0 B6R0.6 C(CN=C=O)C#N AB74244 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.6 CCCNCCC AB02251 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.6 COCCCON MB19791 [0,0,0,0,0,0|2,1,0]=3 3 B6R0.6 COCCN=C=O AB50988 [0,0,0,0,0,0|1,1,1]=3 4 B5R0.2 C(CBr)N=C=O AB04619 [1,0,0,0,0,0|2,0,1]=4 5 B5R0.2 C(CC#N)CN AB52761 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.2 C(CCl)N=C=O AB00198 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.2 COCCON MB08235 [1,0,0,0,0,0|2,1,0]=4 8 B7R0.1 CNCCCCC=C CB11323 [0,1,0,0,0,0|2,0,0]=3 9 B7R0.3 COC(=O)CCC=C AB16906 [0,1,0,0,0,0|1,1,1]=4 10 B7R0.4 B(CCCCC)(O)O AB08098 [0,1,0,0,0,0|2,0,1]=4 11 B7R0.4 CC(C)CCN=C=O AB54602 [0,1,0,0,0,0|2,0,1]=4 12 B7R0.4 CCCCO[N+](=O)[O-] AB01790 [0,1,0,0,0,0|3,0,0]=4 13 B7R0.4 CN(C)CCC[Mg]Cl AB55603 [0,1,0,0,0,0|3,0,0]=4 14 B7R0.4 CN(C)CCN=C=O AB74241 [0,1,0,0,0,0|2,0,1]=4 15 B7R1.1 C#CC1CCOC1 PB28898 [0,0,0,1,0,0|1,1,1]=4 16 B7R1.1 C1C=CCC1C=O AB76805 [0,0,0,1,0,0|1,0,1]=3 17 B7R1.1 C1CCC(C1)C=O AB02400 [0,0,0,1,0,0|1,0,0]=2 18 B7R1.1 C1CCC(C1)CBr AB50196 [0,0,0,1,0,0|2,0,1]=4 19 B7R1.1 C1CCC(C1)CI AB15507 [0,0,0,1,0,0|2,0,1]=4 20 B7R1.1 C1CCC(C1)CN AB17884 [0,0,0,1,0,0|2,0,1]=4 21 B7R1.1 C1CNCC1C#N PB12572 [0,0,0,1,0,0|2,0,1]=4 22 B7R1.1 C1CNCC1CO PB15896 [0,0,0,1,0,0|1,0,2]=4 23 B7R1.1 C1CNCC1CO PB31387 [0,0,0,1,0,0|1,0,2]=4 24 B7R1.1 C1CNC[C@@H]1C#N PB25426 [0,0,0,1,0,0|2,0,1]=4 25 B7R1.1 C1CNC[C@@H]1CO PB12644 [0,0,0,1,0,0|1,0,2]=4 26 B7R1.1 C1CNC[C@@H]1CO PB19010 [0,0,0,1,0,0|1,0,2]=4 27 B7R1.1 C1CNC[C@H]1C#N PB10931 [0,0,0,1,0,0|2,0,1]=4 28 B7R1.1 C1CNC[C@H]1CO PB31350 [0,0,0,1,0,0|1,0,2]=4 29 B7R1.1 C1CNC[C@H]1CO PB32765 [0,0,0,1,0,0|1,0,2]=4 30 B7R1.1 C1COCC1C#N PB22187 [0,0,0,1,0,0|1,1,1]=4 31 B7R1.1 C1COCC1CBr PB10518 [0,0,0,1,0,0|1,1,1]=4 32 B7R1.1 C1COCC1CCl MB04735 [0,0,0,1,0,0|1,1,1]=4 33 B7R1.1 C1COCC1CI PB23453 [0,0,0,1,0,0|1,1,1]=4 34 B7R1.1 C1COCC1CN PB10526 [0,0,0,1,0,0|1,1,1]=4 35 B7R1.1 C1COCC1CO PB30586 [0,0,0,1,0,0|0,1,2]=4 36 