0 B4R0.2 CC#CCN Z1713595498 [0,0,0,0,0,0|1,0,3]=4 1 B4R0.2 CCCC#N Z238878246 [0,0,0,0,0,0|1,0,3]=4 2 B4R0.2 CCCCN Z104474314 [0,0,0,0,0,0|1,0,3]=4 3 B4R0.2 CCCCO Z104473488 [0,0,0,0,0,0|0,0,4]=4 4 B4R0.2 CCCNN Z415728048 [0,0,0,0,0,0|2,0,2]=4 5 B4R0.2 CNCC#N Z1262250834 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.2 COCC#N Z86023357 [0,0,0,0,0,0|2,0,2]=4 7 B4R0.2 COCCO Z104473522 [0,0,0,0,0,0|1,0,3]=4 8 B4R0.2 CSCCO Z149154880 [0,0,0,0,0,0|1,0,3]=4 9 B4R0.2 NC/C=C/Cl Z2941400887 [0,0,0,0,0,0|2,0,1]=3 10 B3R0.1 C=CCO Z104473976 [1,0,0,0,0,0|0,0,2]=3 11 B3R0.1 I/C=C/I Z2417817184 [1,0,0,0,0,0|2,0,0]=3 12 B3R0.1 N/C=N/O Z156964716 [1,0,0,0,0,0|2,0,1]=4 13 B5R0.1 C#CCC(=O)O Z295890060 [0,1,0,0,0,0|0,0,3]=4 14 B5R0.1 C/C(=C\C#N)/[O-] Z90662985 [0,1,0,0,0,0|1,0,1]=3 15 B5R0.1 C/C(=N/C#N)/N Z2573128414 [0,1,0,0,0,0|2,0,1]=4 16 B5R0.1 C/C=C/C(=O)O Z104476026 [0,1,0,0,0,0|0,0,0]=1 17 B5R0.1 C=C(C)CCN Z1203582475 [0,1,0,0,0,0|1,0,2]=4 18 B5R0.1 C=CCC(C)N Z1269638561 [0,1,0,0,0,0|1,0,2]=4 19 B5R0.1 CC#CC(=O)N Z1203579284 [0,1,0,0,0,0|0,0,2]=3 20 B5R0.1 CC(=CC#N)C Z851014248 [0,1,0,0,0,0|1,0,1]=3 21 B5R0.1 CC(=CCN)C Z1827897919 [0,1,0,0,0,0|1,0,1]=3 22 B5R0.1 CC(=O)CCO Z906206900 [0,1,0,0,0,0|0,0,3]=4 23 B5R0.1 CC(C)NC=O Z1201617634 [0,1,0,0,0,0|1,0,1]=3 24 B5R0.1 CCCC(=N)N Z1198394172 [0,1,0,0,0,0|1,0,2]=4 25 B5R0.1 CCCC(=O)N Z33546461 [0,1,0,0,0,0|0,0,2]=3 26 B5R0.1 CCCC(=O)O Z104495380 [0,1,0,0,0,0|0,0,2]=3 27 B5R0.1 CCNC(=N)N Z2574931373 [0,1,0,0,0,0|2,0,1]=4 28 B5R0.1 CCOC(=N)N Z1741973543 [0,1,0,0,0,0|2,0,1]=4 29 B5R0.1 CCOC(=O)N Z33546369 [0,1,0,0,0,0|1,0,1]=3 30 B5R0.1 CCSC(=N)N Z1708092306 [0,1,0,0,0,0|2,0,1]=4 31 B5R0.1 CNCC(=O)N Z415678308 [0,1,0,0,0,0|1,0,1]=3 32 B5R0.1 CNCC(=O)O Z104480276 [0,1,0,0,0,0|1,0,1]=3 33 B5R0.1 COCC(=N)N Z1258620054 [0,1,0,0,0,0|2,0,1]=4 34 B5R0.1 COCC(=O)N Z33546778 [0,1,0,0,0,0|1,0,1]=3 35 