0 B8R1.1 C1=C(N=CC1Cl)C=O PB27576 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.1 C1=NC(=NC1C=O)Br AB56999 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.1 C1=NC(=NC1C=O)Cl AB57000 [0,0,0,0,0,0|3,0,1]=4 3 B8R1.1 C1=NC(=NC1C=O)N AB57912 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.1 C1=NC(=NC1I)C=O AB60579 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.1 CC1=CN=C(C1)C=O AB43814 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.1 CC1=NC(=CC1)C=O AB43978 [0,0,0,0,0,0|1,0,1]=2 7 B8R1.1 CC1=NC(=NC1)C=O AB22828 [0,0,0,0,0,0|2,0,1]=3 8 B8R1.1 CC1=NN=C(C1)C=O AB49641 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.1 CCc1cnc(o1)N AB64704 [0,0,0,0,0,0|3,0,1]=4 10 B8R1.1 Cc1[nH]c(cn1)C=O AB05024 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.1 Cc1[nH]c(cn1)CCl AB57911 [0,0,0,0,0,0|3,0,1]=4 12 B8R1.1 Cc1[nH]c(cn1)CN AB57919 [0,0,0,0,0,0|3,0,1]=4 13 B8R1.1 Cc1[nH]c(cn1)CO AB57908 [0,0,0,0,0,0|2,0,2]=4 14 B8R1.1 Cc1[nH]c(nn1)C=O AB57354 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.1 Cc1cc(oc1)CN PB24200 [0,0,0,0,0,0|3,0,1]=4 16 B8R1.1 Cc1cc(on1)C=O CB11269 [0,0,0,0,0,0|3,0,0]=3 17 B8R1.1 Cc1cc(sc1)CCl AB72607 [0,0,0,0,0,0|3,0,1]=4 18 B8R1.1 Cc1cc(sc1)CN AB25763 [0,0,0,0,0,0|3,0,1]=4 19 B8R1.1 Cc1ccc(s1)C#N PB12235 [0,0,0,0,0,0|1,1,1]=3 20 B8R1.1 Cc1ccc(s1)C=O AB00417 [0,0,0,0,0,0|0,1,0]=1 21 B8R1.1 Cc1ccc(s1)CCl AB50993 [0,0,0,0,0,0|1,1,1]=3 22 B8R1.1 Cc1ccc(s1)CN AB07827 [0,0,0,0,0,0|1,1,1]=3 23 B8R1.1 Cc1cnc(o1)CO AB63479 [0,0,0,0,0,0|1,0,2]=3 24 B8R1.1 Cc1cnc(o1)NC AB65971 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.1 Cc1cnc(s1)C=O AB43202 [0,0,0,0,0,0|1,1,0]=2 26 B8R1.1 Cc1cnc(s1)CCl AB43206 [0,0,0,0,0,0|2,1,1]=4 27 B8R1.1 Cc1cnc(s1)CN AB43201 [0,0,0,0,0,0|2,1,1]=4 28 B8R1.1 Cc1coc(n1)C=O PB28183 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.1 Cc1coc(n1)CCl AB70149 [0,0,0,0,0,0|3,0,1]=4 30 B8R1.1 Cc1coc(n1)CN AB70147 [0,0,0,0,0,0|3,0,1]=4 31 B8R1.1 Cc1coc(n1)NC AB65967 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.1 Cc1csc(n1)C#N PB10548 [0,0,0,0,0,0|3,0,1]=4 33 B8R1.1 Cc1csc(n1)C=O PB14084 [0,0,0,0,0,0|2,0,0]=2 34 B8R1.1 Cc1csc(n1)CCl AB43168 [0,0,0,0,0,0|3,0,1]=4 35 B8R1.1 Cc1csc(n1)CN AB59755 [0,0,0,0,0,0|3,0,1]=4 36 B8R1.1 Cc1csc(n1)CO AB44110 [0,0,0,0,0,0|2,0,2]=4 37 B8R1.1 Cc1csc(n1)NC AB10516 [0,0,0,0,0,0|4,0,0]=4 38 B8R1.1 Cc1nc(co1)C=O AB13940 [0,0,0,0,0,0|2,0,0]=2 39 B8R1.1 Cc1nc(co1)CCl AB45871 [0,0,0,0,0,0|3,0,1]=4 