0 B9R0.45 CCCCCCCCCO Z104476100 [0,0,0,0,0,0|1,1,0]=2 1 B9R0.45 CCCCCCCNC=O Z1203732044 [0,0,0,0,0,0|2,1,1]=4 2 B9R0.45 CCCCCCNCCO Z137800948 [0,0,0,0,0,0|2,1,0]=3 3 B9R0.45 CCCCOCCCCO Z993012624 [0,0,0,0,0,0|2,1,0]=3 4 B9R0.45 COCCOCCCCN Z285178626 [0,0,0,0,0,0|4,0,0]=4 5 B9R0.45 NCCCCCCCCN Z1203577927 [0,0,0,0,0,0|2,0,0]=2 6 B9R0.45 NCCCCCCCCO Z4745386600 [0,0,0,0,0,0|1,1,0]=2 7 B9R0.45 NCCSCCSCCN Z2740753669 [0,0,0,0,0,0|4,0,0]=4 8 B9R0.45 OCCCCCOCCO Z1897250794 [0,0,0,0,0,0|1,2,0]=3 9 B9R0.45 OCCOCCOCCF Z1618124684 [0,0,0,0,0,0|3,1,0]=4 10 B9R0.45 OCCOCCOCCO Z104476078 [0,0,0,0,0,0|2,2,0]=4 11 B9R0.45 OCCOCCSCCO Z756091788 [0,0,0,0,0,0|2,2,0]=4 12 B8R0.4 C#CCCCCCCN Z3847490647 [1,0,0,0,0,0|1,0,2]=4 13 B8R0.4 C#CCCCCCCO Z1198157198 [1,0,0,0,0,0|0,1,2]=4 14 B8R0.4 C=CCCCCCCN Z1198263320 [1,0,0,0,0,0|1,0,2]=4 15 B8R0.4 CCCCCCCCO Z104473500 [1,0,0,0,0,0|0,1,0]=2 16 B8R0.4 CCCCCNCCO Z137800944 [1,0,0,0,0,0|1,1,0]=3 17 B8R0.4 CCCCNCCCC Z102766286 [1,0,0,0,0,0|2,0,0]=3 18 B8R0.4 CCCCNCCCO Z102766210 [1,0,0,0,0,0|1,1,0]=3 19 B8R0.4 CCNCCOCCN Z1323539868 [1,0,0,0,0,0|3,0,0]=4 20 B8R0.4 CCOCCOCCN Z2900987685 [1,0,0,0,0,0|3,0,0]=4 21 B8R0.4 COCCCNCCO Z382722010 [1,0,0,0,0,0|2,1,0]=4 22 B8R0.4 COCCNCCCN Z970105370 [1,0,0,0,0,0|3,0,0]=4 23 B8R0.4 COCCOCCCO Z1080358808 [1,0,0,0,0,0|2,1,0]=4 24 B8R0.4 NCCCCCCCN Z275166586 [1,0,0,0,0,0|2,0,0]=3 25 B8R0.4 NCCCCCCCO Z3016956569 [1,0,0,0,0,0|1,1,0]=3 26 B8R0.4 NCCCNCCCN Z1203577926 [1,0,0,0,0,0|3,0,0]=4 27 B8R0.4 OCCCNCCCO Z104684334 [1,0,0,0,0,0|1,2,0]=4 28 B10R0.1 CCCCCNC(C)CCC Z138670752 [0,1,0,0,0,0|3,0,0]=4 29 B10R0.4 CCCCCCCCC(=O)N Z296759818 [0,1,0,0,0,0|1,1,1]=4 30 B10R0.4 CCCCCCCCC(=O)O Z104473336 [0,1,0,0,0,0|1,1,1]=4 31 B10R0.4 CCCCCCCCS(=O)C Z1198155780 [0,1,0,0,0,0|2,1,0]=4 32 B10R0.4 NCCCCCCCC(=O)O Z1201625777 [0,1,0,0,0,0|1,1,1]=4 33 B10R0.71 C=CCCCCCCCCN Z2083000288 [0,1,0,0,0,0|2,0,0]=3 34 B10R0.71 CCCCCCCCCC=O Z104477054 [0,1,0,0,0,0|1,1,0]=3 35 B10R0.71 CCCCCCCCCCN Z362810900 [0,1,0,0,0,0|2,0,0]=3 36 B10R0.71 CCCCCCCCCNC Z752371288 [0,1,0,0,0,0|2,0,0]=3 37 B10R0.71 CCCCCNCCCOC Z137847940 [0,1,0,0,0,0|2,1,0]=4 38 B10R0.71 CCCCOCCOCCN Z362798458 [0,1,0,0,0,0|3,0,0]=4 39 B10R0.71 CSCCCCCCN=C=S Z1198161073 [0,1,0,0,0,0|1,0,2]=4 40 B10R0.74 CCCCCCCC(C)CN Z415655116 [0,1,0,0,0,0|2,0,0]=3 41 B10R0.91 CCCCNC(C)CCCC Z446072116 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.4 CC1CCCCN1CCN Z271005826 [0,0,0,1,0,0|3,0,0]=4 43 B10R1.4 CCCC1CCCCC1O Z854050598 [0,0,0,1,0,0|1,1,0]=3 44 B10R1.4 CCCC1NCCCC1C Z1267773702 [0,0,0,1,0,0|3,0,0]=4 45 B10R1.4 CCNC1CCCCC1C Z2143574194 [0,0,0,1,0,0|3,0,0]=4 46 B10R1.4 CCSC1CCCCC1N Z1238713176 [0,0,0,1,0,0|3,0,0]=4 47 B10R1.4 CN1CCCCC1CCO Z139565496 [0,0,0,1,0,0|2,1,0]=4 48 B10R1.4 NCC[C@@H]1CCCC[C@@H]1O Z2915288574 [0,0,0,1,0,0|1,1,0]=3 49 B10R1.4 NCC[C@@H]1CCCC[C@H]1O Z3993260243 [0,0,0,1,0,0|1,1,0]=3 50 B10R1.17 CCCNC1CCCCC1 Z57396800 [0,0,0,1,0,0|3,0,0]=4 51 B10R1.17 CCOCC1CCCCN1 Z2261981710 [0,0,0,1,0,0|3,0,0]=4 52 B10R1.17 FCCCC1CCNCC1 Z3485638961 [0,0,0,1,0,0|3,0,0]=4 53 B10R1.17 N#CCCC1CCCCC1 Z382691354 [0,0,0,1,0,0|2,0,1]=4 54 B10R1.17 N#CCCC1CCCCO1 Z1182488755 [0,0,0,1,0,0|1,1,1]=4 55 B10R1.17 NCCCC1CCCCC1 Z234895793 [0,0,0,1,0,0|2,0,0]=3 56 B10R1.17 NCCCC1CCCCO1 Z1182485873 [0,0,0,1,0,0|1,1,0]=3 57 B10R1.17 NCCCC1CCOCC1 Z979765666 [0,0,0,1,0,0|3,0,0]=4 58 B10R1.17 NCCCN1CCCCC1 Z2895178979 [0,0,0,1,0,0|3,0,0]=4 59 B10R1.17 NCCNC1CCCCC1 Z4766278182 [0,0,0,1,0,0|3,0,0]=4 60 B10R1.17 O=CCCC1CCCCC1 Z57921395 [0,0,0,1,0,0|1,1,1]=4 61 B10R1.17 OCCCC1CCCCC1 Z87002514 [0,0,0,1,0,0|1,1,0]=3 62 B10R1.17 OCCCC1CCCCO1 Z1182486786 [0,0,0,1,0,0|0,2,0]=3 63 B10R1.17 OCCCC1CCNCC1 Z3234916305 [0,0,0,1,0,0|2,1,0]=4 64 B10R1.17 OCCCC1CCOCC1 Z993012578 [0,0,0,1,0,0|2,1,0]=4 65 B10R1.17 OCCCN1CCCCC1 Z169222610 [0,0,0,1,0,0|2,1,0]=4 66 B10R1.17 OCCNC1CCCCC1 Z90504557 [0,0,0,1,0,0|2,1,0]=4 67 B10R1.17 OCCOC1CCCCC1 Z362785382 [0,0,0,1,0,0|2,1,0]=4 68 B10R1.19 COC1CCCCCC1N Z1357823917 [0,0,0,1,0,0|3,0,0]=4 69 B10R1.19 NC1CCCCCC1CO Z1407007412 [0,0,0,1,0,0|1,1,0]=3 70 B10R1.20 CCC1CCCCC1C#N Z1162465704 [0,0,0,1,0,0|2,0,1]=4 71 B10R1.20 CCC1CCCCC1C=O Z1183459036 [0,0,0,1,0,0|1,1,1]=4 72 B10R1.20 CCC1CCCCC1CN Z2235386892 [0,0,0,1,0,0|2,0,0]=3 73 B10R1.20 CCC1CCCCC1NC Z813020678 [0,0,0,1,0,0|3,0,0]=4 74 B10R1.20 CCN1CCCCC1CN Z326178796 [0,0,0,1,0,0|3,0,0]=4 75 B10R1.20 CCN1CCCCC1CO Z137992830 [0,0,0,1,0,0|2,1,0]=4 76 B10R1.21 CCCCCC1CCCN1 Z1463349165 [0,0,0,1,0,0|2,0,0]=3 