B5R0.1 COCC(=O)O Z104477404 [0,1,0,0,0,0|1,0,1]=3 36 B5R0.1 CSCC(=N)N Z1459934800 [0,1,0,0,0,0|2,0,1]=4 37 B5R0.1 CSCC(=O)N Z33545668 [0,1,0,0,0,0|1,0,1]=3 38 B5R0.1 CSCS(=O)C Z1255438413 [0,1,0,0,0,0|2,0,1]=4 39 B5R0.1 N#CCC(=O)N Z56896153 [0,1,0,0,0,0|1,0,2]=4 40 B5R0.1 N#CCC(=O)O Z104476112 [0,1,0,0,0,0|1,0,2]=4 41 B5R0.1 N=C(N)NC=O Z1203578554 [0,1,0,0,0,0|2,0,0]=3 42 B5R0.1 NC(=O)CCO Z431951940 [0,1,0,0,0,0|1,0,2]=4 43 B5R0.1 NCC=C(Cl)Cl Z2469606492 [0,1,0,0,0,0|2,0,1]=4 44 B5R0.1 NCC=C(F)F Z4511316967 [0,1,0,0,0,0|2,0,1]=4 45 B5R0.1 NCCC(=O)N Z415728050 [0,1,0,0,0,0|1,0,2]=4 46 B5R0.1 NCCC(=O)O Z57127544 [0,1,0,0,0,0|1,0,2]=4 47 B5R0.1 NOCC(=O)O Z90662171 [0,1,0,0,0,0|2,0,1]=4 48 B5R0.1 O=C(O)/C=C/I Z2327124440 [0,1,0,0,0,0|1,0,0]=2 49 B5R0.1 O=C(O)CCCl Z203045320 [0,1,0,0,0,0|1,0,2]=4 50 B5R0.1 O=C(O)CCS Z104474322 [0,1,0,0,0,0|1,0,2]=4 51 B5R0.1 O=C(O)CNO Z1205493750 [0,1,0,0,0,0|2,0,1]=4 52 B5R0.2 C/C=C/CCN Z1268152372 [0,1,0,0,0,0|1,0,1]=3 53 B5R0.2 C/C=C/OCC Z281777810 [0,1,0,0,0,0|1,0,1]=3 54 B5R0.2 C=C/C=C/CN Z3270208113 [0,1,0,0,0,0|1,0,0]=2 55 B5R0.2 C=CCCCN Z993058434 [0,1,0,0,0,0|1,0,2]=4 56 B5R0.2 C=CCNCC Z2044769224 [0,1,0,0,0,0|1,0,2]=4 57 B5R0.2 CCCCC=O Z104472992 [0,1,0,0,0,0|0,0,2]=3 58 B5R0.2 NC/C=C/CN Z2235386837 [0,1,0,0,0,0|1,0,1]=3 59 B5R0.2 OC/C=C/CO Z237581088 [0,1,0,0,0,0|0,0,2]=3 60 B5R0.3 C/N=C(\C)/NC Z1431002714 [0,1,0,0,0,0|3,0,0]=4 61 B5R0.3 C/N=C(\N)/NC Z1089996530 [0,1,0,0,0,0|3,0,0]=4 62 B5R0.3 C/N=C(\N)/SC Z107728770 [0,1,0,0,0,0|3,0,0]=4 63 B5R0.3 C=C(CC)CN Z2238934536 [0,1,0,0,0,0|1,0,2]=4 64 B5R0.3 CC/C(=N/O)/N Z241067842 [0,1,0,0,0,0|1,0,2]=4 65 B5R0.3 CCC(=O)CC Z104476878 [0,1,0,0,0,0|1,0,2]=4 66 B5R0.3 CCC(=O)CN Z1203579016 [0,1,0,0,0,0|1,0,2]=4 67 B5R0.3 CCC(=O)NN Z56886418 [0,1,0,0,0,0|2,0,1]=4 68 B5R0.3 CCN(C)C=O Z1258520870 [0,1,0,0,0,0|1,0,1]=3 69 B5R0.3 CCN(C)N=O Z1198147516 [0,1,0,0,0,0|2,0,1]=4 70 B5R0.3 CNC(=N)NN Z2301534051 [0,1,0,0,0,0|3,0,0]=4 71 B5R0.3 CNC(=O)CCl Z56891219 [0,1,0,0,0,0|2,0,1]=4 72 B5R0.3 CNC(=O)CN Z57981102 [0,1,0,0,0,0|2,0,1]=4 73 B5R0.3 CNC(=O)CO Z431952700 [0,1,0,0,0,0|1,0,2]=4 74 B5R0.3 CNC(=O)CS Z1203730878 [0,1,0,0,0,0|1,1,1]=4 75 B5R0.3 COC(=O)CN Z57042020 [0,1,0,0,0,0|2,0,1]=4 76 B5R0.3 OC/C(=C/I)/I Z4691071538 [0,1,0,0,0,0|1,0,2]=4 77 B5R1.1 C1=CCNC1 Z2306624771 [0,0,0,1,0,0|1,0,1]=3 78 B5R1.1 C1=CNC=C1 Z104479036 [0,0,0,1,0,0|1,0,1]=3 79 B5R1.1 C1=CNC=N1 Z104472692 [0,0,0,1,0,0|2,0,1]=4 80 B5R1.1 C1=CNN=C1 Z104507728 [0,0,0,1,0,0|2,0,0]=3 81 B5R1.1 C1=CNN=N1 Z237528494 [0,0,0,1,0,0|3,0,0]=4 82 B5R1.1 C1=NN=CN1 Z104479156 [0,0,0,1,0,0|3,0,0]=4 83 B5R1.1 C1=NN=CS1 Z1198156558 [0,0,0,1,0,0|3,0,0]=4 84 B5R1.2 O=C1CCO1 Z1089877620 [0,0,0,1,0,0|1,0,1]=3 85 B2R0.1 CNC Z57834054 [2,0,0,0,0,0|1,0,1]=4 86 B4R0.1 C#CC(=O)O Z104493798 [1,1,0,0,0,0|0,0,2]=4 87 B4R0.1 C=C(Br)CN Z600439032 [1,1,0,0,0,0|1,0,1]=4 88 B4R0.1 C=C(Br)CO Z600440434 [1,1,0,0,0,0|0,0,2]=4 89 B4R0.1 C=CC(=C)C Z104474660 [1,1,0,0,0,0|0,0,0]=2 90 B4R0.1 C=CC(=O)O Z57127944 [1,1,0,0,0,0|0,0,0]=2 91 B4R0.1 C=CC(C)N Z1446855743 [1,1,0,0,0,0|0,0,1]=3 92 B4R0.1 CC(=O)C=O Z104495190 [1,1,0,0,0,0|0,0,0]=2 93 B4R0.1 CC(=O)CN Z1262398366 [1,1,0,0,0,0|1,0,1]=4 94 B4R0.1 CC(=O)NN Z58981787 [1,1,0,0,0,0|2,0,0]=4 95 B4R0.1 CC(=O)NO Z59181917 [1,1,0,0,0,0|1,0,1]=4 96 B4R0.1 CCC(=N)N Z1741969146 [1,1,0,0,0,0|1,0,1]=4 97 B4R0.1 CCC(=O)N Z33546482 [1,1,0,0,0,0|0,0,1]=3 98 B4R0.1 CCC(=O)O Z104474154 [1,1,0,0,0,0|0,0,1]=3 99 B4R0.1 CCC(=S)N Z241091446 [1,1,0,0,0,0|0,1,1]=4 100 B4R0.1 CN(C)N=O Z1255485177 [1,1,0,0,0,0|2,0,0]=4 101 B4R0.1 CNC(=N)C Z2146515751 [1,1,0,0,0,0|1,0,1]=4 102 B4R0.1 CNC(=O)C Z32016274 [1,1,0,0,0,0|1,0,0]=3 103 B4R0.1 CNC(=O)N Z56932989 [1,1,0,0,0,0|1,0,0]=3 104 B4R0.1 COC(=N)N Z1741976783 [1,1,0,0,0,0|2,0,0]=4 