193722 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.2 C=CC1CCCCN1 Z2142036752 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.2 C=CC1CCCNC1 Z2740400893 [1,0,0,0,0,0|2,0,0]=3 49 B8R1.2 C=CC1CCNCC1 Z1266933822 [1,0,0,0,0,0|2,0,0]=3 50 B8R1.2 CCC1CCCCN1 Z839028612 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.2 CCC1CCCNC1 Z381019246 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 CCC1CCNCC1 Z1198394219 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.2 CNC1=NCCCC1 Z1744713171 [1,0,0,0,0,0|1,0,2]=4 54 B8R1.2 CNC1CCCSC1 Z1873867368 [1,0,0,0,0,0|1,0,1]=3 55 B8R1.2 CNC1CCNCC1 Z1511513954 [1,0,0,0,0,0|1,0,1]=3 56 B8R1.2 CNC1CCOCC1 Z440603550 [1,0,0,0,0,0|1,0,1]=3 57 B8R1.2 CNC1CCSCC1 Z3234882084 [1,0,0,0,0,0|1,0,1]=3 58 B8R1.2 COC1CCNCC1 Z169511496 [1,0,0,0,0,0|2,0,1]=4 59 B8R1.2 CSC1CCNCC1 Z1201627011 [1,0,0,0,0,0|2,0,1]=4 60 B8R1.2 FCC1CCCNC1 Z2768770399 [1,0,0,0,0,0|2,0,1]=4 61 B8R1.2 N#CC1CCCCC1 Z210803886 [1,0,0,0,0,0|1,0,1]=3 62 B8R1.2 N#CC1CCCCN1 Z205012332 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.2 N#CC1CCCCS1 Z1413800329 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 N#CC1CCCNC1 Z1198184383 [1,0,0,0,0,0|2,0,1]=4 65 B8R1.2 N#CC1CCCOC1 Z1079179226 [1,0,0,0,0,0|2,0,1]=4 66 B8R1.2 N#CC1CCNCC1 Z969559998 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.2 N#CC1CCOCC1 Z440605452 [1,0,0,0,0,0|2,0,1]=4 68 B8R1.2 NCC1CCCCC1 Z235354645 [1,0,0,0,0,0|1,0,1]=3 69 B8R1.2 NCC1CCCCO1 Z839575544 [1,0,0,0,0,0|2,0,1]=4 70 B8R1.2 NCC1CCCCS1 Z1318217220 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.2 NCC1CCOCC1 Z440605454 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.2 NC[C@H]1CCCNC1 Z2686452674 [1,0,0,0,0,0|2,0,1]=4 73 B8R1.2 NOC1CCCCO1 Z968560364 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.2 O=CC1=CCCCC1 Z1190318865 [1,0,0,0,0,0|0,0,2]=3 75 B8R1.2 O=CC1=CCCOC1 Z979787886 [1,0,0,0,0,0|1,0,2]=4 76 B8R1.2 O=CC1=CCCSC1 Z1255380334 [1,0,0,0,0,0|1,0,2]=4 77 B8R1.2 O=CC1=CCOCC1 Z1511760351 [1,0,0,0,0,0|1,0,2]=4 78 B8R1.2 O=CC1=COCCC1 Z432415080 [1,0,0,0,0,0|1,0,2]=4 79 B8R1.2 O=CC1CC=CCC1 Z57936862 [1,0,0,0,0,0|0,0,2]=3 80 B8R1.2 O=CC1CCC=CO1 Z600389890 [1,0,0,0,0,0|1,0,2]=4 81 B8R1.2 O=CC1CCCCC1 Z104478974 [1,0,0,0,0,0|0,0,0]=1 82 B8R1.2 O=CC1CCCCO1 Z1079442734 [1,0,0,0,0,0|1,0,0]=2 83 B8R1.2 O=CC1CCCOC1 Z1065877672 [1,0,0,0,0,0|1,0,0]=2 84 B8R1.2 O=CC1CCCSC1 Z1255489365 [1,0,0,0,0,0|1,0,0]=2 85 B8R1.2 O=CC1CCOCC1 Z979759508 [1,0,0,0,0,0|1,0,0]=2 86 B8R1.2 O=CC1CCSCC1 Z1201622265 [1,0,0,0,0,0|1,0,0]=2 87 B8R1.2 O=CN1CCCCC1 Z1255415437 [1,0,0,0,0,0|1,0,0]=2 88 B8R1.2 O=CN1CCNCC1 Z104479110 [1,0,0,0,0,0|2,0,0]=3 89 B8R1.2 O=CN1CCOCC1 Z295197308 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.2 O=NN1CCCCC1 Z1198147906 [1,0,0,0,0,0|1,0,1]=3 91 B8R1.2 O=NN1CCNCC1 Z1198149478 [1,0,0,0,0,0|2,0,1]=4 92 B8R1.2 O=NN1CCOCC1 Z1255360497 [1,0,0,0,0,0|2,0,1]=4 93 B8R1.2 O=NN1CCSCC1 Z1198157610 [1,0,0,0,0,0|2,0,1]=4 94 B8R1.2 OCC1CCCCC1 Z104503428 [1,0,0,0,0,0|0,0,2]=3 95 B8R1.2 OCC1CCCCN1 Z104476610 [1,0,0,0,0,0|1,0,2]=4 96 B8R1.2 OCC1CCCCO1 Z104479808 [1,0,0,0,0,0|1,0,2]=4 97 B8R1.2 OCC1CCCNC1 Z104479614 [1,0,0,0,0,0|1,0,2]=4 98 B8R1.2 OCC1CCCOC1 Z445213352 [1,0,0,0,0,0|1,0,2]=4 99 B8R1.2 OCC1CCNCC1 Z380864362 [1,0,0,0,0,0|1,0,2]=4 100 B8R1.2 OCC1CCOCC1 Z979753218 [1,0,0,0,0,0|1,0,2]=4 101 B8R1.2 OCC1CCSCC1 Z1198266791 [1,0,0,0,0,0|1,0,2]=4 102 B8R1.2 OC[C@H]1CCCCN1 Z1203731003 [1,0,0,0,0,0|1,0,2]=4 103 B8R1.2 ON=C1CCCCC1 Z49568468 [1,0,0,0,0,0|0,0,3]=4 104 B8R1.2 [C-]#[N+]C1CCOCC1 Z1725967213 [1,0,0,0,0,0|1,0,2]=4 105 B10R1.1 C=CCN1CCC(CC1)N Z431745660 [0,1,0,0,0,0|3,0,0]=4 106 B10R1.1 CC1CCC(CC1)CCN Z3407353899 [0,1,0,0,0,0|2,0,1]=4 107 B10R1.1 CCCC1CCC(CC1)N Z335455572 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.1 CCNC1CCN(CC1)C Z2235801317 [0,1,0,0,0,0|2,0,1]=4 109 B10R1.1 CCN[C@H]1CC[C@@H](CC1)N Z3244924075 [0,1,0,0,0,0|1,0,1]=3 110 B10R1.1 CCOC1CCC(CC1)O Z1652659072 [0,1,0,0,0,0|2,0,1]=4 111 B10R1.1 CNCC1CCC(CC1)C Z4497190298 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.1 COCC1CCC(CC1)N Z1203642452 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.1 CSCC1CCC(CC1)N Z2234185680 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.4 CCCC1CCCCC1O Z854050598 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.4 CCNC1CCCCC1C Z2143574194 [0,1,0,0,0,0|1,0,1]=3 116 B10R1.4 CCSC1CCCCC1N Z1238713176 [0,1,0,0,0,0|2,0,1]=4 117 B10R1.4 NCC[C@@H]1CCCC[C@@H]1O Z2915288574 [0,1,0,0,0,0|2,0,1]=4 118 B10R1.4 NCC[C@@H]1CCCC[C@H]1O Z3993260243 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.10 CC1CCCC(C1)CCO Z1217184154 [0,1,0,0,0,0|1,0,2]=4 120 B10R1.10 CCNC1CCCC(C1)N Z5062701902 [0,1,0,0,0,0|1,0,1]=3 121 B10R1.10 CCSC1CCCC(C1)N Z1245789153 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.15 C#CC(N)C1CCCCC1 Z4526260015 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.15 C=CC(=O)N1CCCCC1 Z440633600 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.15 CC(C=O)C1CCCCC1 Z1198160362 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.15 CC(C=O)C1CCOCC1 Z3242951087 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.15 CCC(=O)C1CCCCC1 Z513735268 [0,1,0,0,0,0|2,0,1]=4 127 B10R1.15 CCC(N)C1CCCCC1 Z513797596 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.15 CCC(O)C1CCCCC1 Z513751136 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.15 CCN(C)C1CCNCC1 Z1459943863 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.15 CNC(C)C1CCCCC1 Z2010010276 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.15 N#CC(N)C1CCCCC1 Z1335657654 