77 B10R1.21 CCCCNC1CCCC1 Z223658284 [0,0,0,1,0,0|3,0,0]=4 78 B10R1.21 NCCCCC1CCCC1 Z1203590193 [0,0,0,1,0,0|2,0,0]=3 79 B10R1.21 NCCCCN1CCCC1 Z285162574 [0,0,0,1,0,0|3,0,0]=4 80 B10R1.21 NCCOCC1CCCC1 Z976679450 [0,0,0,1,0,0|3,0,0]=4 81 B10R1.21 OCCCCN1CCCC1 Z425793748 [0,0,0,1,0,0|2,1,0]=4 82 B10R1.21 OCCCOC1CCCC1 Z362785376 [0,0,0,1,0,0|2,1,0]=4 83 B10R1.21 OCCOCC1CCCC1 Z1201627417 [0,0,0,1,0,0|2,1,0]=4 84 B10R1.29 CC1CCCC1NCCO Z1118527729 [0,0,0,1,0,0|2,1,0]=4 85 B10R1.29 CCCCC1CCCC1=O Z813018296 [0,0,0,1,0,0|1,1,1]=4 86 B10R1.78 NC1CCCCCCCC1 Z3491522566 [0,0,0,1,0,0|2,0,0]=3 87 B10R1.78 O=C1CCCCCCCC1 Z1255382938 [0,0,0,1,0,0|1,1,1]=4 88 B10R1.78 O=C1CCCCCCCN1 Z1203730756 [0,0,0,1,0,0|1,1,1]=4 89 B10R1.85 CCCC1CCCNCC1 Z425362308 [0,0,0,1,0,0|3,0,0]=4 90 B10R1.85 NCCC1=CCCCCC1 Z1698549638 [0,0,0,1,0,0|2,0,1]=4 91 B10R1.85 NCCN1CCCCCC1 Z228588982 [0,0,0,1,0,0|3,0,0]=4 92 B10R1.85 O=CCC1CCCCCC1 Z1268611681 [0,0,0,1,0,0|1,1,1]=4 93 B10R1.85 OCCC1CCCCCC1 Z1198264962 [0,0,0,1,0,0|1,1,0]=3 94 B10R1.85 OCCN1CCCCCC1 Z197266168 [0,0,0,1,0,0|2,1,0]=4 95 B10R1.161 CCC1CCCCCCN1 Z5401717016 [0,0,0,1,0,0|2,0,0]=3 96 B10R1.161 CNC1CCCCCCC1 Z102766896 [0,0,0,1,0,0|3,0,0]=4 97 B10R1.161 N#CC1CCCCCCC1 Z415654854 [0,0,0,1,0,0|2,0,1]=4 98 B10R1.161 NCC1CCCCCCC1 Z1259155971 [0,0,0,1,0,0|2,0,0]=3 99 B10R1.161 O=CC1CCCCCCC1 Z1162184415 [0,0,0,1,0,0|1,1,1]=4 100 B10R1.177 CCCCCOCC1CO1 Z409358140 [0,0,0,1,0,0|2,1,0]=4 101 B7R0.1 CCCCCCCO Z104473596 [2,0,0,0,0,0|0,1,0]=3 102 B7R0.1 CCCCCCNC Z5419328797 [2,0,0,0,0,0|1,0,0]=3 103 B7R0.1 CCCCOCCN Z409191398 [2,0,0,0,0,0|2,0,0]=4 104 B7R0.1 CCCOCCCO Z1080358966 [2,0,0,0,0,0|1,1,0]=4 105 B7R0.1 CCNCCOCC Z138138014 [2,0,0,0,0,0|2,0,0]=4 106 B7R0.1 CCOCCCCO Z993012560 [2,0,0,0,0,0|1,1,0]=4 107 B7R0.1 CNCCCCCN Z4097840720 [2,0,0,0,0,0|2,0,0]=4 108 B7R0.1 CNCCCCOC Z875082126 [2,0,0,0,0,0|2,0,0]=4 109 B7R0.1 COCCCCCN Z608347192 [2,0,0,0,0,0|2,0,0]=4 110 B7R0.1 COCCCCCO Z993012416 [2,0,0,0,0,0|1,1,0]=4 111 B7R0.1 CSCCCCCN Z823285026 [2,0,0,0,0,0|2,0,0]=4 112 B7R0.1 CSCCCCCO Z968557058 [2,0,0,0,0,0|1,1,0]=4 113 B7R0.1 CSCCCCSC Z1198148193 [2,0,0,0,0,0|2,0,0]=4 114 B7R0.1 NCCCCCCN Z104473514 [2,0,0,0,0,0|2,0,0]=4 115 B7R0.1 OCCCCCCBr Z1255398867 [2,0,0,0,0,0|1,1,0]=4 116 B7R0.1 OCCCCCCO Z104473540 [2,0,0,0,0,0|0,2,0]=4 117 B9R0.2 CCCCCCCC(=O)O Z104495238 [1,1,0,0,0,0|0,1,1]=4 118 B9R0.5 CCCCCC(O)CCO Z1198158015 [1,1,0,0,0,0|0,1,0]=3 119 B9R0.18 CCCCC(N)CCCC Z5099120554 [1,1,0,0,0,0|1,0,0]=3 120 B9R0.46 CCCCCCC(C)CO Z1238840360 [1,1,0,0,0,0|0,1,0]=3 121 B9R0.46 CCCCCCC(C)NN Z1691545122 [1,1,0,0,0,0|2,0,0]=4 122 B9R0.46 CCCCCCC(C)OC Z1416182763 [1,1,0,0,0,0|2,0,0]=4 123 B9R0.46 CCCCCCC(N)CC Z5869944669 [1,1,0,0,0,0|1,0,0]=3 124 B11R0.148 CCCCCCCCCC(=O)O Z104474944 [0,2,0,0,0,0|1,1,0]=4 125 B11R0.3 CCCCCCCCCCC=O Z993017862 [0,2,0,0,0,0|1,1,0]=4 126 B11R0.3 CCCCCCCCCCNC Z102767086 [0,2,0,0,0,0|2,0,0]=4 127 B11R0.3 CCCCCCCCSCCO Z425753146 [0,2,0,0,0,0|1,1,0]=4 128 B11R0.3 CCCCCCCNCCCO Z139305228 [0,2,0,0,0,0|1,1,0]=4 129 B11R0.3 CSCCSCCSCCSC Z291893776 [0,2,0,0,0,0|2,0,0]=4 130 B11R0.3 OCCSCCCCSCCO Z1269109601 [0,2,0,0,0,0|0,2,0]=4 131 B11R0.140 CCCCCN(C)CCCCC Z138914642 [0,2,0,0,0,0|2,0,0]=4 132 B9R1.5 N[C@@H]1CCCCC[C@H]1O Z1198180675 [1,0,0,1,0,0|1,1,0]=4 133 B9R1.5 N[C@H]1CCCCC[C@H]1N Z2895202592 [1,0,0,1,0,0|2,0,0]=4 134 B9R1.8 CCCC1CCCCN1 Z1665033554 [1,0,0,1,0,0|1,0,0]=3 135 B9R1.8 CCCC1CCCNC1 Z1404660494 [1,0,0,1,0,0|2,0,0]=4 136 B9R1.8 CCCC1CCNCC1 Z963408928 [1,0,0,1,0,0|2,0,0]=4 137 B9R1.8 CCCC1CNCCN1 Z1203732978 [1,0,0,1,0,0|2,0,0]=4 138 B9R1.8 CCCC1CNCCO1 Z1203829779 [1,0,0,1,0,0|1,1,0]=4 139 B9R1.8 CCCC1COCCN1 Z4607148847 [1,0,0,1,0,0|2,0,0]=4 140 B9R1.8 CCNC1CCCCC1 Z235346963 [1,0,0,1,0,0|2,0,0]=4 141 B9R1.8 CNCC1CCCCC1 Z102767074 [1,0,0,1,0,0|2,0,0]=4 142 B9R1.8 COCC1CCCCN1 Z2238934630 [1,0,0,1,0,0|2,0,0]=4 143 B9R1.8 ClCCN1CCCCC1 Z235354563 [1,0,0,1,0,0|2,0,0]=4 144 B9R1.8 N#CCC1CCCCC1 Z295382924 [1,0,0,1,0,0|1,0,1]=4 145 B9R1.8 NCCC1CCCCC1 Z367451182 [1,0,0,1,0,0|1,0,0]=3 146 B9R1.8 NCCC1CCCCO1 Z432420620 [1,0,0,1,0,0|1,1,0]=4 147 B9R1.8 NCCC1CCNCC1 Z756921054 [1,0,0,1,0,0|2,0,0]=4 148 B9R1.8 NCCC1CCOCC1 Z851015130 [1,0,0,1,0,0|2,0,0]=4 149 B9R1.8 NCCC1CCSCC1 Z2768149804 [1,0,0,1,0,0|2,0,0]=4 150 B9R1.8 O=CCC1CCCCC1 Z993017728 [1,0,0,1,0,0|0,1,1]=4 151 B9R1.8 OCCC1CCCCC1 Z397587116 [1,0,0,1,0,0|0,1,0]=3 152 B9R1.8 OCCC1CCCCO1 Z1198184633 [1,0,0,1,0,0|0,2,0]=4 153 B9R1.8 OCCC1CCCNC1 Z1263820461 [1,0,0,1,0,0|1,1,0]=4 154 B9R1.8 OCCC1CCCOC1 Z1198309922 [1,0,0,1,0,0|1,1,0]=4 155 B9R1.8 OCCC1CCNCC1 Z336087886 [1,0,0,1,0,0|1,1,0]=4 156 B9R1.8 OCCC1CCOCC1 Z1178491138 [1,0,0,1,0,0|1,1,0]=4 157 B9R1.8 OCCN1CCCCC1 Z104479032 [1,0,0,1,0,0|1,1,0]=4 158 B9R1.8 SCCN1CCOCC1 Z220616938 [1,0,0,1,0,0|2,0,0]=4 159 B9R1.12 CCCCC1CCCN1 Z3244909133 [1,0,0,1,0,0|1,0,0]=3 160 B9R1.12 CCCNC1CCCC1 Z1076533152 [1,0,0,1,0,0|2,0,0]=4 161 B9R1.12 CCNCC1CCCO1 Z810541800 [1,0,0,1,0,0|1,1,0]=4 162 B9R1.12 CNCCC1CCCO1 Z1801307836 [1,0,0,1,0,0|1,1,0]=4 163 B9R1.12 NCCCC1CCCC1 Z744843730 [1,0,0,1,0,0|1,0,0]=3 164 B9R1.12 NCCCC1CCOC1 Z1198224817 [1,0,0,1,0,0|2,0,0]=4 165 B9R1.12 NCCNC1CCCC1 Z4158574763 [1,0,0,1,0,0|2,0,0]=4 166 B9R1.12 NCCOC1CCCC1 Z594038064 [1,0,0,1,0,0|2,0,0]=4 167 B9R1.12 NCCSC1CCCC1 Z1263714075 [1,0,0,1,0,0|2,0,0]=4 168 B9R1.12 O=CCCC1CCCC1 Z993017672 [1,0,0,1,0,0|0,1,1]=4 169 B9R1.12 OCCCC1CCCN1 Z979444798 [1,0,0,1,0,0|1,1,0]=4 170 B9R1.12 OCCCC1CCCO1 Z993012576 [1,0,0,1,0,0|0,2,0]=4 171 B9R1.12 OCCNC1CCCC1 Z1162448840 [1,0,0,1,0,0|1,1,0]=4 172 B9R1.12 OCCOC1CCCC1 Z362785380 [1,0,0,1,0,0|1,1,0]=4 173 B9R1.14 NC[C@@H]1CCC[C@H]1CF Z5489491630 [1,0,0,1,0,0|2,0,0]=4 174 B9R1.15 CC1CCCCC1C#N Z415654838 [1,0,0,1,0,0|1,0,1]=4 175 B9R1.15 CC1CCCCC1C=O Z1268606365 [1,0,0,1,0,0|0,1,1]=4 176 B9R1.15 CC1CCCCC1CN Z415655074 [1,0,0,1,0,0|1,0,0]=3 177 B9R1.15 CC1COCCC1CN Z1255367314 [1,0,0,1,0,0|2,0,0]=4 178 B9R1.15 CCC1CCCCC1N Z368844574 [1,0,0,1,0,0|1,0,0]=3 179 B9R1.15 CCC1CCCCC1O Z104476198 [1,0,0,1,0,0|0,1,0]=3 180 B9R1.15 CNC1CCCCC1C Z324553050 [1,0,0,1,0,0|2,0,0]=4 181 B9R1.15 COC1CCCCC1N Z285187676 [1,0,0,1,0,0|2,0,0]=4 182 B9R1.15 COC1CCCCC1O Z425453594 [1,0,0,1,0,0|1,1,0]=4 183 B9R1.15 CO[C@@H]1CCCC[C@@H]1N Z4658510162 [1,0,0,1,0,0|2,0,0]=4 184 B9R1.15 CO[C@@H]1CCCC[C@H]1O Z3344357599 [1,0,0,1,0,0|1,1,0]=4 185 B9R1.15 CS[C@H]1CCCC[C@@H]1N Z2182116696 [1,0,0,1,0,0|2,0,0]=4 186 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Z2737203189 [1,0,0,1,0,0|1,1,0]=4 187 B9R1.15 C[C@@H]1NCCC[C@@H]1CO Z5613103409 [1,0,0,1,0,0|1,1,0]=4 188 B9R1.15 NCC1CCCCC1O Z409444222 [1,0,0,1,0,0|1,1,0]=4 189 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Z2306746656 [1,0,0,1,0,0|1,1,0]=4 190 