105 B4R0.1 COC(=O)N Z104476722 [1,1,0,0,0,0|1,0,0]=3 106 B4R0.1 CSC(=N)N Z1741980405 [1,1,0,0,0,0|2,0,0]=4 107 B4R0.1 ClC=C(Cl)Cl Z104473870 [1,1,0,0,0,0|2,0,0]=4 108 B4R0.1 NC(=O)CF Z104475768 [1,1,0,0,0,0|1,0,1]=4 109 B4R0.1 NC(=O)CI Z1080376832 [1,1,0,0,0,0|1,0,1]=4 110 B4R0.1 NC(=O)CO Z424788508 [1,1,0,0,0,0|1,0,1]=4 111 B4R0.1 NC(=O)NO Z1203577934 [1,1,0,0,0,0|2,0,0]=4 112 B4R0.1 NCC(=O)N Z1262254285 [1,1,0,0,0,0|1,0,1]=4 113 B4R0.1 NCC(=O)O Z955123660 [1,1,0,0,0,0|1,0,1]=4 114 B4R0.1 NNC(=O)N Z104473922 [1,1,0,0,0,0|2,0,0]=4 115 B4R0.1 O=C(O)CBr Z104473018 [1,1,0,0,0,0|1,0,1]=4 116 B4R0.1 O=C(O)CO Z104473274 [1,1,0,0,0,0|1,0,1]=4 117 B6R0.1 C#CC(=O)OCC Z104478880 [0,2,0,0,0,0|1,0,1]=4 118 B6R0.1 CCC(=O)COC Z825742020 [0,2,0,0,0,0|1,0,1]=4 119 B6R0.1 CCCC(=O)CN Z1203579017 [0,2,0,0,0,0|0,0,2]=4 120 B6R0.1 CCCC(=O)NO Z59181937 [0,2,0,0,0,0|0,0,2]=4 121 B6R0.1 CCNC(=O)CN Z54747476 [0,2,0,0,0,0|1,0,1]=4 122 B6R0.1 CCNC(=O)CO Z431952024 [0,2,0,0,0,0|1,0,1]=4 123 B6R0.1 CCOC(=O)CN Z594038186 [0,2,0,0,0,0|1,0,1]=4 124 B6R0.1 CCOC(=O)CO Z385458066 [0,2,0,0,0,0|1,0,1]=4 125 B6R0.1 CCOC(=O)NN Z104478458 [0,2,0,0,0,0|1,0,1]=4 126 B6R0.1 CNCC(=O)NC Z57981096 [0,2,0,0,0,0|1,0,1]=4 127 B6R0.1 CNCC(=O)OC Z89264972 [0,2,0,0,0,0|1,0,1]=4 128 B6R0.1 CONC(=O)CCl Z234816732 [0,2,0,0,0,0|2,0,0]=4 129 B6R0.2 C/C(=C/C(=O)O)/I Z1508917269 [0,2,0,0,0,0|0,0,0]=2 130 B6R0.2 C=C(C)CC(=O)O Z295890066 [0,2,0,0,0,0|0,0,1]=3 131 B6R0.2 CC(=CC(=O)N)C Z33546934 [0,2,0,0,0,0|0,0,0]=2 132 B6R0.2 CC(=CC(=O)O)C Z104480144 [0,2,0,0,0,0|0,0,0]=2 133 B6R0.2 CC(=O)/C=C(/C)\N Z56858245 [0,2,0,0,0,0|0,0,0]=2 134 B6R0.2 CC(=O)CC(C)N Z57329385 [0,2,0,0,0,0|0,0,2]=4 135 B6R0.2 CC(=O)NC(=N)N Z1203578060 [0,2,0,0,0,0|2,0,0]=4 136 B6R0.2 CC(=O)NC(=O)N Z104476284 [0,2,0,0,0,0|1,0,0]=3 137 B6R0.2 CC(C)CC(=O)N Z33546511 [0,2,0,0,0,0|0,0,2]=4 138 B6R0.2 CC(C)CC(=O)O