B7R1.1 C1COC[C@@H]1C#N PB19741 [0,0,0,1,0,0|1,1,1]=4 37 B7R1.1 C1COC[C@@H]1CN PB15453 [0,0,0,1,0,0|1,1,1]=4 38 B7R1.1 C1COC[C@@H]1CO PB30186 [0,0,0,1,0,0|0,1,2]=4 39 B7R1.1 C1COC[C@H]1C#N PB11493 [0,0,0,1,0,0|1,1,1]=4 40 B7R1.1 C1COC[C@H]1CN PB18204 [0,0,0,1,0,0|1,1,1]=4 41 B7R1.1 C1COC[C@H]1CO PB34870 [0,0,0,1,0,0|0,1,2]=4 42 B7R1.1 C1[C@@H](NCS1)C#N AB63804 [0,0,0,1,0,0|2,0,1]=4 43 B7R1.1 C1[C@H](NCS1)C#N AB63801 [0,0,0,1,0,0|2,0,1]=4 44 B7R1.1 CCC1CCCN1 AB12042 [0,0,0,1,0,0|2,0,1]=4 45 B7R1.1 CCC1CCNC1 AB41905 [0,0,0,1,0,0|2,0,1]=4 46 B7R1.1 CC[C@@H]1CCNC1 AB74297 [0,0,0,1,0,0|2,0,1]=4 47 B7R1.1 CNC1CCOC1 PB17482 [0,0,0,1,0,0|2,1,0]=4 48 B7R1.1 CN[C@@H]1CCOC1 PB30485 [0,0,0,1,0,0|2,1,0]=4 49 B7R1.1 CN[C@H]1CCOC1 PB11771 [0,0,0,1,0,0|2,1,0]=4 50 B7R1.1 COC1CCNC1 PB31357 [0,0,0,1,0,0|2,1,0]=4 51 B7R1.1 CO[C@@H]1CCNC1 PB20659 [0,0,0,1,0,0|2,1,0]=4 52 B7R1.1 CO[C@@H]1CCNC1 PB26535 [0,0,0,1,0,0|2,1,0]=4 53 B7R1.1 CO[C@H]1CCNC1 PB10788 [0,0,0,1,0,0|2,1,0]=4 54 B7R1.1 CSC1=NC=NC1 CB10764 [0,0,0,1,0,0|2,0,1]=4 55 B7R1.3 C1CC(=O)CNC1 AB27650 [0,0,0,1,0,0|1,0,0]=2 56 B7R1.3 C1CC(=O)CNC1 PB26241 [0,0,0,1,0,0|1,0,0]=2 57 B7R1.3 C1CC(=O)COC1 PB27461 [0,0,0,1,0,0|0,1,0]=2 58 B7R1.3 C1CC(=O)CSC1 PB28980 [0,0,0,1,0,0|0,0,0]=1 59 B7R1.3 C1CC(CNC1)F PB33693 [0,0,0,1,0,0|2,0,1]=4 60 B7R1.3 C1CC(CNC1)O PB27381 [0,0,0,1,0,0|1,0,2]=4 61 B7R1.3 C1CC(CNC1)S PB34789 [0,0,0,1,0,0|1,1,1]=4 62 B7R1.3 C1CC(COC1)Br MB04535 [0,0,0,1,0,0|1,1,1]=4 63 B7R1.3 C1CC(COC1)N PB30901 [0,0,0,1,0,0|1,1,1]=4 64 B7R1.3 C1CC(COC1)O PB32182 [0,0,0,1,0,0|0,1,2]=4 65 B7R1.3 C1CNC(=O)CN1 PB23229 [0,0,0,1,0,0|2,0,0]=3 66 B7R1.3 C1CNCCC1=O PB32095 [0,0,0,1,0,0|2,0,0]=3 67 B7R1.3 C1COC(=O)CN1 AB71646 [0,0,0,1,0,0|2,0,0]=3 68 B7R1.3 C1COCC(=O)N1 PB29100 [0,0,0,1,0,0|1,1,0]=3 69 B7R1.3 C1COCC(=S)N1 AB72718 [0,0,0,1,0,0|1,2,0]=4 70 B7R1.3 C1COCCC1=O PB24536 [0,0,0,1,0,0|2,0,0]=3 71 B7R1.3 C1CSCCC1=O PB25896 [0,0,0,1,0,0|2,0,0]=3 72 B7R1.3 C1C[C@@H](CNC1)F PB24269 [0,0,0,1,0,0|2,0,1]=4 