40 B8R1.1 Cc1nc(co1)CN AB54740 [0,0,0,0,0,0|3,0,1]=4 41 B8R1.1 Cc1nc(co1)CO AB48508 [0,0,0,0,0,0|2,0,2]=4 42 B8R1.1 Cc1nc(cs1)C=O AB25415 [0,0,0,0,0,0|2,0,0]=2 43 B8R1.1 Cc1nc(cs1)CCl AB02129 [0,0,0,0,0,0|3,0,1]=4 44 B8R1.1 Cc1nc(cs1)CN AB23320 [0,0,0,0,0,0|3,0,1]=4 45 B8R1.1 Cc1nc(on1)C=O AB57238 [0,0,0,0,0,0|3,0,0]=3 46 B8R1.1 Cc1ncc(o1)C=O AB27658 [0,0,0,0,0,0|1,0,0]=1 47 B8R1.1 Cc1ncc(o1)CCl AB70153 [0,0,0,0,0,0|2,0,1]=3 48 B8R1.1 Cc1ncc(o1)CN AB64071 [0,0,0,0,0,0|2,0,1]=3 49 B8R1.1 Cc1ncc(s1)C=O CB11336 [0,0,0,0,0,0|1,1,0]=2 50 B8R1.1 Cc1nnc(o1)C=O AB57523 [0,0,0,0,0,0|2,0,0]=2 51 B8R1.1 Cc1nnc(o1)CCl AB25410 [0,0,0,0,0,0|3,0,1]=4 52 B8R1.1 Cc1nnc(o1)CN AB28132 [0,0,0,0,0,0|3,0,1]=4 53 B8R1.1 Cc1nnc(o1)CN AB28474 [0,0,0,0,0,0|3,0,1]=4 54 B8R1.1 Cc1nnc(s1)C=O AB62638 [0,0,0,0,0,0|2,1,0]=3 55 B8R1.1 Cn1cc(cn1)C=O PB23185 [0,0,0,0,0,0|3,0,0]=3 56 B8R1.1 Cn1cc(nc1)C=O PB24797 [0,0,0,0,0,0|3,0,0]=3 57 B8R1.1 Cn1cc(nn1)C=O AB57105 [0,0,0,0,0,0|4,0,0]=4 58 B8R1.1 Cn1ccc(c1)CN AB48514 [0,0,0,0,0,0|3,0,1]=4 59 B8R1.1 Cn1ccc(c1)CO AB09760 [0,0,0,0,0,0|2,0,2]=4 60 B8R1.1 Cn1ccc(n1)C#N PB29091 [0,0,0,0,0,0|3,0,1]=4 61 B8R1.1 Cn1ccc(n1)C=O AB14508 [0,0,0,0,0,0|2,0,0]=2 62 B8R1.1 Cn1ccc(n1)CBr AB27867 [0,0,0,0,0,0|3,0,1]=4 63 B8R1.1 Cn1ccc(n1)CN PB29254 [0,0,0,0,0,0|3,0,1]=4 64 B8R1.1 Cn1ccc(n1)CO PB20290 [0,0,0,0,0,0|2,0,2]=4 65 B8R1.1 c1c(csc1Br)C=O PB31345 [0,0,0,0,0,0|3,0,0]=3 66 B8R1.1 c1c(csc1C=O)Br PB24526 [0,0,0,0,0,0|3,0,0]=3 67 B8R1.1 c1c(csc1C=O)Cl PB20572 [0,0,0,0,0,0|3,0,0]=3 68 B8R1.1 c1c(csc1Cl)C=O PB18241 [0,0,0,0,0,0|3,0,0]=3 69 B8R1.1 c1c(nc(o1)Cl)C=O AB68328 [0,0,0,0,0,0|3,0,0]=3 70 B8R1.1 c1c(onc1Br)C=O AB52798 [0,0,0,0,0,0|4,0,0]=4 71 B8R1.1 c1c(sc(n1)Br)C=O AB16053 [0,0,0,0,0,0|2,1,0]=3 72 B8R1.1 c1c(sc(n1)C=O)Br PB22294 [0,0,0,0,0,0|2,1,0]=3 73 B8R1.1 c1c(sc(n1)C=O)Cl PB22169 [0,0,0,0,0,0|2,1,0]=3 74 B8R1.1 c1c(sc(n1)Cl)C=O PB14244 [0,0,0,0,0,0|2,1,0]=3 75 B8R1.1 c1c(sc(n1)N)C=O AB11362 [0,0,0,0,0,0|2,1,0]=3 76 B8R1.1 c1cc(sc1C#N)Br PB23415 [0,0,0,0,0,0|2,1,1]=4 77 B8R1.1 c1cc(sc1C#N)Cl PB17611 [0,0,0,0,0,0|2,1,1]=4 78 B8R1.1 c1cc(sc1C#N)F PB20534 [0,0,0,0,0,0|2,1,1]=4 79 B8R1.1 c1cc(sc1C=O)Br PB32069 [0,0,0,0,0,0|1,1,0]=2 80 B8R1.1 c1cc(sc1C=O)Cl PB17085 [0,0,0,0,0,0|1,1,0]=2 81 B8R1.1 c1cc(sc1CCl)Cl AB00990 [0,0,0,0,0,0|2,1,1]=4 82 B8R1.1 c1cc(sc1CN)Br PB24892 [0,0,0,0,0,0|2,1,1]=4 83 B8R1.1 c1cc(sc1CN)Cl PB22134 [0,0,0,0,0,0|2,1,1]=4 84 B8R1.1 c1cc(sc1CN)F PB33422 [0,0,0,0,0,0|2,1,1]=4 