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.15 NCC(N)C1CCCCC1 Z425861046 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.15 NCC(O)C1CCCCC1 Z234895869 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.15 NNC(=O)C1CCCCC1 Z56930714 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.15 O=C(CCl)C1CCCCC1 Z1205657412 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.17 C#CCNC1CCCCC1 Z910843080 [0,1,0,0,0,0|1,0,1]=3 137 B10R1.17 C#CCNC1CCNCC1 Z728910178 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.17 C#CCNC1CCOCC1 Z440603568 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.17 C=CCCC1CCCNC1 Z4456666883 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.17 C=CCOC1CCNCC1 Z391852222 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.17 CCCNC1CCCCC1 Z57396800 [0,1,0,0,0,0|1,0,1]=3 142 B10R1.17 CCCNC1CCOCC1 Z3251708452 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.17 FCCNC1CCOCC1 Z5919610119 [0,1,0,0,0,0|2,0,1]=4 144 B10R1.17 N#CCCC1CCCCC1 Z382691354 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.17 NCCCC1CCCCC1 Z234895793 [0,1,0,0,0,0|2,0,1]=4 146 B10R1.17 NCCNC1CCCCC1 Z4766278182 [0,1,0,0,0,0|1,0,1]=3 147 B10R1.17 O=CCCC1CC=CCC1 Z1511746907 [0,1,0,0,0,0|1,0,2]=4 148 B10R1.17 O=CCCC1CCCCC1 Z57921395 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.17 O=CCCC1CCOCC1 Z993017668 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.17 OCC#CC1CCCCC1 Z1618119110 [0,1,0,0,0,0|1,0,2]=4 151 B10R1.17 OCCCC1CCCCC1 Z87002514 [0,1,0,0,0,0|1,0,2]=4 152 B10R1.17 OCCNC1CCCCC1 Z90504557 [0,1,0,0,0,0|0,0,2]=3 153 B10R1.17 OCCNC1CCOCC1 Z440604238 [0,1,0,0,0,0|1,0,2]=4 154 B10R1.17 OCCOC1CCCCC1 Z362785382 [0,1,0,0,0,0|1,0,2]=4 155 B10R1.18 CC(=O)CC1CCNCC1 Z3235039172 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.18 CC(=O)CC1CCOCC1 Z992965782 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.18 CC(=O)CC1COCCN1 Z1649677748 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.18 CC(=O)NC1CCCNC1 Z285140960 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.18 CC(=O)NC1CCNCC1 Z969560560 [0,1,0,0,0,0|1,0,0]=2 160 B10R1.18 CC(=O)OC1=CCCCC1 Z426041318 [0,1,0,0,0,0|1,0,2]=4 161 B10R1.18 CC(C)NC1CCCCC1 Z166605468 [0,1,0,0,0,0|1,0,1]=3 162 B10R1.18 CC(C)NC1CCCOC1 Z5110495008 [0,1,0,0,0,0|2,0,1]=4 163 B10R1.18 CC(C)NC1CCNCC1 Z728910198 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.18 CC(C)NC1CCOCC1 Z3013892334 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.18 CC(N)CC1CCCCC1 Z3235020113 [0,1,0,0,0,0|2,0,1]=4 166 B10R1.18 N=C(N)CC1CCCCC1 Z803129918 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.18 N=C(N)NC1CCOCC1 Z1117844692 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.18 NC(=NC1CCCCC1)N Z1250080946 [0,1,0,0,0,0|1,0,1]=3 169 B10R1.18 NC(=O)CC1CCCCC1 Z33547160 [0,1,0,0,0,0|1,0,0]=2 170 B10R1.18 NC(=O)CC1CCCCN1 Z370714204 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.18 NC(=O)CC1CCCNC1 Z1318268688 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.18 NC(=O)CC1CCNCC1 Z300072138 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.18 NC(=O)CC1CNCCO1 Z1274804035 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.18 NC(=O)CC1COCCN1 Z2080125157 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.18 NC(=O)CN1CCNCC1 Z169506468 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.18 NC(=O)NC1CCCCC1 Z56896929 [0,1,0,0,0,0|0,0,0]=1 177 B10R1.18 NC(=O)NC1CCCNC1 Z1259341125 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.18 NC(=O)NC1CCNCC1 Z1272096623 [0,1,0,0,0,0|1,0,0]=2 179 B10R1.18 NC(=S)NC1CCCCC1 Z56931891 [0,1,0,0,0,0|0,1,0]=2 180 B10R1.18 NC(=S)NC1CCOCC1 Z440609286 [0,1,0,0,0,0|1,1,0]=3 181 B10R1.18 O=C(O)C=C1CCCCC1 Z352748084 [0,1,0,0,0,0|1,0,1]=3 182 B10R1.18 O=C(O)C=C1CCOCC1 Z440605394 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.18 O=C(O)C=C1CCSCC1 Z1262528560 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.18 O=C(O)CC1=CCCCC1 Z1138835936 [0,1,0,0,0,0|1,0,2]=4 185 B10R1.18 O=C(O)CC1C=CCCC1 Z1198264430 [0,1,0,0,0,0|1,0,2]=4 186 B10R1.18 O=C(O)CC1CCCCC1 Z104486044 [0,1,0,0,0,0|1,0,0]=2 187 B10R1.18 O=C(O)CC1CCCCN1 Z3234954063 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.18 O=C(O)CC1CCCCO1 Z432421618 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.18 O=C(O)CC1CCCNC1 Z1272743958 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.18 O=C(O)CC1CCCOC1 Z445215100 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.18 O=C(O)CC1CCOCC1 Z440605396 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.18 O=C(O)CC1CCSCC1 Z826531570 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.18 O=C(O)CC1CNCCO1 Z3241262582 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.18 O=C(O)CC1COCCN1 Z1741981133 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.18 O=C(O)CC1CSCCS1 Z1492186731 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.18 O=C(O)CC1OCCCO1 Z1205495524 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.18 O=C(O)CN1CCCCC1 Z1171978832 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.18 O=C(O)CN1CCNCC1 Z2887863329 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.18 O=C(O)CN1CCOCC1 Z1270246390 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.377 C#CCC1(CCCCC1)N Z2900956970 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.377 C#CCC1(CCCCC1)O Z1098923664 [0,1,0,0,0,0|2,0,1]=4 202 B10R1.377 C=CCC1(CCNCC1)O Z2805801401 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.377 CC1(CCOCC1)CC=O Z2466490037 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.377 CNCC1(CCCCC1)O Z5877642793 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.377 