73 B7R1.3 C1C[C@@H](CNC1)N AB15031 [0,0,0,1,0,0|2,0,1]=4 74 B7R1.3 C1C[C@@H](CNC1)O PB26394 [0,0,0,1,0,0|1,0,2]=4 75 B7R1.3 C1C[C@H](CNC1)F PB38654 [0,0,0,1,0,0|2,0,1]=4 76 B7R1.3 C1C[C@H](CNC1)N AB29962 [0,0,0,1,0,0|2,0,1]=4 77 B7R1.3 C1C[C@H](CNC1)O PB20930 [0,0,0,1,0,0|1,0,2]=4 78 B7R1.3 C1C[C@H](CNC1)O PB25197 [0,0,0,1,0,0|1,0,2]=4 79 B7R1.3 CC1CCCNC1 AB00557 [0,0,0,1,0,0|2,0,1]=4 80 B7R1.4 C1CNC(=O)[C@@H]1N AB64075 [0,0,0,1,0,0|3,0,0]=4 81 B7R1.4 C1CNC(=O)[C@H]1N AB64072 [0,0,0,1,0,0|3,0,0]=4 82 B7R1.4 C1CNC(=O)[C@H]1O AB29512 [0,0,0,1,0,0|3,0,0]=4 83 B7R1.4 C1COC(=O)[C@@H]1O MB00930 [0,0,0,1,0,0|3,0,0]=4 84 B7R1.6 C1C(CO1)CC=O PB14037 [0,0,0,1,0,0|0,1,0]=2 85 B7R1.6 C1C(CO1)CCN AB76310 [0,0,0,1,0,0|1,1,1]=4 86 B7R1.6 C1C(CO1)CCO PB15326 [0,0,0,1,0,0|0,1,2]=4 87 B7R1.6 C1CC(C1)CC=O AB49507 [0,0,0,1,0,0|1,0,0]=2 88 B7R1.6 C1CC(C1)CCN PB23748 [0,0,0,1,0,0|2,0,1]=4 89 B7R1.6 C1CC(C1)N=C=O AB55242 [0,0,0,1,0,0|2,0,1]=4 90 B7R1.6 CNCC1COC1 PB36516 [0,0,0,1,0,0|2,1,0]=4 91 B7R1.6 COCC1CCN1 PB36845 [0,0,0,1,0,0|1,1,1]=4 92 B7R1.6 COCC1CNC1 PB23654 [0,0,0,1,0,0|2,1,0]=4 93 B7R1.6 COC[C@@H]1CCN1 PB36728 [0,0,0,1,0,0|1,1,1]=4 94 B7R1.6 COC[C@H]1CCN1 PB28355 [0,0,0,1,0,0|1,1,1]=4 95 B7R1.7 C1CC1CN=C=O AB71485 [0,0,0,1,0,0|2,0,1]=4 96 B7R1.8 C1CC(=O)C1CO PB37542 [0,0,0,1,0,0|2,0,0]=3 97 B7R1.8 CN1CCC1CN PB37073 [0,0,0,1,0,0|2,0,1]=4 98 B7R1.8 CN1CC[C@@H]1CN PB35830 [0,0,0,1,0,0|2,0,1]=4 99 B7R1.8 CN1CC[C@H]1CN PB38844 [0,0,0,1,0,0|2,0,1]=4 100 B4R0.2 C(CN)CCl AB06220 [2,0,0,0,0,0|2,0,0]=4 101 B4R0.2 C=CCCBr AB00123 [2,0,0,0,0,0|1,0,1]=4 102 B4R0.2 C=CCCN AB14698 [2,0,0,0,0,0|1,0,1]=4 103 B4R0.2 C=CCCO AB00288 [2,0,0,0,0,0|0,1,1]=4 104 B6R0.1 COCC(CO)N AB24949 [1,1,0,0,0,0|0,1,1]=4 105 B6R0.4 C#CCCC(=O)O CB10019 [1,1,0,0,0,0|0,0,2]=4 106 B6R0.4 C=C(CCCCl)I MB13670 [1,1,0,0,0,0|2,0,0]=4 107 B6R0.4 CN(C)CCCBr AB52731 [1,1,0,0,0,0|2,0,0]=4 108 B8R0.5 CCCC(CC(=O)O)N AB01975 [0,2,0,0,0,0|1,0,0]=3 109 B8R0.21 COCCCS(=O)(=O)Cl AB66343 [0,2,0,0,0,0|1,1,0]=4 110 B6R1.1 C1CNCC=C1 PB15670 [1,0,0,1,0,0|1,0,1]=4 111 B6R1.2 C1CNCC1=O PB21807 [1,0,0,1,0,0|1,0,0]=3 112 B6R1.2 C1CNCC1F AB27153 [1,0,0,1,0,0|2,0,0]=4 113 B6R1.2 C1CNCC1F PB27633 [1,0,0,1,0,0|2,0,0]=4 114 B6R1.2 C1CNCC1O PB24775 [1,0,0,1,0,0|1,0,1]=4 115 B6R1.2 C1CNC[C@@H]1F AB27158 [1,0,0,1,0,0|2,0,0]=4 116 B6R1.2 C1CNC[C@@H]1F PB23386 [1,0,0,1,0,0|2,0,0]=4 117 B6R1.2 C1CNC[C@@H]1N AB02820 [1,0,0,1,0,0|2,0,0]=4 118 B6R1.2 C1CNC[C@@H]1O PB17129 [1,0,0,1,0,0|1,0,1]=4 119 B6R1.2 C1CNC[C@@H]1O PB18456 [1,0,0,1,0,0|1,0,1]=4 120 B6R1.2 C1CNC[C@H]1F AB27154 [1,0,0,1,0,0|2,0,0]=4 121 B6R1.2 C1CNC[C@H]1F PB20102 [1,0,0,1,0,0|2,0,0]=4 122 B6R1.2 C1CNC[C@H]1N AB02823 [1,0,0,1,0,0|2,0,0]=4 123 B6R1.2 C1CNC[C@H]1O PB30638 [1,0,0,1,0,0|1,0,1]=4 124 B6R1.2 C1CNC[C@H]1O PB32171 [1,0,0,1,0,0|1,0,1]=4 125 B6R1.2 C1COCC1=O PB17440 [1,0,0,1,0,0|0,1,0]=3 126 B6R1.2 C1COCC1Br PB20333 [1,0,0,1,0,0|1,1,0]=4 127 B6R1.2 C1COCC1I PB14773 [1,0,0,1,0,0|1,1,0]=4 128 B6R1.2 C1COCC1N PB27801 [1,0,0,1,0,0|1,1,0]=4 129 B6R1.2 C1COCC1O PB24525 [1,0,0,1,0,0|0,1,1]=4 130 B6R1.2 C1COC[C@@H]1I PB34863 [1,0,0,1,0,0|1,1,0]=4 131 B6R1.2 C1COC[C@@H]1N PB10514 [1,0,0,1,0,0|1,1,0]=4 132 B6R1.2 C1COC[C@@H]1O PB17096 [1,0,0,1,0,0|0,1,1]=4 133 B6R1.2 C1COC[C@H]1I PB22839 [1,0,0,1,0,0|1,1,0]=4 134 B6R1.2 C1COC[C@H]1N PB18852 [1,0,0,1,0,0|1,1,0]=4 135 B6R1.2 C1COC[C@H]1O PB25950 [1,0,0,1,0,0|0,1,1]=4 136 B6R1.2 C1CONC1=O MB10654 [1,0,0,1,0,0|1,1,0]=4 137 B6R1.2 CC1=CCCO1 AB00300 [1,0,0,1,0,0|2,0,0]=4 138 B6R1.2 CC1CCCN1 AB44503 [1,0,0,1,0,0|1,0,1]=4 139 B6R1.2 CC1CCNC1 AB41901 [1,0,0,1,0,0|1,0,1]=4 140 B6R1.2 C[C@@H]1CCCN1 AB29488 [1,0,0,1,0,0|1,0,1]=4 141 B6R1.2 C[C@@H]1CCCN1 AB42774 [1,0,0,1,0,0|1,0,1]=4 142 B6R1.2 C[C@@H]1CCNC1 AB29518 [1,0,0,1,0,0|1,0,1]=4 143 B6R1.2 C[C@H]1CCCN1 AB29489 [1,0,0,1,0,0|1,0,1]=4 144 B6R1.2 C[C@H]1CCNC1 AB29522 [1,0,0,1,0,0|1,0,1]=4 145 B6R1.3 C1CC1CC#N PB18433 [1,0,0,1,0,0|1,0,1]=4 146 B6R1.3 C1CC1CC=O AB51242 [1,0,0,1,0,0|0,0,0]=2 