B9R1.15 OCC1CCCCC1O Z1198163949 [1,0,0,1,0,0|0,2,0]=4 191 B9R1.16 CC1CC1CCCC=O Z3271342479 [1,0,0,1,0,0|0,1,1]=4 192 B9R1.17 NCCCCC1CCC1 Z5398432947 [1,0,0,1,0,0|1,0,0]=3 193 B9R1.17 NCCOCC1CCC1 Z1263592136 [1,0,0,1,0,0|2,0,0]=4 194 B9R1.17 OCCCNC1CCC1 Z859816160 [1,0,0,1,0,0|1,1,0]=4 195 B9R1.17 OCCOCC1CCC1 Z2256067074 [1,0,0,1,0,0|1,1,0]=4 196 B9R1.33 CCN[C@@H]1CCC[C@H]1O Z1796000613 [1,0,0,1,0,0|1,1,0]=4 197 B9R1.33 CCSC1CCCC1N Z1238713136 [1,0,0,1,0,0|2,0,0]=4 198 B9R1.33 CN1CCCC1CCN Z1255415415 [1,0,0,1,0,0|2,0,0]=4 199 B9R1.33 CN1CCCC1CCO Z607750234 [1,0,0,1,0,0|1,1,0]=4 200 B9R1.33 CNCC1CCCC1O Z1268477814 [1,0,0,1,0,0|1,1,0]=4 201 B9R1.33 NC1CCCC1CCO Z1509036975 [1,0,0,1,0,0|1,1,0]=4 202 B9R1.33 NCC[C@@H]1CCC[C@@H]1O Z4317048669 [1,0,0,1,0,0|1,1,0]=4 203 B9R1.33 NCC[C@@H]1CCC[C@H]1O Z3272980752 [1,0,0,1,0,0|1,1,0]=4 204 B9R1.50 CC1CCCCCCN1 Z3487835965 [1,0,0,1,0,0|1,0,0]=3 205 B9R1.50 NC1CCCCCCC1 Z104478188 [1,0,0,1,0,0|1,0,0]=3 206 B9R1.50 O=C1CCCCCCC1 Z104474712 [1,0,0,1,0,0|0,1,1]=4 207 B9R1.50 OC1CCCCCCC1 Z104472780 [1,0,0,1,0,0|0,1,0]=3 208 B9R1.83 CCCCCCC1CO1 Z1020680070 [1,0,0,1,0,0|0,1,0]=3 209 B9R1.83 CCCCOCC1CO1 Z409191626 [1,0,0,1,0,0|1,1,0]=4 210 B9R1.83 NCCOCCC1CC1 Z3629170058 [1,0,0,1,0,0|2,0,0]=4 211 B9R1.83 O=CCCCCC1CC1 Z3002702510 [1,0,0,1,0,0|0,1,1]=4 212 B9R1.83 OCCCCNC1CC1 Z839096664 [1,0,0,1,0,0|1,1,0]=4 213 B9R1.89 CCC1CCCCCN1 Z992736884 [1,0,0,1,0,0|1,0,0]=3 214 B9R1.89 CCC1CCCNCC1 Z425362302 [1,0,0,1,0,0|2,0,0]=4 215 B9R1.89 CCC1CCNCCO1 Z3275232542 [1,0,0,1,0,0|1,1,0]=4 216 B9R1.89 CCC1CCOCCN1 Z3275231194 [1,0,0,1,0,0|2,0,0]=4 217 B9R1.89 CNC1CCCCCC1 Z102766800 [1,0,0,1,0,0|2,0,0]=4 218 B9R1.89 NCC1CCCCCC1 Z415655096 [1,0,0,1,0,0|1,0,0]=3 219 B9R1.89 NCC1CCCOCC1 Z4438964521 [1,0,0,1,0,0|2,0,0]=4 220 B9R1.89 NCC1CCCSCC1 Z3037487975 [1,0,0,1,0,0|2,0,0]=4 221 B9R1.89 O=CC1CCCCCC1 Z1079442748 [1,0,0,1,0,0|0,1,1]=4 222 B9R1.89 OCC1CCCCCC1 Z992928672 [1,0,0,1,0,0|0,1,0]=3 223 B9R1.89 OCC1CCCCNC1 Z1318147457 [1,0,0,1,0,0|1,1,0]=4 224 B9R1.103 C1CCCCNCCC1 Z1203730912 [1,0,0,1,0,0|1,0,0]=3 225 B11R1.16 CCCC(N)C1CCCCC1 Z513797868 [0,1,0,1,0,0|2,0,0]=4 226 B11R1.16 NC(CCO)C1CCCCC1 Z979743602 [0,1,0,1,0,0|1,1,0]=4 227 B11R1.101 NC1CCCCCCCCC1 