NC1(CCCCC1)CCO Z1198728181 [0,1,0,0,0,0|1,0,2]=4 206 B10R1.377 NCCC1(CCCCC1)O Z3014013619 [0,1,0,0,0,0|2,0,1]=4 207 B8R0.4 C=CCCCCCCN Z1198263320 [0,0,1,0,0,0|3,0,0]=4 208 B8R0.4 CCCCCCCCO Z104473500 [0,0,1,0,0,0|1,0,2]=4 209 B10R2.1 NC1CC12CCCCC2 Z1795817890 [0,0,0,1,0,0|2,0,1]=4 210 B10R2.6 C1CCC(CC1)C2CO2 Z1020679990 [0,0,0,1,0,0|1,0,2]=4 211 B10R2.6 C1CCC(CC1)[C@H]2CO2 Z3271410869 [0,0,0,1,0,0|1,0,2]=4 212 B10R2.7 C1=CC2=C(N1)CCCC2 Z274765016 [0,0,0,1,0,0|1,0,2]=4 213 B10R2.7 C1=NC2=C(N1)CCCC2 Z1198155272 [0,0,0,1,0,0|1,0,2]=4 214 B10R2.7 C1CCC2CNCC2C1 Z1198161702 [0,0,0,1,0,0|3,0,0]=4 215 B10R2.7 C1CC[C@H]2CNC[C@H]2C1 Z1198182421 [0,0,0,1,0,0|3,0,0]=4 216 B10R2.7 C1C[C@@H]2NCC[C@@H]2CN1 Z4763571500 [0,0,0,1,0,0|2,0,1]=4 217 B10R2.61 O=C1NC2CCNC1C2 Z1509030871 [0,0,0,1,0,0|1,0,0]=2 218 B10R2.61 O=C1NC2CNCC1C2 Z2696515575 [0,0,0,1,0,0|1,0,0]=2 219 B10R2.61 O=C1OC2CCNC1C2 Z5219768392 [0,0,0,1,0,0|2,0,0]=3 220 B10R2.62 NC1CC2CCC1CC2 Z2217033055 [0,0,0,1,0,0|2,0,1]=4 221 B10R2.62 O=C1CC2CCC1CC2 Z1379488333 [0,0,0,1,0,0|1,0,0]=2 222 B10R2.62 O=C1C[C@H]2C=C[C@@H]1CC2 Z1255439877 [0,0,0,1,0,0|1,0,2]=4 223 B10R2.62 O=C1NC2CCC1CC2 Z926909656 [0,0,0,1,0,0|0,0,0]=1 224 B10R2.62 O=C1NN2CCC1CC2 Z2181669941 [0,0,0,1,0,0|1,0,0]=2 225 B10R2.62 OC1CC2CCC1CC2 Z1255390988 [0,0,0,1,0,0|1,0,2]=4 226 B10R2.320 N[C@@H]1C[C@H]2[C@@H]1CCCC2 Z2768509371 [0,0,0,1,0,0|2,0,1]=4 227 B10R2.320 O=C1N[C@H]2[C@@H]1CCCC2 Z2289709427 [0,0,0,1,0,0|0,0,0]=1 228 B10R2.368 NCCC1CCC2C1C2 Z2830621171 [0,0,0,1,0,0|2,0,1]=4 229 B10R2.408 C1CC2CCNC(C1)C2 Z3277762688 [0,0,0,1,0,0|1,0,1]=3 230 B10R2.408 C1CC2CN(C1)CCN2 Z3243810573 [0,0,0,1,0,0|2,0,1]=4 231 B10R2.408 C1CC2CNCC(C1)C2 Z2039477488 [0,0,0,1,0,0|3,0,0]=4 232 B10R2.409 C1CC2CCC1CNC2 Z1262569342 [0,0,0,1,0,0|3,0,0]=4 233 B10R2.409 C1CN2CCC(N1)CC2 Z274488362 [0,0,0,1,0,0|2,0,1]=4 234 B10R2.484 C1CC2(N1)CCOCC2 Z1201627692 [0,0,0,1,0,0|2,0,1]=4 235 B10R2.484 C1CC2(N1)CCSCC2 Z3304732688 [0,0,0,1,0,0|2,0,1]=4 236 B10R2.513 NC[C@@H]1[C@@H]2[C@H]1CCCC2 Z4952682900 [0,0,0,1,0,0|2,0,1]=4 237 B10R2.513 O=CC1C2C1CCCC2 Z1464130482 [0,0,0,1,0,0|1,0,0]=2 238 B10R2.513 O=CC1C2C1COCC2 Z3049864179 [0,0,0,1,0,0|2,0,0]=3 239 B8R1.8 CCNC1CCCC1 Z90513159 [0,0,0,0,1,0|1,0,1]=3 240 B8R1.8 CNCC1CCCC1 Z1162448850 [0,0,0,0,1,0|3,0,0]=4 241 B8R1.8 N#CCC1CCCC1 Z804898574 [0,0,0,0,1,0|2,0,1]=4 242 B8R1.8 NCCC1CCCC1 Z398556750 [0,0,0,0,1,0|2,0,1]=4 243 B8R1.8 O=C=NC1CCCC1 Z316172554 [0,0,0,0,1,0|0,0,2]=3 244 B8R1.8 O=CCC1CCCC1 Z993017732 [0,0,0,0,1,0|1,0,0]=2 245 B8R1.8 O=CCC1CCCO1 Z1183458964 [0,0,0,0,1,0|2,0,0]=3 246 B8R1.8 O=CCC1CCOC1 Z1138844345 [0,0,0,0,1,0|2,0,0]=3 247 B8R1.8 OCCC1CCCC1 Z397587408 [0,0,0,0,1,0|1,0,2]=4 248 B10R1.85 C=CCN1CCCNCC1 Z3271028100 [0,0,0,0,0,1|3,0,0]=4 249 B10R1.85 CCCC1CCCNCC1 Z425362308 [0,0,0,0,0,1|2,0,1]=4 250 B10R1.85 N#CNC1=NCCCCC1 Z839028582 [0,0,0,0,0,1|1,0,2]=4 251 B10R1.85 O=CCC1CCCCCC1 Z1268611681 [0,0,0,0,0,1|1,0,0]=2 252 B10R1.85 OCCC1CCCCCC1 Z1198264962 [0,0,0,0,0,1|1,0,2]=4 253 B7R0.1 CCCCCCCO Z104473596 [1,0,1,0,0,0|0,0,2]=4 254 B7R0.1 CCCCCCNC Z5419328797 [1,0,1,0,0,0|0,0,1]=3 255 B7R0.1 CNCCCCCN Z4097840720 [1,0,1,0,0,0|1,0,1]=4 256 B7R0.1 CNCCCCOC Z875082126 [1,0,1,0,0,0|1,0,1]=4 257 B7R0.3 CCCCC(C)NC Z446022384 [1,0,1,0,0,0|0,0,1]=3 258 B7R0.3 CCCCN(C)N=O Z1198149449 [1,0,1,0,0,0|1,0,1]=4 259 B7R0.3 CCSCC(C)NC Z1238713281 [1,0,1,0,0,0|1,0,1]=4 260 B7R0.12 CCNC(CC)CC Z2130642482 [1,0,1,0,0,0|1,0,1]=4 261 B7R0.12 O=CNC(CO)CO Z1259117052 [1,0,1,0,0,0|2,0,0]=4 262 B7R1.3 C=C1CCNCC1 Z1124146875 [2,0,0,0,0,0|1,0,1]=4 263 B7R1.3 C[C@H]1CCCNC1 Z1895741201 [2,0,0,0,0,0|1,0,1]=4 264 B7R1.3 FC1CCNCC1 Z1741960061 [2,0,0,0,0,0|2,0,0]=4 265 B7R1.3 NC1=NCCCC1 Z1723418848 [2,0,0,0,0,0|1,0,1]=4 266 B7R1.3 NC1C=CCCC1 Z1203579654 [2,0,0,0,0,0|0,0,2]=4 267 B7R1.3 NC1CCCCC1 Z1945707495 [2,0,0,0,0,0|0,0,0]=2 268 B7R1.3 NC1CCCOC1 Z1013492300 [2,0,0,0,0,0|1,0,0]=3 269 B7R1.3 NC1CCCSC1 Z1029463244 [2,0,0,0,0,0|1,0,0]=3 270 B7R1.3 NC1CCOCC1 Z600428352 [2,0,0,0,0,0|1,0,0]=3 271 B7R1.3 NC1CCSCC1 Z992716928 [2,0,0,0,0,0|1,0,0]=3 272 B7R1.3 O=C1CCCCC1 Z104474256 [2,0,0,0,0,0|0,0,1]=3 273 B7R1.3 O=C1CCCCN1 Z168817684 [2,0,0,0,0,0|1,0,1]=4 274 B7R1.3 O=C1CCCCO1 Z432085120 [2,0,0,0,0,0|1,0,1]=4 275 B7R1.3 O=C1CCCCS1 Z1726147018 [2,0,0,0,0,0|1,0,1]=4 276 B7R1.3 O=C1CCCNC1 Z3063726909 [2,0,0,0,0,0|1,0,1]=4 277 B7R1.3 O=C1CCCSC1 Z979714552 [2,0,0,0,0,0|1,0,1]=4 278 B7R1.3 O=C1CCNCC1 Z1741959513 [2,0,0,0,0,0|1,0,1]=4 279 B7R1.3 O=S1CCNCC1 Z1263714072 [2,0,0,0,0,0|2,0,0]=4 280 B7R1.3 OC1CCCCC1 Z104473498 [2,0,0,0,0,0|0,0,1]=3 281 B7R1.3 OC1CCCSC1 Z993818972 [2,0,0,0,0,0|1,0,1]=4 282 B7R1.3 OC1CCNCC1 Z56347197 [2,0,0,0,0,0|1,0,1]=4 283 B7R1.3 OC1CCOCC1 Z1359429523 [2,0,0,0,0,0|1,0,1]=4 284 B9R0.2 CC(=O)NCCOCCO Z353623894 [0,1,1,0,0,0|2,0,0]=4 285 B9R0.2 CCCCCCCC(=O)O Z104495238 [0,1,1,0,0,0|1,0,0]=3 286 B9R0.2 CCCCCCNC(=S)N Z55992996 [0,1,1,0,0,0|0,1,0]=3 287 B9R0.2 CCCCCNCC(=O)N Z104536260 [0,1,1,0,0,0|2,0,0]=4 288 B9R0.2 CCCCCOCC(=O)O Z409357548 [0,1,1,0,0,0|2,0,0]=4 289 B9R0.2 CCCCSCCC(=O)O Z149304844 [0,1,1,0,0,0|2,0,0]=4 290 B9R0.2 CCNCCCCC(=O)O Z2893830564 [0,1,1,0,0,0|2,0,0]=4 291 B9R0.2 CCOCCCNC(=O)N Z56985786 [0,1,1,0,0,0|1,0,0]=3 292 B9R0.2 CCOCCCNC(=S)N Z108564470 [0,1,1,0,0,0|1,1,0]=4 293 B9R0.2 NC(=O)NCCOCCO Z198194948 [0,1,1,0,0,0|2,0,0]=4 294 B9R0.2 NCCCCCCC(=O)O Z56896351 [0,1,1,0,0,0|2,0,0]=4 295 B9R0.45 CCCCCCCNC=O Z1203732044 [0,1,1,0,0,0|0,0,0]=2 296 B9R0.45 CCCCCCNCCO Z137800948 [0,1,1,0,0,0|0,0,2]=4 297 B9R0.14 CCCC(CC)CC(=O)O Z1198149106 [0,1,1,0,0,0|1,0,0]=3 298 B9R1.1 CC1CCC(CC1)C#N Z415654864 [1,1,0,0,0,0|1,0,1]=4 299 B9R1.1 CC1CCC(CC1)C=O Z1250055138 [1,1,0,0,0,0|0,0,0]=2 300 B9R1.1 CC1CCC(CC1)NN Z927192058 [1,1,0,0,0,0|1,0,0]=3 301 B9R1.1 CC[C@H]1CC[C@@H](CC1)N Z2205958759 [1,1,0,0,0,0|1,0,1]=4 302 B9R1.1 CN1CCC(CC1)C=O Z372839344 [1,1,0,0,0,0|1,0,0]=3 303 B9R1.1 CNC1CCC(CC1)O Z138503904 [1,1,0,0,0,0|0,0,1]=3 304 B9R1.1 CNC1CCN(CC1)C Z102766804 [1,1,0,0,0,0|1,0,1]=4 305 B9R1.1 CNC1CCS(=O)CC1 Z1259162055 [1,1,0,0,0,0|1,0,1]=4 306 B9R1.1 CN[C@H]1CC[C@H](CC1)O Z3241259883 [1,1,0,0,0,0|0,0,1]=3 307 B9R1.1 COC1CCC(CC1)N Z2284394857 [1,1,0,0,0,0|1,0,1]=4 308 B9R1.1 COC1CCC(CC1)O Z904962746 [1,1,0,0,0,0|1,0,1]=4 309 B9R1.1 C[C@H]1CC[C@@H](CC1)C=O Z1511765971 [1,1,0,0,0,0|0,0,0]=2 310 B9R1.1 N#C[C@H]1CC[C@@H](CC1)N Z1262687451 [1,1,0,0,0,0|1,0,1]=4 311 B9R1.1 N#C[C@H]1CC[C@H](CC1)N Z1486032476 [1,1,0,0,0,0|1,0,1]=4 312 B9R1.1 N[C@H]1CC[C@@H](CC1)CF Z3035094917 [1,1,0,0,0,0|1,0,1]=4 313 B9R1.1 N[C@H]1CC[C@@H](CC1)CO Z1203582309 [1,1,0,0,0,0|0,0,2]=4 314 B9R1.1 N[C@H]1CC[C@H](CC1)CO Z1203579954 [1,1,0,0,0,0|0,0,2]=4 315 B9R1.1 O=CC1CCC(=O)CC1 Z1198165293 [1,1,0,0,0,0|0,0,1]=3 316 B9R1.1 O=CC1CCC(CC1)F Z1813155376 [1,1,0,0,0,0|0,0,0]=2 317 B9R1.1 OCC1CCC(CC1)O Z1255451065 [1,1,0,0,0,0|0,0,2]=4 318 B9R1.2 C=C[C@@H]1CCC[C@H](C1)N Z3071811850 [1,1,0,0,0,0|1,0,0]=3 319 B9R1.2 CC1CC(CCO1)C=O Z1268606322 [1,1,0,0,0,0|1,0,0]=3 320 B9R1.2 CC1CCCC(C1)C#N Z415654834 [1,1,0,0,0,0|1,0,1]=4 321 B9R1.2 CC1CCCC(C1)C=O Z1217182161 [1,1,0,0,0,0|0,0,0]=2 322 B9R1.2 CCC1CCCC(C1)N Z1210580079 [1,1,0,0,0,0|1,0,1]=4 323 B9R1.2 CCC1CCCC(C1)O Z1192057272 [1,1,0,0,0,0|1,0,1]=4 324 B9R1.2 CNC1CCCC(C1)C Z367452444 [1,1,0,0,0,0|0,0,1]=3 325 B9R1.2 CNC1CCCC(C1)O Z3064472236 [1,1,0,0,0,0|0,0,1]=3 326 B9R1.2 CNC1CCOC(C1)C Z4657959047 [1,1,0,0,0,0|1,0,1]=4 327 B9R1.2 COC1CCCC(C1)N Z1192179498 [1,1,0,0,0,0|1,0,1]=4 328 B9R1.2 COC1CCCC(C1)O Z104476334 [1,1,0,0,0,0|1,0,1]=4 329 B9R1.2 CSC1CCCC(C1)N Z1219048788 [1,1,0,0,0,0|1,0,1]=4 330 B9R1.2 NCC1CCCC(C1)F Z2429425744 [1,1,0,0,0,0|1,0,1]=4 331 B9R1.2 O=CC1CCCC(C1)F Z1813182338 [1,1,0,0,0,0|0,0,0]=2 332 B9R1.6 CC(=O)C1CCCCN1 Z1954800414 [1,1,0,0,0,0|1,0,0]=3 333 B9R1.6 CC(=O)C1CCCOC1 Z1259153006 [1,1,0,0,0,0|1,0,0]=3 334 B9R1.6 CC(=O)C1CCNCC1 Z1741977299 [1,1,0,0,0,0|1,0,0]=3 335 B9R1.6 CC(=O)C1CCOCC1 Z1178490124 [1,1,0,0,0,0|1,0,0]=3 336 B9R1.6 CC(=O)N1CCCOC1 Z2143251901 [1,1,0,0,0,0|2,0,0]=4 337 B9R1.6 CC(=O)[C@@H]1CCCCN1 Z1618016835 [1,1,0,0,0,0|1,0,0]=3 338 B9R1.6 CC(=O)[C@H]1CCCCN1 Z2234185612 [1,1,0,0,0,0|1,0,0]=3 339 B9R1.6 CC(N)C1CCCCC1 Z446020926 [1,1,0,0,0,0|1,0,1]=4 340 B9R1.6 CC(O)C1CCCCC1 Z445987098 [1,1,0,0,0,0|0,0,2]=4 341 B9R1.6 CN(C)C1CCCNC1 Z415658510 [1,1,0,0,0,0|1,0,1]=4 342 B9R1.6 CN(C)C1CCNCC1 Z317268642 [1,1,0,0,0,0|1,0,1]=4 343 B9R1.6 C[C@@H](O)C1CCCCC1 Z959151676 [1,1,0,0,0,0|0,0,2]=4 344 B9R1.6 N=C(N)C1CCCCC1 Z317027412 [1,1,0,0,0,0|1,0,0]=3 345 B9R1.6 N=C(N)C1CCCCN1 Z1269145449 [1,1,0,0,0,0|2,0,0]=4 346 B9R1.6 N=C(N)C1CCCOC1 Z5597542232 [1,1,0,0,0,0|2,0,0]=4 347 B9R1.6 N=C(N)C1CCOCC1 Z1582263016 [1,1,0,0,0,0|2,0,0]=4 348 B9R1.6 N=C(N)N1CCCCC1 Z1582263025 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.6 NC(=O)C1CC=CCC1 Z145119476 [1,1,0,0,0,0|0,0,2]=4 350 B9R1.6 NC(=O)C1CCCCC1 Z33546516 [1,1,0,0,0,0|0,0,0]=2 351 B9R1.6 NC(=O)C1CCCCN1 Z90122010 [1,1,0,0,0,0|1,0,0]=3 352 B9R1.6 NC(=O)C1CCCNC1 Z85932258 [1,1,0,0,0,0|1,0,0]=3 353 B9R1.6 NC(=O)C1CCNCC1 Z1450533743 [1,1,0,0,0,0|1,0,0]=3 354 B9R1.6 NC(=O)C1CCOCC1 Z82670321 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.6 NC(=O)C1CNCCN1 Z203041340 [1,1,0,0,0,0|2,0,0]=4 356 B9R1.6 NC(=O)C1CNCCO1 Z854097660 [1,1,0,0,0,0|2,0,0]=4 357 B9R1.6 NC(=O)C1CSCCN1 Z1198160722 [1,1,0,0,0,0|2,0,0]=4 358 B9R1.6 NC(=O)N1CCCCC1 Z56917364 [1,1,0,0,0,0|1,0,0]=3 359 B9R1.6 NC(=O)N1CCNCC1 Z1473962055 [1,1,0,0,0,0|2,0,0]=4 360 B9R1.6 NC(=O)[C@@H]1CNCCO1 Z2434225518 [1,1,0,0,0,0|2,0,0]=4 361 B9R1.6 NC(=O)[C@H]1CNCCO1 Z2434225532 [1,1,0,0,0,0|2,0,0]=4 362 B9R1.6 NC(=S)N1CCCCC1 Z56899022 [1,1,0,0,0,0|1,1,0]=4 363 B9R1.6 O=C(O)C1C=CCCC1 Z57127330 [1,1,0,0,0,0|0,0,2]=4 364 B9R1.6 O=C(O)C1CC=CCC1 Z57921336 [1,1,0,0,0,0|0,0,2]=4 365 B9R1.6 O=C(O)C1CCCCC1 Z104475698 [1,1,0,0,0,0|0,0,0]=2 366 B9R1.6 O=C(O)C1CCCCN1 Z104479780 [1,1,0,0,0,0|1,0,0]=3 367 B9R1.6 O=C(O)C1CCCCO1 Z963633098 [1,1,0,0,0,0|1,0,0]=3 368 B9R1.6 O=C(O)C1CCCNC1 Z324553206 [1,1,0,0,0,0|1,0,0]=3 369 B9R1.6 O=C(O)C1CCCOC1 Z445214062 [1,1,0,0,0,0|1,0,0]=3 370 B9R1.6 O=C(O)C1CCCSC1 Z1198485079 [1,1,0,0,0,0|1,0,0]=3 371 B9R1.6 O=C(O)C1CCCSS1 Z1262517456 [1,1,0,0,0,0|2,0,0]=4 372 B9R1.6 O=C(O)C1CCNCC1 Z104474390 [1,1,0,0,0,0|1,0,0]=3 373 B9R1.6 O=C(O)C1CCOCC1 Z85923421 [1,1,0,0,0,0|1,0,0]=3 374 B9R1.6 O=C(O)C1CCSCC1 Z826531634 [1,1,0,0,0,0|1,0,0]=3 375 B9R1.6 O=C(O)C1CCSCN1 Z1235963996 [1,1,0,0,0,0|2,0,0]=4 376 B9R1.6 O=C(O)C1CNCCN1 Z1273089259 [1,1,0,0,0,0|2,0,0]=4 377 B9R1.6 O=C(O)C1COCCN1 Z1255387606 [1,1,0,0,0,0|2,0,0]=4 378 B9R1.6 O=C(O)C1COCCO1 Z362763682 [1,1,0,0,0,0|2,0,0]=4 379 B9R1.6 O=C(O)C1CSCCS1 Z147642878 [1,1,0,0,0,0|2,0,0]=4 380 B9R1.6 O=C(O)C1SCCCS1 Z275241266 [1,1,0,0,0,0|2,0,0]=4 381 B9R1.6 O=C(O)[C@@H]1CCCCN1 Z1033300646 [1,1,0,0,0,0|1,0,0]=3 382 B9R1.6 OB(O)C1CCCCC1 Z56789446 [1,1,0,0,0,0|1,0,1]=4 383 B9R1.15 C#CC1CCCCC1O Z1725997828 [1,1,0,0,0,0|1,0,1]=4 384 B9R1.15 CC1CC=CCC1C=O Z1201621350 [1,1,0,0,0,0|0,0,2]=4 385 B9R1.15 CC1CCCCC1C#N Z415654838 [1,1,0,0,0,0|1,0,1]=4 386 B9R1.15 CC1CCCCC1C=O Z1268606365 [1,1,0,0,0,0|0,0,0]=2 387 B9R1.15 CC1CCCCC1CN Z415655074 [1,1,0,0,0,0|1,0,1]=4 388 B9R1.15 CCC1CCCCC1N Z368844574 [1,1,0,0,0,0|1,0,1]=4 389 B9R1.15 CCC1CCCCC1O Z104476198 [1,1,0,0,0,0|1,0,1]=4 