Z104474910 [0,2,0,0,0,0|0,0,2]=4 139 B6R0.2 CC(C)NC(=O)N Z56887677 [0,2,0,0,0,0|1,0,1]=4 140 B6R0.2 CC(N)CC(=O)N Z594220690 [0,2,0,0,0,0|0,0,2]=4 141 B6R0.2 CC(N)CC(=O)O Z147647144 [0,2,0,0,0,0|0,0,2]=4 142 B6R0.2 CN(C)CC(=O)N Z54750057 [0,2,0,0,0,0|1,0,1]=4 143 B6R0.2 CN(C)CC(=O)O Z235580496 [0,2,0,0,0,0|1,0,1]=4 144 B6R0.2 CS(=O)CC(=O)N Z1203581973 [0,2,0,0,0,0|1,0,1]=4 145 B6R0.2 C[C@H](N)CC(=O)O Z1741969208 [0,2,0,0,0,0|0,0,2]=4 146 B6R0.2 N=C(N)CC(=O)N Z104480060 [0,2,0,0,0,0|1,0,1]=4 147 B6R0.2 NC(=O)CC(=O)N Z104473780 [0,2,0,0,0,0|1,0,1]=4 148 B6R0.2 NC(=O)CC(=O)O Z963467736 [0,2,0,0,0,0|1,0,1]=4 149 B6R0.2 NC(=O)NC(=O)N Z57206006 [0,2,0,0,0,0|2,0,0]=4 150 B6R0.2 O=C(O)C=C(Br)Br Z1416198234 [0,2,0,0,0,0|1,0,0]=3 151 B6R0.2 O=C(O)C=C(Cl)Cl Z1205493743 [0,2,0,0,0,0|1,0,0]=3 152 B6R0.2 O=C(O)CC(=O)O Z57965450 [0,2,0,0,0,0|1,0,1]=4 153 B6R0.3 C=CC(N)C(=O)O Z3244810526 [0,2,0,0,0,0|0,0,2]=4 154 B6R0.3 CC(=C(F)CN)C Z1203639272 [0,2,0,0,0,0|1,0,1]=4 155 B6R0.3 CC(C)N(C)C=O Z1258520821 [0,2,0,0,0,0|1,0,1]=4 156 B6R0.3 CCC(C)C(=O)N Z270978420 [0,2,0,0,0,0|0,0,2]=4 157 B6R0.3 CCC(C)C(=O)O Z237374874 [0,2,0,0,0,0|0,0,2]=4 158 B6R0.3 CCC(N)C(=O)O Z104495144 [0,2,0,0,0,0|0,0,2]=4 159 B6R0.3 CCC(O)C(=O)N Z965049008 [0,2,0,0,0,0|0,0,2]=4 160 B6R0.3 CCC(O)C(=O)O Z246073650 [0,2,0,0,0,0|0,0,2]=4 161 B6R0.3 CC[C@@H](N)C(=O)O Z904976986 [0,2,0,0,0,0|0,0,2]=4 162 B6R0.3 CC[C@H](C)C(=O)O Z1205493564 [0,2,0,0,0,0|0,0,2]=4 163 B6R0.3 CC[C@H](N)C(=O)O Z1741965569 [0,2,0,0,0,0|0,0,2]=4 164 B6R0.3 CNC(C)C(=O)O Z1278590830 [0,2,0,0,0,0|1,0,1]=4 165 B6R0.3 CN[C@@H](C)C(=O)N Z2143576643 [0,2,0,0,0,0|1,0,1]=4 166 B6R0.3 COC(=O)C(=N)N Z1198220825 [0,2,0,0,0,0|2,0,0]=4 167 B6R0.3 COC(C)C(=O)C Z447898138 [0,2,0,0,0,0|1,0,1]=4 168 B6R0.3 COC(C)C(=O)N Z223645218 [0,2,0,0,0,0|1,0,1]=4 169 B6R0.3 COC(C)C(=O)O Z316258898 [0,2,0,0,0,0|1,0,1]=4 170 B6R0.3 