Z3244659869 [0,1,0,1,0,0|2,0,0]=4 228 B11R1.101 O=C1CCCCCCCCN1 Z1255465322 [0,1,0,1,0,0|1,1,0]=4 229 B11R1.117 CNCC1CCCCCCC1 Z1258570420 [0,1,0,1,0,0|2,0,0]=4 230 B11R1.86 CC(C)CC1CCCCC1N Z3406095613 [0,1,0,1,0,0|2,0,0]=4 231 B11R1.90 CC(C)CCC1CCCC1N Z813018522 [0,1,0,1,0,0|2,0,0]=4 232 B11R1.91 CC(O)CCC1CCCCC1 Z854048750 [0,1,0,1,0,0|1,1,0]=4 233 B11R1.568 NC1CCCCCCC1(F)F Z3281869143 [0,1,0,1,0,0|2,0,0]=4 234 B11R1.742 CC(C)CC1CCCCCN1 Z992736924 [0,1,0,1,0,0|2,0,0]=4 235 B11R1.742 CC(O)CC1CCCCCN1 Z1332990062 [0,1,0,1,0,0|1,1,0]=4 236 B11R1.17 CC1CCCCN1CCCO Z168932308 [0,1,0,1,0,0|1,1,0]=4 237 B11R1.28 CCCCCC1CCCCN1 Z1082216934 [0,1,0,1,0,0|2,0,0]=4 238 B11R1.28 CCCCNC1CCCCC1 Z2218556189 [0,1,0,1,0,0|2,0,0]=4 239 B11R1.28 CCCNCC1CCCCC1 Z57170999 [0,1,0,1,0,0|2,0,0]=4 240 B11R1.28 CCCNCC1CCCCO1 Z138447410 [0,1,0,1,0,0|1,1,0]=4 241 B11R1.28 NCCCOC1CCCCO1 Z1198263393 [0,1,0,1,0,0|1,1,0]=4 242 B11R1.28 OCCCCC1CCNCC1 Z3234885301 [0,1,0,1,0,0|1,1,0]=4 243 B11R1.28 OCCCNC1CCCCC1 Z3504619196 [0,1,0,1,0,0|1,1,0]=4 244 B11R1.28 OCCCOC1CCCCC1 Z362785378 [0,1,0,1,0,0|1,1,0]=4 245 B11R1.28 OCCNCC1CCCCC1 Z90504645 [0,1,0,1,0,0|1,1,0]=4 246 B11R1.41 CCCN1CCCCC1CN Z326178808 [0,1,0,1,0,0|2,0,0]=4 247 B11R1.41 NCC1CCCCN1CCO Z871859796 [0,1,0,1,0,0|1,1,0]=4 248 B11R1.203 FCCCN1CCCCCC1 Z3899643792 [0,1,0,1,0,0|2,0,0]=4 249 B11R1.203 NCCOC1CCCCCC1 Z756084276 [0,1,0,1,0,0|2,0,0]=4 250 B11R1.203 OCCCN1CCCCCC1 Z3069017316 [0,1,0,1,0,0|1,1,0]=4 251 B11R1.203 OCCNC1CCCCCC1 Z1862093141 [0,1,0,1,0,0|1,1,0]=4 252 B11R1.1 CCCCC1CCC(CC1)N Z839028544 [0,1,0,1,0,0|2,0,0]=4 253 B11R1.40 CC(CO)CC1CCCCC1 Z1238840407 [0,1,0,1,0,0|1,1,0]=4 254 B11R1.40 NC(CO)CC1CCCCC1 Z1201620851 [0,1,0,1,0,0|1,1,0]=4 255 B11R1.40 NC(CO)CC1CCCCO1 Z4777204053 [0,1,0,1,0,0|0,2,0]=4 256 B11R1.40 NCC(O)CC1CCCCC1 Z5195335934 [0,1,0,1,0,0|2,0,0]=4 257 B11R1.410 NC1(CCCCCCC1)CO Z2738576692 [0,1,0,1,0,0|1,1,0]=4 258 B11R1.410 NCC1(CCCCCCC1)O Z4403452657 [0,1,0,1,0,0|2,0,0]=4 259 B11R2.10 CC1CC2CCCCC2N1 Z1171508994 [0,0,0,2,0,0|2,0,0]=4 260 B11R2.10 N[C@@H]1C[C@@H]2CCCC[C@@H]2C1 Z3211867630 [0,0,0,2,0,0|2,0,0]=4 261 B11R2.20 C1CCC2CCCCC2C1 Z104474658 [0,0,0,2,0,0|2,0,0]=4 262 B11R2.20 C1CCC2CNCCC2C1 Z3492354682 [0,0,0,2,0,0|2,0,0]=4 