390 B9R1.15 CNC1CCCCC1C Z324553050 [1,1,0,0,0,0|0,0,1]=3 391 B9R1.15 CNC1CCOCC1C Z4641453836 [1,1,0,0,0,0|1,0,1]=4 392 B9R1.15 COC1CCCCC1N Z285187676 [1,1,0,0,0,0|1,0,1]=4 393 B9R1.15 COC1CCCCC1O Z425453594 [1,1,0,0,0,0|1,0,1]=4 394 B9R1.15 CO[C@@H]1CCCC[C@@H]1N Z4658510162 [1,1,0,0,0,0|1,0,1]=4 395 B9R1.15 CO[C@@H]1CCCC[C@H]1O Z3344357599 [1,1,0,0,0,0|1,0,1]=4 396 B9R1.15 CS[C@H]1CCCC[C@@H]1N Z2182116696 [1,1,0,0,0,0|1,0,1]=4 397 B9R1.15 NCC1CCCCC1O Z409444222 [1,1,0,0,0,0|1,0,1]=4 398 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Z2306746656 [1,1,0,0,0,0|1,0,1]=4 399 B9R1.15 O=CC1CCCCC1F Z1813140630 [1,1,0,0,0,0|0,0,0]=2 400 B9R1.15 OCC1CCCCC1O Z1198163949 [1,1,0,0,0,0|0,0,2]=4 401 B9R1.118 C=CC1(CCOCC1)N Z3092386482 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.118 CC1(CCCCC1)C#N Z1255495336 [1,1,0,0,0,0|1,0,1]=4 403 B9R1.118 CC1(CCCCC1)C=O Z1198343650 [1,1,0,0,0,0|0,0,0]=2 404 B9R1.118 CC1(CCCCC1)CN Z1413780464 [1,1,0,0,0,0|1,0,1]=4 405 B9R1.118 CC1(CCCCC1)CO Z1201620047 [1,1,0,0,0,0|0,0,2]=4 406 B9R1.118 CC1(CCCCO1)C=O Z2178581866 [1,1,0,0,0,0|1,0,0]=3 407 B9R1.118 CC1(CCOCC1)C=O Z1255452107 [1,1,0,0,0,0|1,0,0]=3 408 B9R1.118 CC1(COCCO1)C=O Z3827418417 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.118 CCC1(CCCCC1)N Z2235790648 [1,1,0,0,0,0|1,0,1]=4 410 B9R1.118 CCC1(CCCCC1)O Z449370576 [1,1,0,0,0,0|1,0,1]=4 411 B9R1.118 CNC1(CCCCC1)C Z4646023133 [1,1,0,0,0,0|0,0,1]=3 412 B9R1.118 CNC1(CCOCC1)C Z3813478225 [1,1,0,0,0,0|1,0,1]=4 413 B9R1.118 N#CC1(CCCCC1)N Z56968513 [1,1,0,0,0,0|1,0,1]=4 414 B9R1.118 NC1(CCCCC1)CO Z2417556977 [1,1,0,0,0,0|0,0,2]=4 415 B9R1.118 NCC1(CCCCC1)Br Z1982417702 [1,1,0,0,0,0|1,0,1]=4 416 B9R1.118 NCC1(CCCCC1)N Z235344715 [1,1,0,0,0,0|1,0,1]=4 417 B9R1.118 NCC1(CCCCC1)O Z363991148 [1,1,0,0,0,0|1,0,1]=4 418 B9R1.118 O=CC1(CCCCC1)Br Z1255439614 [1,1,0,0,0,0|0,0,0]=2 419 B9R1.118 O=CC1(CCCCC1)Cl Z1251357068 [1,1,0,0,0,0|0,0,0]=2 420 B9R1.118 O=CC1(CCOCC1)Cl Z1511915339 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.11 CC(C=O)C1CCCC1 Z1268606342 [0,1,0,0,1,0|1,0,0]=3 422 B9R1.12 C#CCNC1CCCC1 Z90560641 [0,1,0,0,1,0|1,0,1]=4 423 B9R1.12 C=CCNC1CCCC1 Z607822410 [0,1,0,0,1,0|1,0,0]=3 424 B9R1.12 CCCNC1CCCC1 Z1076533152 [0,1,0,0,1,0|1,0,1]=4 425 B9R1.12 N#CCNC1CCCC1 Z235649030 [0,1,0,0,1,0|1,0,1]=4 426 B9R1.12 NCCNC1CCCC1 Z4158574763 [0,1,0,0,1,0|1,0,1]=4 427 B9R1.12 O=CCCC1CCCC1 Z993017672 [0,1,0,0,1,0|1,0,0]=3 428 B9R1.12 O=CCCC1CCCO1 Z993017666 [0,1,0,0,1,0|2,0,0]=4 429 B9R1.12 O=CCCC1CCOC1 Z1198305626 [0,1,0,0,1,0|2,0,0]=4 430 B9R1.12 OCCNC1CCCC1 Z1162448840 [0,1,0,0,1,0|0,0,2]=4 431 B9R1.13 CC(=O)CC1CCCO1 Z513734588 [0,1,0,0,1,0|2,0,0]=4 432 B9R1.13 CC(=O)CC1CCOC1 Z1321971717 [0,1,0,0,1,0|2,0,0]=4 433 B9R1.13 CC(=O)NC1CCCC1 Z32413858 [0,1,0,0,1,0|0,0,0]=2 434 B9R1.13 CC(=O)OC1CCNC1 Z1201627165 [0,1,0,0,1,0|2,0,0]=4 435 B9R1.13 CC(C)NC1CCCC1 Z316170330 [0,1,0,0,1,0|1,0,1]=4 436 B9R1.13 N=C(N)CC1CCCC1 Z2092177104 [0,1,0,0,1,0|2,0,0]=4 437 B9R1.13 NC(=NC1CCCC1)N Z1269638443 [0,1,0,0,1,0|1,0,1]=4 438 B9R1.13 NC(=O)C=C1CCCC1 Z741560360 [0,1,0,0,1,0|1,0,1]=4 439 B9R1.13 NC(=O)CC1CCCC1 Z33546662 [0,1,0,0,1,0|1,0,0]=3 440 B9R1.13 NC(=O)CC1CCCN1 Z1459435572 [0,1,0,0,1,0|2,0,0]=4 441 B9R1.13 NC(=O)CN1CCCC1 Z1184886892 [0,1,0,0,1,0|2,0,0]=4 442 B9R1.13 NC(=O)NC1CCCC1 Z56896930 [0,1,0,0,1,0|0,0,0]=2 443 B9R1.13 NC(=O)NC1CCNC1 Z1551475943 [0,1,0,0,1,0|1,0,0]=3 444 B9R1.13 O=C(O)C=C1CCCC1 Z352748244 [0,1,0,0,1,0|1,0,1]=4 445 B9R1.13 O=C(O)CC1CCCC1 Z104477042 [0,1,0,0,1,0|1,0,0]=3 446 B9R1.13 O=C(O)CC1CCCN1 Z1480642793 [0,1,0,0,1,0|2,0,0]=4 447 B9R1.13 O=C(O)CC1CCNC1 Z1863617764 [0,1,0,0,1,0|2,0,0]=4 448 B9R1.13 O=C(O)CC1CCOC1 Z825745916 [0,1,0,0,1,0|2,0,0]=4 449 B9R1.13 O=C(O)CN1CCCC1 Z197269292 [0,1,0,0,1,0|2,0,0]=4 450 B9R1.13 O=C(O)C[C@@H]1CCCO1 Z1862025858 [0,1,0,0,1,0|2,0,0]=4 451 B9R1.13 O=C(O)C[C@H]1CCOC1 Z1205495408 [0,1,0,0,1,0|2,0,0]=4 452 B9R1.33 C=CCC1CCCC1N Z993059006 [0,1,0,0,1,0|2,0,0]=4 453 B9R1.33 CCN[C@@H]1CCC[C@H]1O Z1796000613 [0,1,0,0,1,0|1,0,1]=4 454 B11R1.203 N#CCNC1CCCCCC1 Z267047340 [0,1,0,0,0,1|1,0,1]=4 455 B11R1.203 O=CNN=C1CCCCCC1 Z49645680 [0,1,0,0,0,1|0,0,1]=3 456 B11R1.203 OCCNC1CCCCCC1 Z1862093141 [0,1,0,0,0,1|0,0,2]=4 457 B11R1.742 CC(=O)CN1CCCCCC1 Z56041634 [0,1,0,0,0,1|2,0,0]=4 458 B11R1.742 CC(=O)NC1CCCCCC1 Z32452010 [0,1,0,0,0,1|0,0,0]=2 459 B11R1.742 NC(=O)CC1CCCCCC1 Z1262638694 [0,1,0,0,0,1|1,0,0]=3 460 B11R1.742 NC(=O)CC1CCCNCC1 Z1746998025 [0,1,0,0,0,1|1,0,0]=3 461 B11R1.742 NC(=O)CN1CCCNCC1 Z426041418 [0,1,0,0,0,1|2,0,0]=4 462 B11R1.742 NC(=O)NC1CCCNCC1 Z3613001386 [0,1,0,0,0,1|0,0,0]=2 463 B11R1.742 O=C(O)CC1CCCCCC1 Z352783664 [0,1,0,0,0,1|1,0,0]=3 464 B11R1.742 O=C(O)CC1CCCNCC1 Z2830496103 [0,1,0,0,0,1|1,0,0]=3 465 B11R1.742 O=C(O)CN1CCCCCC1 Z1171978829 [0,1,0,0,0,1|2,0,0]=4 466 B11R1.742 O=C(O)CN1CCCNCC1 Z1259161963 [0,1,0,0,0,1|2,0,0]=4 467 B11R1.20 CC(=O)NC1CCC(=O)CC1 Z235341209 [0,2,0,0,0,0|0,0,1]=3 468 B11R1.20 CC1CCC(=CC(=O)O)CC1 Z352748308 [0,2,0,0,0,0|1,0,1]=4 469 B11R1.20 CC1CCC(CC1)C[N+](=O)[O-] Z3271333405 [0,2,0,0,0,0|2,0,0]=4 470 B11R1.20 CC1CCN(CC1)CC(=O)N Z54847897 [0,2,0,0,0,0|2,0,0]=4 471 B11R1.20 CC1CCN(CC1)CC(=O)O Z197278060 [0,2,0,0,0,0|2,0,0]=4 472 B11R1.20 CN1CCC(CC1)CC(=O)O Z2524805848 [0,2,0,0,0,0|2,0,0]=4 473 B11R1.20 NC(=O)CN1CCC(CC1)O Z54505513 [0,2,0,0,0,0|2,0,0]=4 474 B11R1.20 NC(=O)NC1CCC(CC1)O Z198194888 [0,2,0,0,0,0|0,0,0]=2 475 B11R1.20 NC1CCC(CC1)CC(=O)O Z3243726577 [0,2,0,0,0,0|1,0,0]=3 476 B11R1.20 NC1CCN(CC1)CC(=O)O Z1762658240 [0,2,0,0,0,0|2,0,0]=4 477 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O Z1255418104 [0,2,0,0,0,0|1,0,0]=3 478 B11R1.20 O=C(O)CC1CCC(=O)CC1 Z1198235241 [0,2,0,0,0,0|1,0,1]=4 479 B11R1.20 O=C(O)CN1CCC(CC1)O Z744593184 [0,2,0,0,0,0|2,0,0]=4 480 B11R1.82 CC1(CCC(CC1)CC=O)C Z3242853298 [0,2,0,0,0,0|1,0,0]=3 481 B11R1.82 O=CCC1CCC(CC1)(F)F Z1511895455 [0,2,0,0,0,0|1,0,0]=3 482 B11R1.86 CC(=O)NC1CCCCC1C Z32972082 [0,2,0,0,0,0|0,0,0]=2 483 B11R1.86 CC1CCCCC1CC(=O)O Z352783476 [0,2,0,0,0,0|1,0,0]=3 484 B11R1.86 CC1CCCCC1NC(=O)N Z56985817 [0,2,0,0,0,0|0,0,0]=2 485 B11R1.86 CC1CCCCN1CC(=O)N Z54751033 [0,2,0,0,0,0|2,0,0]=4 486 B11R1.86 CC1CCNCC1CC(=O)O Z2515281558 [0,2,0,0,0,0|2,0,0]=4 487 B11R1.86 CN1CCCCC1CC(=O)O Z2106602368 [0,2,0,0,0,0|2,0,0]=4 488 B11R1.86 NC1CCOCC1CC(=O)O Z2732475544 [0,2,0,0,0,0|2,0,0]=4 489 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Z2235791115 [0,2,0,0,0,0|1,0,0]=3 490 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O Z1262514098 [0,2,0,0,0,0|1,0,0]=3 491 B11R1.157 CC1CCCC(C1)CC(=O)O Z352783434 [0,2,0,0,0,0|1,0,0]=3 492 B11R1.157 CC1CCCN(C1)CC(=O)N Z54749656 [0,2,0,0,0,0|2,0,0]=4 493 B11R1.157 CC1CNCC(C1)CC(=O)O Z2235790824 [0,2,0,0,0,0|2,0,0]=4 494 B11R1.157 CN1CCCC(C1)CC(=O)O Z2310699362 [0,2,0,0,0,0|2,0,0]=4 495 B11R1.157 C[C@@H]1CCC[C@@H](O1)CC(=O)O Z4946669801 [0,2,0,0,0,0|2,0,0]=4 496 B11R1.157 NC(=O)CC1CCCC(C1)N Z4439100400 [0,2,0,0,0,0|1,0,0]=3 497 B11R1.157 NC(=O)CN1CCCC(C1)N Z803145266 [0,2,0,0,0,0|2,0,0]=4 498 B11R1.157 NC1CCCC(C1)CC(=O)O Z5087190945 [0,2,0,0,0,0|1,0,0]=3 499 B11R1.157 NC1CCOC(C1)CC(=O)O Z4579787506 [0,2,0,0,0,0|2,0,0]=4 500 B11R1.157 O=C(O)CC1CCCC(=O)C1 Z907709938 [0,2,0,0,0,0|1,0,1]=4 501 B11R1.157 O=C(O)CC1CCCC(C1)O Z1262524441 [0,2,0,0,0,0|1,0,0]=3 502 B11R1.342 CC1(CC(CCO1)CC=O)C Z1511783289 [0,2,0,0,0,0|2,0,0]=4 503 B11R1.342 CC1(CCCC(C1)CC=O)C Z1198149195 [0,2,0,0,0,0|1,0,0]=3 504 B11R1.7 C=CS(=O)(=O)C1CCCCC1 Z1041705242 [0,2,0,0,0,0|2,0,0]=4 505 B11R1.7 CC(C)(C=O)C1CCCCO1 Z2755013959 [0,2,0,0,0,0|2,0,0]=4 506 B11R1.7 CC(C)(C=O)C1CCOCC1 Z1255445661 [0,2,0,0,0,0|2,0,0]=4 507 B11R1.12 COC(C=O)C1CCCCC1 Z1511788569 [0,2,0,0,0,0|1,0,0]=3 508 B11R1.12 COC(C=O)C1CCOCC1 Z2217101712 [0,2,0,0,0,0|2,0,0]=4 509 B11R1.16 C#CCN(C)C1CCCCC1 Z2274815423 [0,2,0,0,0,0|1,0,1]=4 510 B11R1.16 CN(CCN)C1CCCCC1 Z425389760 [0,2,0,0,0,0|1,0,1]=4 511 B11R1.16 CN(CCO)C1CCCCC1 Z159528828 [0,2,0,0,0,0|0,0,2]=4 512 B11R1.16 O=C(/C=C/[O-])C1CCCCC1 Z1147577711 [0,2,0,0,0,0|1,0,1]=4 513 B11R1.36 CC(=O)C(C)C1CCCCC1 Z1255356497 [0,2,0,0,0,0|1,0,0]=3 514 B11R1.36 CC(=O)N(C)C1CCNCC1 Z1259341005 [0,2,0,0,0,0|1,0,0]=3 515 B11R1.36 CC(C(=O)N)N1CCCCC1 Z103698666 [0,2,0,0,0,0|2,0,0]=4 516 B11R1.36 CC(C(=O)O)C1CCNCC1 Z3244908692 [0,2,0,0,0,0|2,0,0]=4 517 B11R1.36 CC(C(=O)O)C1CCOCC1 Z1262520886 [0,2,0,0,0,0|2,0,0]=4 518 B11R1.36 CC(C(=O)O)N1CCCCC1 Z1172068155 [0,2,0,0,0,0|2,0,0]=4 519 B11R1.36 NC(=O)C(O)C1CCOCC1 Z979770898 [0,2,0,0,0,0|2,0,0]=4 520 B11R1.36 NC(C(=O)O)C1CCCCC1 Z752370756 [0,2,0,0,0,0|1,0,0]=3 521 B11R1.36 NC(C(=O)O)C1CCOCC1 Z2895181969 [0,2,0,0,0,0|2,0,0]=4 522 B11R1.36 O=C(O)C(F)C1CCNCC1 Z2733346658 [0,2,0,0,0,0|2,0,0]=4 523 B11R1.36 O=C(O)C(O)C1CCCCC1 Z788000630 [0,2,0,0,0,0|1,0,0]=3 524 B11R1.36 O=C(O)C(O)C1CCCNC1 Z1964357511 [0,2,0,0,0,0|2,0,0]=4 525 B11R1.36 O=C(O)C(O)C1CCNCC1 Z3045554278 [0,2,0,0,0,0|2,0,0]=4 526 B11R1.28 CCCCNC1CCCCC1 Z2218556189 [0,2,0,0,0,0|1,0,1]=4 527 B11R1.28 CCCNCC1CCCCC1 Z57170999 [0,2,0,0,0,0|1,0,1]=4 528 B11R1.28 COCCNC1CCCCC1 Z90501874 [0,2,0,0,0,0|0,0,2]=4 529 B11R1.28 O=CNCCN1CCOCC1 Z1258521081 [0,2,0,0,0,0|2,0,0]=4 530 B11R1.28 OCCCNC1CCCCC1 Z3504619196 [0,2,0,0,0,0|0,0,2]=4 531 B11R1.28 OCCNCC1CCCCC1 Z90504645 [0,2,0,0,0,0|0,0,2]=4 532 B11R1.40 C=CC(=O)NC1CC=CCC1 Z1267813413 [0,2,0,0,0,0|0,0,2]=4 533 B11R1.40 C=CC(=O)NC1CCCOC1 Z1126746439 [0,2,0,0,0,0|1,0,0]=3 534 B11R1.40 C=CC(=O)NC1CCCSC1 Z1711756544 [0,2,0,0,0,0|1,0,0]=3 535 B11R1.40 C=CC(=O)NC1CCOCC1 Z440635228 [0,2,0,0,0,0|1,0,0]=3 536 B11R1.40 C=CC(=O)NC1CCSCC1 Z1711756626 [0,2,0,0,0,0|1,0,0]=3 537 B11R1.40 C=CC(=O)N[C@@H]1CC=CCC1 Z4187333436 [0,2,0,0,0,0|0,0,2]=4 538 B11R1.40 C=CC(=O)N[C@@H]1CCCOC1 Z3326590186 [0,2,0,0,0,0|1,0,0]=3 539 B11R1.40 C=CC(=O)N[C@H]1CC=CCC1 Z4379715106 [0,2,0,0,0,0|0,0,2]=4 540 B11R1.40 C=CC(=O)N[C@H]1CCCOC1 Z3326590196 [0,2,0,0,0,0|1,0,0]=3 541 B11R1.40 CC(C=O)CC1CCCCC1 Z1238838137 [0,2,0,0,0,0|1,0,0]=3 542 B11R1.40 CC(C=O)CC1CCOCC1 Z1238838084 [0,2,0,0,0,0|2,0,0]=4 543 B11R1.40 CCC(=O)CC1CCCCC1 Z992965580 [0,2,0,0,0,0|1,0,0]=3 544 B11R1.40 CCC(=O)NC1CCCNC1 Z285140980 [0,2,0,0,0,0|1,0,0]=3 545 B11R1.40 CCC(=O)NC1CCNCC1 Z426041554 [0,2,0,0,0,0|1,0,0]=3 546 B11R1.40 CCC(=O)N[C@H]1CCCNC1 Z1251352778 [0,2,0,0,0,0|1,0,0]=3 547 B11R1.40 CNC(=N)NC1CCCCC1 Z1347691727 [0,2,0,0,0,0|1,0,0]=3 548 B11R1.40 CNC(=O)CC1CCNCC1 Z300071370 [0,2,0,0,0,0|2,0,0]=4 549 B11R1.40 CNC(=O)NC1CCCNC1 Z2831686475 [0,2,0,0,0,0|1,0,0]=3 550 B11R1.40 CNC(=O)NC1CCNCC1 Z1255363290 [0,2,0,0,0,0|1,0,0]=3 551 B11R1.40 CNC(=O)OC1CCNCC1 Z4461667317 [0,2,0,0,0,0|2,0,0]=4 552 B11R1.40 COC(=O)CC1CCOCC1 Z1198266999 [0,2,0,0,0,0|2,0,0]=4 553 B11R1.40 COC(=O)CC1CCSCC1 Z1426217133 [0,2,0,0,0,0|2,0,0]=4 554 B11R1.40 COC(=O)C[C@@H]1CCCNC1 Z1198161509 [0,2,0,0,0,0|2,0,0]=4 555 B11R1.40 NCC(=O)CC1CCCCC1 Z2756265233 [0,2,0,0,0,0|1,0,0]=3 556 B11R1.40 NCC(=O)NC1CCCCC1 Z939944692 [0,2,0,0,0,0|0,0,0]=2 557 B11R1.40 NCC(=O)OC1CCCCC1 Z1333043376 [0,2,0,0,0,0|1,0,0]=3 558 B11R1.40 NNC(=O)CC1CCCCC1 Z58982701 [0,2,0,0,0,0|1,0,0]=3 559 B11R1.40 NNC(=O)NC1CCCCC1 Z56838483 [0,2,0,0,0,0|0,0,0]=2 560 B11R1.40 NNC(=S)NC1CCCCC1 Z56840612 [0,2,0,0,0,0|0,1,0]=3 561 B11R1.40 O=C(CCl)CC1CCCCC1 Z1255500367 [0,2,0,0,0,0|1,0,0]=3 562 B11R1.40 