147 B6R1.3 C1CC1CCN AB23437 [1,0,0,1,0,0|1,0,1]=4 148 B6R1.3 C1CC1CCN PB11093 [1,0,0,1,0,0|1,0,1]=4 149 B6R1.3 C1CC1CCO PB24555 [1,0,0,1,0,0|0,0,2]=4 150 B6R1.3 C1CC1CNN PB30981 [1,0,0,1,0,0|2,0,0]=4 151 B6R1.3 C1CC1CON AB21122 [1,0,0,1,0,0|2,0,0]=4 152 B6R1.3 C1CC1N=C=O AB10805 [1,0,0,1,0,0|1,0,1]=4 153 B6R1.3 C1CC1\C=C\Br AB76480 [1,0,0,1,0,0|1,0,1]=4 154 B6R1.6 C1C(CN1)CO PB34326 [1,0,0,1,0,0|1,0,1]=4 155 B6R1.6 C1C(CO1)C=O AB76630 [1,0,0,1,0,0|0,1,0]=3 156 B6R1.6 C1C(CO1)CCl MB06442 [1,0,0,1,0,0|1,1,0]=4 157 B6R1.6 C1C(CO1)CI PB11384 [1,0,0,1,0,0|1,1,0]=4 158 B6R1.6 C1C(CO1)CN PB26850 [1,0,0,1,0,0|1,1,0]=4 159 B6R1.6 C1C(CO1)CO PB28641 [1,0,0,1,0,0|0,1,1]=4 160 B6R1.6 C1C(CS1)CN PB19286 [1,0,0,1,0,0|1,0,0]=3 161 B6R1.6 C1CC(C1)CN PB27388 [1,0,0,1,0,0|1,0,1]=4 162 B6R1.8 CS[C@@H]1C[C@H]1N MB69372 [1,0,0,1,0,0|1,0,0]=3 163 B8R1.2 C#CC1CCSCC1 PB39036 [0,1,0,1,0,0|1,0,1]=4 164 B8R1.2 C1CC(COC1)C=O AB16155 [0,1,0,1,0,0|0,1,0]=3 165 B8R1.2 C1CC(OC=C1)C=O PB24581 [0,1,0,1,0,0|1,0,1]=4 166 B8R1.2 C1CCNC(C1)C=O AB52540 [0,1,0,1,0,0|1,0,0]=3 167 B8R1.2 C1CCOC(C1)C=O MB05934 [0,1,0,1,0,0|1,0,0]=3 168 B8R1.2 C1CNCCC1C=O AB52543 [0,1,0,1,0,0|1,0,0]=3 169 B8R1.2 C1COCCC1C=O AB14645 [0,1,0,1,0,0|0,1,0]=3 170 B8R1.2 C1CSCCC1C#N PB29580 [0,1,0,1,0,0|1,0,1]=4 171 B8R1.2 C1CSCCC1C=O AB14650 [0,1,0,1,0,0|0,0,0]=2 172 B8R1.2 C1CSCCC1CN PB35740 [0,1,0,1,0,0|1,0,1]=4 173 B8R1.2 C1CSCCC1CO PB28111 [0,1,0,1,0,0|0,0,2]=4 174 B8R1.2 CSC1CCNCC1 PB22682 [0,1,0,1,0,0|1,0,1]=4 175 B8R1.5 C1CCC(=O)C(C1)F MB01688 [0,1,0,1,0,0|1,0,0]=3 176 B8R1.5 C1CNCC(C1=O)F PB20587 [0,1,0,1,0,0|2,0,0]=4 177 B8R1.5 C1COCC(C1=O)Br PB18064 [0,1,0,1,0,0|2,0,0]=4 178 B8R1.5 C1COCC(C1=O)F PB28362 [0,1,0,1,0,0|2,0,0]=4 179 B8R1.5 C1C[C@@H](C(=O)NC1)N AB49759 [0,1,0,1,0,0|2,0,0]=4 180 B8R1.5 C1C[C@H](C(=O)NC1)N AB45380 [0,1,0,1,0,0|2,0,0]=4 181 B8R1.5 CC1C(=O)NCCN1 AB04135 [0,1,0,1,0,0|2,0,0]=4 182 B8R1.5 CC1C(=O)NCCO1 AB71412 [0,1,0,1,0,0|1,1,0]=4 183 B8R1.5 CC1CCNCC1=O PB36769 [0,1,0,1,0,0|1,0,0]=3 184 B8R1.5 CC1CNCCC1=O PB23474 [0,1,0,1,0,0|1,0,0]=3 185 B8R1.5 CC1COCCC1=O PB26907 [0,1,0,1,0,0|1,0,0]=3 186 B8R1.5 CN1CCNCC1=O PB24934 [0,1,0,1,0,0|1,0,0]=3 187 B8R1.5 C[C@@H]1C(=O)NCCN1 AB76857 [0,1,0,1,0,0|2,0,0]=4 188 B8R1.5 C[C@H]1C(=O)NCCN1 AB37140 [0,1,0,1,0,0|2,0,0]=4 189 B8R1.8 C1CC(OC1)CC=O AB76318 [0,1,0,1,0,0|1,0,0]=3 190 B8R1.8 C1CCC(C1)N=C=O AB10807 [0,1,0,1,0,0|1,0,1]=4 191 B8R1.8 C1COCC1CC=O AB75447 [0,1,0,1,0,0|0,1,0]=3 192 B8R1.10 C1CC(C1)CN=C=O AB74239 [0,1,0,1,0,0|1,0,1]=4 193 B8R1.11 C1C(C(=O)CO1)C#N PB39082 [0,1,0,1,0,0|2,0,0]=4 194 B8R1.11 C1C(C(=O)CS1)C#N PB17090 [0,1,0,1,0,0|2,0,0]=4 195 B8R1.11 C1CC(=O)C(=C1)CO MB05797 [0,1,0,1,0,0|1,0,1]=4 196 B8R1.22 C1CC(=O)CCNC1 PB26051 [0,1,0,1,0,0|1,0,0]=3 197 B8R1.22 C1CC(=O)CCOC1 AB76453 [0,1,0,1,0,0|0,1,0]=3 198 B8R1.22 C1CNCC(=O)NC1 AB30280 [0,1,0,1,0,0|1,0,0]=3 199 B8R1.22 C1CNCCNC1=O AB07054 [0,1,0,1,0,0|2,0,0]=4 200 B8R1.1 C1CC(=O)NC1CN AB28123 [0,1,0,1,0,0|2,0,0]=4 201 B8R1.1 C1CC(=O)N[C@@H]1CCl MB07054 [0,1,0,1,0,0|2,0,0]=4 202 B8R1.1 C1CC(=O)N[C@@H]1CN AB28507 [0,1,0,1,0,0|2,0,0]=4 203 B8R1.1 C1CC(=O)N[C@H]1CCl MB06934 [0,1,0,1,0,0|2,0,0]=4 204 B8R1.1 C1CC(=O)N[C@H]1CN AB28509 [0,1,0,1,0,0|2,0,0]=4 205 B8R1.1 C1CC(=O)N[C@H]1CO AB02985 [0,1,0,1,0,0|2,0,0]=4 206 B8R1.3 C1CC(=O)CCC1N AB26267 [0,1,0,1,0,0|1,0,0]=3 207 B8R1.3 C1CC(=O)NCC1N PB22229 [0,1,0,1,0,0|2,0,0]=4 208 B8R1.3 CC1CNC(=O)CN1 AB37204 [0,1,0,1,0,0|2,0,0]=4 209 B8R1.3 CC1CNC(=O)CO1 AB71787 [0,1,0,1,0,0|1,1,0]=4 210 B8R1.3 C[C@@H]1CNC(=O)CN1 AB37209 [0,1,0,1,0,0|2,0,0]=4 211 B8R1.3 C[C@H]1CNC(=O)CN1 AB37206 [0,1,0,1,0,0|2,0,0]=4 212 B8R1.50 C1CN(C(=O)C1N)O AB02803 [0,1,0,1,0,0|2,0,0]=4 213 B8R1.4 C1C(=O)COCC1=O PB14653 [0,1,0,1,0,0|0,1,1]=4 214 B8R1.4 C1C(=O)CSCC1=O PB15832 [0,1,0,1,0,0|0,0,1]=3 215 B8R1.4 C1CC(=CC(=O)C1)I MB07038 [0,1,0,1,0,0|1,0,1]=4 216 B8R1.4 C1CNC(=O)CC1=O PB20308 [0,1,0,1,0,0|2,0,0]=4 217 B8R1.4 C1CNC(=O)CC1N PB11631 [0,1,0,1,0,0|2,0,0]=4 218 B8R1.4 