CSC(C)C(=O)O Z149191750 [0,2,0,0,0,0|1,0,1]=4 171 B6R0.3 NNC(=O)C(=O)O Z3068042919 [0,2,0,0,0,0|2,0,0]=4 172 B6R0.3 O=C(O)C(=O)CBr Z1079181768 [0,2,0,0,0,0|1,0,1]=4 173 B6R0.4 C=CCCC(=O)C Z406376894 [0,2,0,0,0,0|0,0,2]=4 174 B6R0.4 C=CCCC(=O)O Z995028722 [0,2,0,0,0,0|0,0,2]=4 175 B6R0.4 C=CCNC(=O)C Z32064466 [0,2,0,0,0,0|0,0,2]=4 176 B6R0.4 C=CCNC(=O)N Z56904662 [0,2,0,0,0,0|0,0,2]=4 177 B6R0.4 CC(=O)NCCCl Z57983106 [0,2,0,0,0,0|1,0,1]=4 178 B6R0.4 CC(=O)OCCN Z1973465551 [0,2,0,0,0,0|1,0,1]=4 179 B6R0.4 CC/C=C/C(=O)O Z2311573931 [0,2,0,0,0,0|0,0,0]=2 180 B6R0.4 CCC#CC(=O)O Z1205493735 [0,2,0,0,0,0|0,0,2]=4 181 B6R0.4 CCCCC(=O)N Z104476278 [0,2,0,0,0,0|0,0,2]=4 182 B6R0.4 CCCCC(=O)O Z104473312 [0,2,0,0,0,0|0,0,2]=4 183 B6R0.4 CCCNC(=O)C Z33030314 [0,2,0,0,0,0|0,0,2]=4 184 B6R0.4 CCCOC(=O)N Z1198148877 [0,2,0,0,0,0|0,0,2]=4 185 B6R0.4 CCNCC(=O)N Z1459435506 [0,2,0,0,0,0|0,0,2]=4 186 B6R0.4 CCNCC(=O)O Z744593094 [0,2,0,0,0,0|0,0,2]=4 187 B6R0.4 CCOCC(=O)O Z104495232 [0,2,0,0,0,0|0,0,2]=4 188 B6R0.4 CNCCC(=O)C Z1536943318 [0,2,0,0,0,0|0,0,2]=4 189 B6R0.4 COCCC(=O)C Z362119682 [0,2,0,0,0,0|0,0,2]=4 190 B6R0.4 COCCC(=O)N Z394696458 [0,2,0,0,0,0|0,0,2]=4 191 B6R0.4 COCCC(=O)O Z285184634 [0,2,0,0,0,0|0,0,2]=4 192 B6R0.4 CS/C=C/C(=O)O Z1868430572 [0,2,0,0,0,0|0,0,0]=2 193 B6R0.4 CSCCC(=O)O Z54719251 [0,2,0,0,0,0|0,0,2]=4 194 B6R0.4 NC(=O)CCCO Z1203578394 [0,2,0,0,0,0|0,0,2]=4 195 B6R0.4 NC(=O)NCCF Z1203582184 [0,2,0,0,0,0|1,0,1]=4 196 B6R0.4 NC(=O)OCCO Z1198158440 [0,2,0,0,0,0|1,0,1]=4 197 B6R0.4 NCCCC(=O)N Z398513418 [0,2,0,0,0,0|0,0,2]=4 198 B6R0.4 NCCCC(=O)O Z104475620 [0,2,0,0,0,0|0,0,2]=4 199 B6R0.4 NCCNC(=O)N Z1268152381 [0,2,0,0,0,0|1,0,1]=4 200 B6R0.4 NCCOC(=O)N Z1587257433 [0,2,0,0,0,0|1,0,1]=4 201 B6R0.4 O=C(O)/C=C/CO Z3178016098 [0,2,0,0,0,0|0,0,0]=2 202 B6R0.4 O=C(O)C#CCO Z1198169479 [0,2,0,0,0,0|0,0,2]=4 203 B6R0.4 O=C(O)CCCS