O=C(CCl)CC1CCOCC1 Z3579547101 [0,2,0,0,0,0|2,0,0]=4 563 B11R1.40 O=C(CCl)NC1CCCCC1 Z56896331 [0,2,0,0,0,0|0,0,0]=2 564 B11R1.40 O=C(CCl)NC1CCOCC1 Z440609270 [0,2,0,0,0,0|1,0,0]=3 565 B11R1.91 CC(=O)/C=C/C1CCCCC1 Z1217226894 [0,2,0,0,0,0|1,0,0]=3 566 B11R1.91 CC(=O)CCC1CCCCC1 Z406376884 [0,2,0,0,0,0|1,0,0]=3 567 B11R1.91 CC(=O)NCC1CCCCN1 Z1456490747 [0,2,0,0,0,0|1,0,0]=3 568 B11R1.91 CC(=O)NCC1CCCNC1 Z285140846 [0,2,0,0,0,0|1,0,0]=3 569 B11R1.91 CC(=O)NCC1CCNCC1 Z425484868 [0,2,0,0,0,0|1,0,0]=3 570 B11R1.91 CC(=O)NCC1CNCCO1 Z439694282 [0,2,0,0,0,0|2,0,0]=4 571 B11R1.91 CC(=O)OCC1CCCNC1 Z1201627162 [0,2,0,0,0,0|2,0,0]=4 572 B11R1.91 CC(=O)OCC1CCNCC1 Z1201627163 [0,2,0,0,0,0|2,0,0]=4 573 B11R1.91 CC(C)CNC1CCCCC1 Z1259341026 [0,2,0,0,0,0|1,0,1]=4 574 B11R1.91 CC(O)CNC1CCCCC1 Z90526999 [0,2,0,0,0,0|0,0,2]=4 575 B11R1.91 N=C(N)NCC1CCCCC1 Z991126698 [0,2,0,0,0,0|1,0,0]=3 576 B11R1.91 NC(=O)CCC1CCCCC1 Z33547070 [0,2,0,0,0,0|1,0,0]=3 577 B11R1.91 NC(=O)CCC1CCCNC1 Z852089132 [0,2,0,0,0,0|2,0,0]=4 578 B11R1.91 NC(=O)CCC1CCNCC1 Z963586266 [0,2,0,0,0,0|2,0,0]=4 579 B11R1.91 NC(=O)COC1CCNCC1 Z1702888512 [0,2,0,0,0,0|2,0,0]=4 580 B11R1.91 NC(=O)NCC1CCCCC1 Z198194728 [0,2,0,0,0,0|0,0,0]=2 581 B11R1.91 NC(=O)NCC1CCCNC1 Z285141404 [0,2,0,0,0,0|1,0,0]=3 582 B11R1.91 NC(=O)NCC1CCNCC1 Z444350016 [0,2,0,0,0,0|1,0,0]=3 583 B11R1.91 NC(=O)NCC1COCCO1 Z732184864 [0,2,0,0,0,0|2,0,0]=4 584 B11R1.91 NC(=S)NN=C1CCCCC1 Z49561637 [0,2,0,0,0,0|0,1,1]=4 585 B11R1.91 O=C(O)/C=C/C1CCCCC1 Z975822798 [0,2,0,0,0,0|1,0,0]=3 586 B11R1.91 O=C(O)/C=C/C1CCOCC1 Z979767036 [0,2,0,0,0,0|2,0,0]=4 587 B11R1.91 O=C(O)C#CC1CCCCO1 Z1235951021 [0,2,0,0,0,0|2,0,0]=4 588 B11R1.91 O=C(O)C#CC1CCCNC1 Z2492804071 [0,2,0,0,0,0|2,0,0]=4 589 B11R1.91 O=C(O)C#CC1CCNCC1 Z2442061999 [0,2,0,0,0,0|2,0,0]=4 590 B11R1.91 O=C(O)C#CC1CCOCC1 Z1235950906 [0,2,0,0,0,0|2,0,0]=4 591 B11R1.91 O=C(O)CCC1CCCCC1 Z104479892 [0,2,0,0,0,0|1,0,0]=3 592 B11R1.91 O=C(O)CCC1CCCCN1 Z1526503392 [0,2,0,0,0,0|2,0,0]=4 593 B11R1.91 O=C(O)CCC1CCCCO1 Z1167042736 [0,2,0,0,0,0|2,0,0]=4 594 B11R1.91 O=C(O)CCC1CCCNC1 Z839027062 [0,2,0,0,0,0|2,0,0]=4 595 B11R1.91 O=C(O)CCC1CCCOC1 Z1154555237 [0,2,0,0,0,0|2,0,0]=4 596 B11R1.91 O=C(O)CCC1CCNCC1 Z364250128 [0,2,0,0,0,0|2,0,0]=4 597 B11R1.91 O=C(O)CCC1CCOCC1 Z979765670 [0,2,0,0,0,0|2,0,0]=4 598 B11R1.91 O=C(O)CCN1CCCCC1 Z744843478 [0,2,0,0,0,0|2,0,0]=4 599 B11R1.91 O=C(O)CNC1CCCCC1 Z1259273154 [0,2,0,0,0,0|0,0,0]=2 600 B11R1.91 O=C(O)CNC1CCNCC1 Z1694636318 [0,2,0,0,0,0|1,0,0]=3 601 B11R1.91 O=C(O)COC1CCCCC1 Z316258722 [0,2,0,0,0,0|1,0,0]=3 602 B11R1.91 O=C(O)COC1CCCOC1 Z1898756150 [0,2,0,0,0,0|2,0,0]=4 603 B11R1.91 O=C(O)COC1CCNCC1 Z1511483985 [0,2,0,0,0,0|2,0,0]=4 604 B11R1.91 O=C(O)COC1CCOCC1 Z802587584 [0,2,0,0,0,0|2,0,0]=4 605 B11R1.91 O=C(O)CSC1CCCCO1 Z1262516824 [0,2,0,0,0,0|2,0,0]=4 606 B11R1.509 CS(=O)(=O)NC1CCCNC1 Z285141572 [0,2,0,0,0,0|2,0,0]=4 607 B11R1.509 CS(=O)(=O)NC1CCNCC1 Z204013886 [0,2,0,0,0,0|2,0,0]=4 608 B11R1.509 NS(=O)(=O)CC1CCCCC1 Z734461532 [0,2,0,0,0,0|2,0,0]=4 609 B11R1.509 NS(=O)(=O)NC1CCNCC1 Z2689031650 [0,2,0,0,0,0|2,0,0]=4 610 B11R1.509 NS(=O)(=O)NC1CCOCC1 Z741768586 [0,2,0,0,0,0|2,0,0]=4 611 B11R1.509 O=S(=O)(F)CC1CCCCC1 Z991753780 [0,2,0,0,0,0|2,0,0]=4 612 B11R1.928 CC(=O)NC1(CCNCC1)C Z3689602976 [0,2,0,0,0,0|1,0,0]=3 613 B11R1.928 CC1(CCCCC1)CC(=O)O Z1255466882 [0,2,0,0,0,0|1,0,0]=3 614 B11R1.928 CC1(CCNCC1)CC(=O)O Z5590137993 [0,2,0,0,0,0|2,0,0]=4 615 B11R1.928 NC(=O)CC1(CCCCC1)N Z2941400913 [0,2,0,0,0,0|1,0,0]=3 616 B11R1.928 NC(=O)CC1(CCOCC1)N Z1335657666 [0,2,0,0,0,0|2,0,0]=4 617 B11R1.928 NC1(CCCCC1)CC(=O)O Z1741975256 [0,2,0,0,0,0|1,0,0]=3 618 B11R1.928 NC1(CCNCC1)CC(=O)O Z1624323979 [0,2,0,0,0,0|2,0,0]=4 619 B11R1.928 NC1(CCOCC1)CC(=O)O Z2255110164 [0,2,0,0,0,0|2,0,0]=4 620 B11R1.928 O=C(O)CC1(CCCCC1)O Z982131964 [0,2,0,0,0,0|1,0,0]=3 621 B11R1.928 O=C(O)CC1(CCNCC1)O Z3488912123 [0,2,0,0,0,0|2,0,0]=4 622 B11R1.928 O=C(O)CC1(CCOCC1)O Z982132196 [0,2,0,0,0,0|2,0,0]=4 623 B11R1.1253 C=CCC1(CCCCC1)C=O Z1255403854 [0,2,0,0,0,0|2,0,0]=4 624 B9R1.48 CC1COCCC(=O)N1 Z1203833663 [0,0,1,1,0,0|1,0,0]=3 625 B9R1.50 CC1CCCCCCN1 Z3487835965 [0,0,1,1,0,0|1,0,1]=4 626 B9R1.69 CC1CCC(C(=O)C1)C Z1238548176 [0,0,1,1,0,0|1,0,0]=3 627 B9R1.69 CC1CCC(C(=O)N1)C Z1203817414 [0,0,1,1,0,0|0,0,0]=2 628 B9R1.5 CC1CCCCNC1=O Z1198181151 [0,0,1,1,0,0|0,0,0]=2 629 B9R1.5 CC1NCCCNC1=O Z1203829873 [0,0,1,1,0,0|1,0,0]=3 630 B9R1.5 NC1CCCCCC1=O Z2213893401 [0,0,1,1,0,0|2,0,0]=4 631 B9R1.5 NC1CCCCNC1=O Z281895050 [0,0,1,1,0,0|1,0,0]=3 632 B9R1.5 O=C1CCCCCC1Cl Z223607164 [0,0,1,1,0,0|2,0,0]=4 633 B9R1.5 O=C1NCCCCC1Br Z220343714 [0,0,1,1,0,0|1,0,0]=3 634 B9R1.16 CC1CC1CCCC=O Z3271342479 [0,0,1,1,0,0|1,0,0]=3 635 B9R1.83 O=CCCCCC1CC1 Z3002702510 [0,0,1,1,0,0|1,0,0]=3 636 B9R1.83 O=CCCOCC1CC1 Z1080366652 [0,0,1,1,0,0|2,0,0]=4 637 B9R1.89 CCC1CCCNCC1 Z425362302 [0,0,1,1,0,0|1,0,1]=4 638 B9R1.89 O=CC1=CCCCCC1 Z1190318867 [0,0,1,1,0,0|1,0,1]=4 639 B9R1.89 O=CC1CCCCCC1 Z1079442748 [0,0,1,1,0,0|1,0,0]=3 640 B9R1.89 O=CC1CCCOCC1 Z1268606450 [0,0,1,1,0,0|2,0,0]=4 641 B9R1.89 O=CN1CCCNCC1 Z104510266 [0,0,1,1,0,0|1,0,0]=3 642 B9R1.103 C1CCCCNCCC1 Z1203730912 [0,0,1,1,0,0|1,0,1]=4 643 B9R1.23 CCC1CC(C(=O)N1)C Z1203824349 [0,0,1,1,0,0|0,0,0]=2 644 B9R2.47 O=CC1CC2CC2C1 Z1407035097 [1,0,0,1,0,0|0,0,0]=2 645 B9R2.49 C1CC2CCC1NN2 Z2301499854 [1,0,0,1,0,0|1,0,0]=3 646 B9R2.49 C1CC2CCC1NO2 Z2712744350 [1,0,0,1,0,0|0,0,1]=3 647 B9R2.49 C1CC2CNC1CN2 Z2301438463 [1,0,0,1,0,0|1,0,1]=4 648 B9R2.50 C1CC[C@H]2NC[C@H]2C1 Z2309997705 [1,0,0,1,0,0|0,0,1]=3 649 B9R2.56 NC[C@@]12CCC[C@@H]1C2 Z2896171841 [1,0,0,1,0,0|1,0,1]=4 