263 B11R2.20 C1CCC2SCCNC2C1 Z1218937242 [0,0,0,2,0,0|2,0,0]=4 264 B11R2.20 C1CC[C@H]2NCCC[C@H]2C1 Z1203731004 [0,0,0,2,0,0|2,0,0]=4 265 B11R2.20 C1CSC2CCNCC2C1 Z4606693102 [0,0,0,2,0,0|2,0,0]=4 266 B11R2.47 NC1CC2CCC1CC2O Z4958656174 [0,0,0,2,0,0|1,1,0]=4 267 B11R2.106 NC1CCCC2C1CCO2 Z1413805519 [0,0,0,2,0,0|1,1,0]=4 268 B11R2.248 NCCC1CC2CCC1C2 Z432067000 [0,0,0,2,0,0|2,0,0]=4 269 B11R2.248 NCCC1CC2CCC1O2 Z1416162508 [0,0,0,2,0,0|1,1,0]=4 270 B11R2.641 NCCC1CCCC2C1C2 Z4076162898 [0,0,0,2,0,0|2,0,0]=4 271 B11R2.18 C1CC2CCNCCC2C1 Z4351247729 [0,0,0,2,0,0|2,0,0]=4 272 B11R2.36 NC1CCC2CCCC2C1 Z1259341392 [0,0,0,2,0,0|2,0,0]=4 273 B11R2.162 NC[C@@H]1C[C@H]2C[C@@H]1C[C@H]2O Z3713600798 [0,0,0,2,0,0|1,1,0]=4 274 B11R2.216 NCC1CCCC1C2CC2 Z2301415771 [0,0,0,2,0,0|2,0,0]=4 275 B11R2.226 N[C@@H]1[C@H]([C@@H]2[C@H]1CCC2)CO Z3445138951 [0,0,0,2,0,0|1,1,0]=4 276 B11R2.282 NCC1CCCC12CCC2 Z3302271630 [0,0,0,2,0,0|2,0,0]=4 277 B11R2.1098 NC[C@]12CCC[C@H]1CCO2 Z3267517630 [0,0,0,2,0,0|1,1,0]=4 278 B11R2.474 OC1CCCC2CCC1N2 Z3219595348 [0,0,0,2,0,0|1,1,0]=4 279 B11R2.17 NCC1CCC12CCCO2 Z3689421467 [0,0,0,2,0,0|1,1,0]=4 280 B11R2.1 NC1CCC2C1SCCS2 Z1489407807 [0,0,0,2,0,0|2,0,0]=4 281 B11R2.4 NC1CC1C2CCCCC2 Z1259273403 [0,0,0,2,0,0|2,0,0]=4 282 B11R2.13 NCC1CC12CCCCC2 Z3247610236 [0,0,0,2,0,0|2,0,0]=4 283 B11R2.164 NCC1CC2CCC1CC2 Z2380439346 [0,0,0,2,0,0|2,0,0]=4 284 B11R2.238 C1CCC(OC1)CC2CO2 Z3271405517 [0,0,0,2,0,0|0,2,0]=4 285 B11R2.1261 C1CCC2(CC1)CCCN2 Z1526503348 [0,0,0,2,0,0|2,0,0]=4 286 B11R2.1261 C1CCC2(CC1)NCCS2 Z2017679672 [0,0,0,2,0,0|2,0,0]=4 287 B11R2.266 NCC1CCC2CC1CO2 Z2903623101 [0,0,0,2,0,0|1,1,0]=4 288 B11R2.711 N[C@@H]1C[C@H]2[C@@H]1CCCCC2 Z3616240777 [0,0,0,2,0,0|2,0,0]=4 289 B11R2.2 C1CCC(C1)C2CCCN2 Z744754698 [0,0,0,2,0,0|2,0,0]=4 290 B11R2.2 C1CNC(C1)C2CCCO2 Z281773892 [0,0,0,2,0,0|1,1,0]=4 291 B11R2.3 N[C@@H]1CCC[C@]12CCCO2 Z2760980004 [0,0,0,2,0,0|1,1,0]=4 292 B11R2.3 OC1CCCC12CCCC2 Z1896300084 [0,0,0,2,0,0|1,1,0]=4 293 B11R2.32 NCC1CC1C2CCCC2 Z3035016249 [0,0,0,2,0,0|2,0,0]=4 294 B11R2.15 NCC1CC2CCCC2C1 Z4133940794 [0,0,0,2,0,0|2,0,0]=4 295 B11R2.15 NCC1CC2CCCC2O1 Z2756214370 [0,0,0,2,0,0|1,1,0]=4 296 B11R2.1242 C1CC2(C1)CCNCCS2 Z2299686620 [0,0,0,2,0,0|2,0,0]=4