Z147642510 [0,2,0,0,0,0|0,0,2]=4 204 B6R0.5 CC(C)(N)/C=C/Cl Z2827897660 [0,2,0,0,0,0|1,0,1]=4 205 B6R0.6 C=C/C=C/CCN Z2786180930 [0,2,0,0,0,0|1,0,0]=3 206 B6R0.6 O=CCCCC=O Z57127529 [0,2,0,0,0,0|0,0,2]=4 207 B6R1.2 BrC1=CNC=N1 Z1213725191 [0,1,0,1,0,0|2,0,0]=4 208 B6R1.2 CC1=CC=CN1 Z594218440 [0,1,0,1,0,0|1,0,0]=3 209 B6R1.2 CC1=CC=CO1 Z104472456 [0,1,0,1,0,0|0,0,1]=3 210 B6R1.2 CC1=CCNC1 Z1203734447 [0,1,0,1,0,0|1,0,1]=4 211 B6R1.2 CC1=CN=CN1 Z1945707502 [0,1,0,1,0,0|1,0,0]=3 212 B6R1.2 CC1=CN=CO1 Z1198180653 [0,1,0,1,0,0|0,0,1]=3 213 B6R1.2 CC1=CNC=C1 Z1203730789 [0,1,0,1,0,0|1,0,0]=3 214 B6R1.2 CC1=CNN=C1 Z600419582 [0,1,0,1,0,0|2,0,0]=4 215 B6R1.2 CC1=CNN=N1 Z1255358215 [0,1,0,1,0,0|2,0,0]=4 216 B6R1.2 CC1=COC=N1 Z1198313432 [0,1,0,1,0,0|1,0,0]=3 217 B6R1.2 CC1=NC=CN1 Z104494990 [0,1,0,1,0,0|1,0,0]=3 218 B6R1.2 CC1=NNC=C1 Z450469310 [0,1,0,1,0,0|1,0,0]=3 219 B6R1.2 CC1=NNC=N1 Z939944658 [0,1,0,1,0,0|2,0,0]=4 220 B6R1.2 CN1C=CC=C1 Z57127895 [0,1,0,1,0,0|1,0,0]=3 221 B6R1.2 CN1C=CC=N1 Z336081430 [0,1,0,1,0,0|1,0,0]=3 222 B6R1.2 CN1C=CN=C1 Z104506032 [0,1,0,1,0,0|2,0,0]=4 223 B6R1.2 CN1C=CN=N1 Z1198221873 [0,1,0,1,0,0|2,0,0]=4 224 B6R1.2 CN1C=NC=N1 Z237493308 [0,1,0,1,0,0|2,0,0]=4 225 B6R1.2 ClC1=CNN=C1 Z275169786 [0,1,0,1,0,0|2,0,0]=4 226 B6R1.2 ClC1=NNC=C1 Z1255493581 [0,1,0,1,0,0|2,0,0]=4 227 B6R1.2 IC1=CNN=C1 Z1203162050 [0,1,0,1,0,0|2,0,0]=4 228 B6R1.2 NC1=CC=NO1 Z415654518 [0,1,0,1,0,0|1,0,1]=4 229 B6R1.2 NC1=CC=NS1 Z2568737642 [0,1,0,1,0,0|1,1,0]=4 230 B6R1.2 NC1=CNC=N1 Z3241270014 [0,1,0,1,0,0|2,0,0]=4 231 B6R1.2 NC1=CSC=C1 Z1962138158 [0,1,0,1,0,0|0,1,1]=4 232 B6R1.2 NC1=CSN=C1 Z2467685283 [0,1,0,1,0,0|1,1,0]=4 233 B6R1.2 NC1=NC=CN1 Z1262237195 [0,1,0,1,0,0|2,0,0]=4 234 B6R1.2 NC1=NC=CO1 Z939904646 [0,1,0,1,0,0|1,0,1]=4 235 B6R1.2 NC1=NC=CS1 Z104472798 [0,1,0,1,0,0|1,1,0]=4 236 B6R1.2 NC1=NNC=C1 Z240126818 [0,1,0,1,0,0|2,0,0]=4 