C1CNC(=O)C[C@@H]1O AB29511 [0,1,0,1,0,0|2,0,0]=4 219 B8R1.4 CC1CC(=O)CCN1 PB18889 [0,1,0,1,0,0|2,0,0]=4 220 B8R1.4 CC1CC(=O)CCO1 PB18115 [0,1,0,1,0,0|2,0,0]=4 221 B8R1.4 CC1CNCC(=O)N1 AB37299 [0,1,0,1,0,0|2,0,0]=4 222 B8R1.4 CN1CCCC(=O)C1 AB39316 [0,1,0,1,0,0|1,0,0]=3 223 B8R1.4 C[C@@H]1CC(=O)CCO1 PB35061 [0,1,0,1,0,0|2,0,0]=4 224 B8R1.4 C[C@@H]1CNCC(=O)N1 AB37303 [0,1,0,1,0,0|2,0,0]=4 225 B8R1.4 C[C@H]1CC(=O)CCO1 PB15186 [0,1,0,1,0,0|2,0,0]=4 226 B8R1.4 C[C@H]1CNCC(=O)N1 AB37302 [0,1,0,1,0,0|2,0,0]=4 227 B8R1.7 C1C=CCC1C(=O)O PB14124 [0,1,0,1,0,0|1,0,1]=4 228 B8R1.7 C1CCC(C1)C(=O)O AB00138 [0,1,0,1,0,0|1,0,0]=3 229 B8R1.7 C1CNCC1C(=O)N PB11736 [0,1,0,1,0,0|1,0,0]=3 230 B8R1.7 C1CNCC1C(=O)N PB32691 [0,1,0,1,0,0|1,0,0]=3 231 B8R1.7 C1CNCC1C(=O)O PB19915 [0,1,0,1,0,0|1,0,0]=3 232 B8R1.7 C1CNC[C@@H]1C(=O)N PB14988 [0,1,0,1,0,0|1,0,0]=3 233 B8R1.7 C1CNC[C@@H]1C(=O)O PB16017 [0,1,0,1,0,0|1,0,0]=3 234 B8R1.7 C1CNC[C@H]1C(=O)N PB16436 [0,1,0,1,0,0|1,0,0]=3 235 B8R1.7 C1CNC[C@H]1C(=O)N PB28896 [0,1,0,1,0,0|1,0,0]=3 236 B8R1.7 C1CNC[C@H]1C(=O)O PB10622 [0,1,0,1,0,0|1,0,0]=3 237 B8R1.7 C1COCC1C(=O)N PB20686 [0,1,0,1,0,0|0,1,0]=3 238 B8R1.7 C1COC[C@@H]1C(=O)O PB15879 [0,1,0,1,0,0|0,1,0]=3 239 B8R1.7 C1COC[C@H]1C(=O)O PB26265 [0,1,0,1,0,0|0,1,0]=3 240 B8R1.7 C1C[C@@H](NC1)C(=O)N AB04106 [0,1,0,1,0,0|2,0,0]=4 241 B8R1.7 C1C[C@@H](NC1)C(=O)O AB02582 [0,1,0,1,0,0|2,0,0]=4 242 B8R1.7 C1C[C@H](NC1)C(=O)N AB00394 [0,1,0,1,0,0|2,0,0]=4 243 B8R1.7 C1[C@@H](NCS1)C(=O)O AB03779 [0,1,0,1,0,0|1,0,0]=3 244 B8R1.31 C1CN(C1C(=O)O)N MB69364 [0,1,0,1,0,0|2,0,0]=4 245 B8R1.34 C1C(CN1)CC(=O)O PB17729 [0,1,0,1,0,0|1,0,0]=3 246 B8R1.34 C1C(CO1)CC(=O)O PB15407 [0,1,0,1,0,0|0,1,0]=3 247 B8R1.34 C1C(CO1)C[N+](=O)[O-] AB65636 [0,1,0,1,0,0|1,1,0]=4 248 B8R1.34 CC(=O)NC1CNC1 PB23547 [0,1,0,1,0,0|2,0,0]=4 249 B8R1.34 CC(=O)SC1CNC1 PB19657 [0,1,0,1,0,0|2,0,0]=4 250 B8R1.18 CN1CC(CC1=O)N PB22380 [0,1,0,1,0,0|1,0,0]=3 251 B8R2.42 C1C2(CN1)CSC2 PB22870 [0,0,0,2,0,0|2,0,0]=4