650 B9R2.56 O=C[C@@]12CCC[C@@H]1C2 Z2900769719 [1,0,0,1,0,0|0,0,0]=2 651 B9R2.65 NCC1C2C1CCC2 Z3676755604 [1,0,0,1,0,0|1,0,1]=4 652 B9R2.65 O=CC1C2C1CCC2 Z1464130480 [1,0,0,1,0,0|0,0,0]=2 653 B9R2.65 O=CC1C2C1COC2 Z1511806975 [1,0,0,1,0,0|1,0,0]=3 654 B9R2.65 O=C[C@@H]1[C@@H]2[C@H]1COC2 Z1511809905 [1,0,0,1,0,0|1,0,0]=3 655 B9R2.68 C1NC2COCC1C2 Z4789051337 [1,0,0,1,0,0|1,0,1]=4 656 B9R2.68 C1NC2CSCC1C2 Z5013438049 [1,0,0,1,0,0|1,0,1]=4 657 B9R2.68 C1NCC2CC1CN2 Z3491361794 [1,0,0,1,0,0|1,0,1]=4 658 B9R2.123 NC1C2C1CCCC2 Z1335657662 [1,0,0,1,0,0|1,0,1]=4 659 B9R2.174 C1CCC2(CC1)CO2 Z359231458 [1,0,0,1,0,0|0,0,2]=4 660 B9R2.3 C1CC2CCNC2C1 Z1201627727 [0,0,0,1,1,0|1,0,1]=4 661 B9R2.7 O=C1NC2C1CCC2 Z1250169685 [0,0,0,1,1,0|0,0,0]=2 662 B9R2.7 O=C1N[C@H]2[C@@H]1CCC2 Z2307158154 [0,0,0,1,1,0|0,0,0]=2 663 B9R2.39 O=C1NC2CCC1C2 Z1238833321 [0,0,0,1,1,0|0,0,0]=2 664 B11R2.232 CCN1C2CCC1CNC2 Z2867580639 [0,0,0,1,0,1|1,0,1]=4 665 B11R2.711 O=C1NC2C1CCCCC2 Z1203733441 [0,0,0,1,0,1|0,0,0]=2 666 B11R2.1037 C1CCN2CCNC(C1)C2 Z3268388583 [0,0,0,1,0,1|1,0,1]=4 667 B11R2.1387 O=CC1C2C1CCCCC2 Z1511825784 [0,0,0,1,0,1|1,0,0]=3 668 B11R2.164 O=CC1CC2CCC1CC2 Z1511766105 [0,1,0,1,0,0|1,0,0]=3 669 B11R2.357 O=C1CCC2CCCN1C2 Z1509062698 [0,1,0,1,0,0|2,0,0]=4 670 B11R2.357 O=C1CCC2CCNC1C2 Z3013817851 [0,1,0,1,0,0|2,0,0]=4 671 B11R2.357 O=C1NCC2CCCC1N2 Z3487940635 [0,1,0,1,0,0|1,0,0]=3 672 B11R2.357 OC1CCC2CCNC1C2 Z2238768422 [0,1,0,1,0,0|1,0,1]=4 673 B11R2.357 O[C@@H]1CC[C@H]2CCN[C@H]1C2 Z3063687175 [0,1,0,1,0,0|1,0,1]=4 674 B11R2.679 CC12CCN(CC1)CC2=O Z5185415087 [0,1,0,1,0,0|2,0,0]=4 675 B11R2.10 CC1CC2CCCCC2N1 Z1171508994 [0,1,0,1,0,0|1,0,1]=4 676 B11R2.10 O=C1C[C@@H]2CCNC[C@@H]2N1 Z2941409830 [0,1,0,1,0,0|1,0,0]=3 677 B11R2.10 O=C1C[C@@H]2NCCC[C@@H]2N1 Z2568671488 [0,1,0,1,0,0|1,0,0]=3 678 B11R2.10 O=C1NC2=C(S1)CCCC2 Z409413532 [0,1,0,1,0,0|0,0,2]=4 679 B11R2.10 O=C1N[C@@H]2CCNC[C@@H]2O1 Z3486109396 [0,1,0,1,0,0|1,0,0]=3 680 B11R2.10 O=C1N[C@H]2CCCC[C@H]2N1 Z3227128710 [0,1,0,1,0,0|0,0,0]=2 681 B11R2.10 O=C1OC2CCCCC2O1 Z1201621064 [0,1,0,1,0,0|1,0,0]=3 682 B11R2.10 S=C1NC2CCCCC2N1 Z56928968 [0,1,0,1,0,0|0,1,0]=3 683 B11R2.20 C1CCC2CNCCC2C1 Z3492354682 [0,1,0,1,0,0|1,0,1]=4 684 B11R2.20 C1CCC2NCCNC2C1 Z1184886650 [0,1,0,1,0,0|1,0,1]=4 685 B11R2.20 C1CCC2OCCNC2C1 Z397586840 [0,1,0,1,0,0|0,0,2]=4 686 B11R2.20 C1CCC2SCCNC2C1 Z1218937242 [0,1,0,1,0,0|0,1,1]=4 687 B11R2.20 C1CC[C@H]2NCCC[C@H]2C1 Z1203731004 [0,1,0,1,0,0|1,0,1]=4 688 B11R2.68 CC1CCC2CC1NC2=O Z1203749581 [0,1,0,1,0,0|0,0,0]=2 689 B11R2.120 CN1C2CCCC1C(=O)C2 Z5626300430 [0,1,0,1,0,0|2,0,0]=4 690 B11R2.118 O=C1CC2CCC1C(=O)N2 Z1203824229 [0,1,0,1,0,0|0,0,1]=3 691 B11R2.678 N[C@H]1C[C@@H]2C=CC[C@H](C1)C2 Z5055332020 [0,1,0,1,0,0|2,0,0]=4 692 B11R2.678 O=C1CC2CCCC(C1)C2 Z1255416520 [0,1,0,1,0,0|1,0,0]=3 693 B11R2.678 O=C1CC2CCCC(C1)N2 Z1262564614 [0,1,0,1,0,0|2,0,0]=4 694 B11R2.1 CC1CNC2C1CCCC2 Z1202249435 [0,1,0,1,0,0|1,0,1]=4 695 B11R2.1 O=C1NCC2N1CCNC2 Z1357823882 [0,1,0,1,0,0|2,0,0]=4 696 B11R2.1 O=C1NC[C@@H]2[C@H]1CCCN2 Z1968124423 [0,1,0,1,0,0|1,0,0]=3 697 B11R2.1 O=C1NC[C@H]2[C@@H]1CCCC2 Z2307208665 [0,1,0,1,0,0|0,0,0]=2 698 B11R2.1 O=C1NC[C@H]2[C@@H]1CCCN2 Z3379440575 [0,1,0,1,0,0|1,0,0]=3 699 B11R2.1 O=C1NN=C2N1CCCC2 Z1020851196 [0,1,0,1,0,0|1,0,1]=4 700 B11R2.1 O=C1OCC2C1CCNC2 Z4438428292 [0,1,0,1,0,0|2,0,0]=4 701 B11R2.12 O=C1NCC12CCCOC2 Z2865012678 [0,1,0,1,0,0|1,0,0]=3 702 B11R2.13 O=CC1CC12CCCCC2 Z1511870834 [0,1,0,1,0,0|1,0,0]=3 703 B11R2.13 O=CC1CC12CCCOC2 Z3243445308 [0,1,0,1,0,0|2,0,0]=4 704 B11R2.13 O=CC1CC12CCOCC2 Z1999520977 [0,1,0,1,0,0|2,0,0]=4 705 B11R2.367 CC1C(=O)C2CCN1CC2 Z4371528740 [0,1,0,1,0,0|2,0,0]=4 706 B11R2.238 C1CCC(CC1)NC2CC2 Z803145598 [0,1,0,1,0,0|1,0,1]=4 707 B11R2.1261 C1=CC2(CCOCC2)NC1 Z3717234411 [0,1,0,1,0,0|2,0,0]=4 708 B11R2.1261 C1CCC2(CC1)CCCN2 Z1526503348 [0,1,0,1,0,0|1,0,1]=4 709 B11R2.1261 C1CCC2(CC1)CCNC2 Z979421238 [0,1,0,1,0,0|1,0,1]=4 710 B11R2.1261 C1CCC2(CC1)NCCS2 Z2017679672 [0,1,0,1,0,0|0,1,1]=4 711 B11R2.703 O=C1CC2(N1)CCCCC2 Z1238837545 [0,1,0,1,0,0|0,0,0]=2 712 B11R2.703 O=C1CC2(N1)CCNCC2 Z2143572749 [0,1,0,1,0,0|1,0,0]=3 713 B11R2.703 O=C1CC2(N1)CCOCC2 Z1238837683 [0,1,0,1,0,0|1,0,0]=3 714 B11R2.932 O=C(O)CC1CCC2C1C2 Z1509040790 [0,1,0,1,0,0|1,0,0]=3 715 B11R2.934 O=C(O)CN1CC2CC2C1 Z3377864519 [0,1,0,1,0,0|2,0,0]=4 716 B11R2.1824 O=C(O)[C@H]1[C@H]2CNC[C@@H]1C2 Z5354305391 [0,1,0,1,0,0|2,0,0]=4 717 B11R2.1852 O=C(O)[C@@H]1[C@@H]2[C@H]1OCCC2 Z3002935457 [0,1,0,1,0,0|2,0,0]=4 718 B11R2.1852 O=C(O)[C@H]1[C@@H]2[C@H]1CCNC2 Z4605254163 [0,1,0,1,0,0|2,0,0]=4 719 B11R2.696 CC12CCC(CC1)C(=O)O2 Z5185201929 [0,1,0,1,0,0|1,0,0]=3 720 B11R3.19 O=C1NC2CC1C3C2C3 Z1509037889 [0,0,0,2,0,0|0,0,0]=2 721 B7R1.1 CNC1CCCC1 Z102766802 [1,0,0,0,1,0|0,0,1]=3 722 B7R1.1 CNC1CCOC1 Z1079260566 [1,0,0,0,1,0|1,0,1]=4 723 B7R1.1 CNC1CCSC1 Z102767000 [1,0,0,0,1,0|1,0,1]=4 724 B7R1.1 N#CC1CCCC1 Z285131394 [1,0,0,0,1,0|1,0,1]=4 725 B7R1.1 NCC1CCCC1 Z367452206 [1,0,0,0,1,0|1,0,1]=4 726 B7R1.1 NNC1CCCC1 Z285139110 [1,0,0,0,1,0|1,0,0]=3 727 B7R1.1 O=CC1=CCCC1 Z1190318866 [1,0,0,0,1,0|0,0,2]=4 728 B7R1.1 O=CC1CC=CC1 Z1504676872 [1,0,0,0,1,0|0,0,2]=4 729 B7R1.1 O=CC1CCCC1 Z875036058 [1,0,0,0,1,0|0,0,0]=2 730 B7R1.1 O=CC1CCOC1 Z199056102 [1,0,0,0,1,0|1,0,0]=3 731 B7R1.1 O=CC1CCSC1 Z1201681645 [1,0,0,0,1,0|1,0,0]=3 732 B7R1.1 O=CN1CCCC1 Z1255394997 [1,0,0,0,1,0|1,0,0]=3 733 B7R1.1 OCC1CCCC1 Z397587414 [1,0,0,0,1,0|0,0,2]=4 734 B7R1.6 CCNC1CCC1 Z2144245483 [0,0,0,0,2,0|1,0,1]=4 735 B7R1.6 O=CCC1CCC1 Z1198184444 [0,0,0,0,2,0|1,0,0]=3 736 B7R1.6 O=CCC1COC1 Z1511884358 [0,0,0,0,2,0|2,0,0]=4