237 B6R1.2 NC1C=CCC1 Z2679312470 [0,1,0,1,0,0|1,0,1]=4 238 B6R1.2 NC1CC=CC1 Z1416200863 [0,1,0,1,0,0|1,0,1]=4 239 B6R1.2 N[C@@H]1C=CCC1 Z1203585093 [0,1,0,1,0,0|1,0,1]=4 240 B6R1.2 O=C1C=CCO1 Z1219048777 [0,1,0,1,0,0|0,0,0]=2 241 B6R1.2 O=C1C=CNN1 Z1198154338 [0,1,0,1,0,0|1,0,0]=3 242 B6R1.2 O=C1C=CSN1 Z1741980421 [0,1,0,1,0,0|1,0,0]=3 243 B6R1.2 O=C1CCCN1 Z104472846 [0,1,0,1,0,0|0,0,2]=4 244 B6R1.2 O=C1CCNC1 Z1741976513 [0,1,0,1,0,0|0,0,2]=4 245 B6R1.2 O=C1CCNN1 Z2935001239 [0,1,0,1,0,0|1,0,1]=4 246 B6R1.2 O=C1CCSC1 Z104495638 [0,1,0,1,0,0|0,0,2]=4 247 B6R1.2 O=C1NC=CN1 Z1198148260 [0,1,0,1,0,0|1,0,0]=3 248 B6R1.2 O=C1NC=CS1 Z445210514 [0,1,0,1,0,0|1,0,0]=3 249 B6R1.2 O=C1NCCN1 Z104494954 [0,1,0,1,0,0|1,0,1]=4 250 B6R1.2 O=C1NCCO1 Z104474784 [0,1,0,1,0,0|1,0,1]=4 251 B6R1.2 O=C1NCCS1 Z55928860 [0,1,0,1,0,0|1,0,1]=4 252 B6R1.2 O=C1OCCO1 Z1172235744 [0,1,0,1,0,0|1,0,1]=4 253 B6R1.2 OC1=NOC=C1 Z1255501207 [0,1,0,1,0,0|1,0,1]=4 254 B6R1.2 OC1C=CCC1 Z1255485846 [0,1,0,1,0,0|0,0,2]=4 255 B6R1.2 ON1C=CC=N1 Z1198342489 [0,1,0,1,0,0|1,0,1]=4 256 B6R1.2 SC1=NC=CN1 Z1198723329 [0,1,0,1,0,0|1,1,0]=4 257 B6R1.3 O=CCC1CC1 Z905066058 [0,1,0,1,0,0|0,0,2]=4 258 B6R1.8 CC1CC1C=O Z1079442440 [0,1,0,1,0,0|0,0,2]=4 259 B6R1.8 C[C@H]1C[C@@H]1C=O Z1511765506 [0,1,0,1,0,0|0,0,2]=4 260 B6R1.8 C[C@H]1C[C@H]1C=O Z1511760860 [0,1,0,1,0,0|0,0,2]=4 261 B6R1.8 O=CC1CC1Cl Z1262480603 [0,1,0,1,0,0|0,0,2]=4 262 B6R1.8 O=C[C@@H]1C[C@H]1Cl Z4541248007 [0,1,0,1,0,0|0,0,2]=4 263 B6R1.1 C1=CC=CC=C1 Z57120059 [0,1,0,1,0,0|1,0,1]=4 264 B6R1.1 C1=CC=NC=C1 Z56899837 [0,1,0,1,0,0|1,0,1]=4 265 B6R1.1 C1=CCCCC1 Z104474726 [0,1,0,1,0,0|1,0,1]=4 266 B6R1.1 C1=CCNCC1 Z1623864216 [0,1,0,1,0,0|1,0,1]=4 267 B6R1.1 C1=CCONC1 Z1486018651 [0,1,0,1,0,0|0,0,2]=4 268 B6R1.6 O=CC1CCC1 Z1079442452 [0,1,0,1,0,0|0,0,2]=4 269 B6R1.7 CC1(CC1)C=O Z1263714317 [0,1,0,1,0,0|0,0,2]=4