85 B8R1.1 c1cc(sc1CO)Br PB23435 [0,0,0,0,0,0|1,1,2]=4 86 B8R1.1 c1cc(sc1CO)Cl PB23436 [0,0,0,0,0,0|1,1,2]=4 87 B8R1.1 c1cc(sc1CO)F PB31763 [0,0,0,0,0,0|1,1,2]=4 88 B7R1.1 C1=NC=NC1C=O PB14141 [1,0,0,0,0,0|2,0,1]=4 89 B7R1.1 C1C=C(C=N1)C=O AB15013 [1,0,0,0,0,0|2,0,1]=4 90 B7R1.1 C1C=C(N=N1)C=O AB25611 [1,0,0,0,0,0|2,0,1]=4 91 B7R1.1 C1C=CCC1C=O AB76805 [1,0,0,0,0,0|1,0,2]=4 92 B7R1.1 C1C=CN=C1C=O AB00388 [1,0,0,0,0,0|1,0,1]=3 93 B7R1.1 c1[nH]c(nn1)C=O AB48516 [1,0,0,0,0,0|3,0,0]=4 94 B7R1.1 c1[nH]nc(n1)C=O AB63486 [1,0,0,0,0,0|3,0,0]=4 95 B7R1.1 c1c(con1)C=O AB11289 [1,0,0,0,0,0|3,0,0]=4 96 B7R1.1 c1c(csn1)C=O AB62620 [1,0,0,0,0,0|3,0,0]=4 97 B7R1.1 c1c(nco1)C=O PB23292 [1,0,0,0,0,0|2,0,0]=3 98 B7R1.1 c1c(ncs1)C=O AB06592 [1,0,0,0,0,0|2,0,0]=3 99 B7R1.1 c1c(ocn1)C#N AB19309 [1,0,0,0,0,0|2,0,1]=4 100 B7R1.1 c1c(ocn1)C=O AB11283 [1,0,0,0,0,0|1,0,0]=2 101 B7R1.1 c1c(ocn1)CCl AB42450 [1,0,0,0,0,0|2,0,1]=4 102 B7R1.1 c1c(ocn1)CN AB30442 [1,0,0,0,0,0|2,0,1]=4 103 B7R1.1 c1c(ocn1)CO PB32681 [1,0,0,0,0,0|1,0,2]=4 104 B7R1.1 c1c(scn1)C=O AB11293 [1,0,0,0,0,0|1,1,0]=3 105 B7R1.1 c1cc(oc1)C#N AB00309 [1,0,0,0,0,0|1,0,1]=3 106 B7R1.1 c1cc(oc1)CCl MB06568 [1,0,0,0,0,0|1,0,1]=3 107 B7R1.1 c1cc(sc1)CN PB17027 [1,0,0,0,0,0|1,1,1]=4 108 B7R1.1 c1cc(sc1)CO PB10001 [1,0,0,0,0,0|0,1,2]=4 109 B7R1.1 c1cn(nn1)C=O MB06576 [1,0,0,0,0,0|3,0,0]=4 110 B7R1.1 c1cnoc1CN AB27950 [1,0,0,0,0,0|2,0,1]=4 111 B7R1.1 c1cnoc1CN AB27954 [1,0,0,0,0,0|2,0,1]=4 112 B7R1.1 c1cnoc1CO AB28102 [1,0,0,0,0,0|1,0,2]=4 113 B7R1.1 c1cnsc1C=O AB32448 [1,0,0,0,0,0|1,1,0]=3 114 B7R1.1 c1coc(n1)C=O AB14413 [1,0,0,0,0,0|1,0,0]=2 115 B7R1.1 c1coc(n1)CCl AB19278 [1,0,0,0,0,0|2,0,1]=4 116 B7R1.1 c1coc(n1)CN AB19275 [1,0,0,0,0,0|2,0,1]=4 117 B7R1.1 c1coc(n1)CN AB28202 [1,0,0,0,0,0|2,0,1]=4 118 B7R1.1 c1coc(n1)CO PB27948 [1,0,0,0,0,0|1,0,2]=4 119 B7R1.1 c1conc1C=O PB26237 [1,0,0,0,0,0|2,0,0]=3 120 B7R1.1 c1csc(n1)C=O PB12109 [1,0,0,0,0,0|1,1,0]=3 121 B7R1.1 c1cscc1C=O PB14065 [1,0,0,0,0,0|2,0,0]=3 122 B7R1.2 CC1=NC(=O)N=C1 AB05017 [1,0,0,0,0,0|2,0,0]=3 123 B7R1.2 Cc1[nH]c(cn1)Cl AB58131 [1,0,0,0,0,0|3,0,0]=4 124 B7R1.2 Cc1[nH]cc(n1)Br AB14336 [1,0,0,0,0,0|3,0,0]=4 125 B7R1.2 Cc1[nH]cc(n1)N AB60590 [1,0,0,0,0,0|3,0,0]=4 126 B7R1.2 Cc1cc(cs1)Br AB20690 [1,0,0,0,0,0|3,0,0]=4 127 B7R1.2 Cc1cc(sc1)C CB10250 [1,0,0,0,0,0|2,0,1]=4 128 B7R1.2 Cc1ccc(o1)Br AB64979 [1,0,0,0,0,0|1,0,0]=2 129 B7R1.2 Cc1ccn(n1)C PB27396 [1,0,0,0,0,0|2,0,1]=4 130 B7R1.2 Cc1cnc(o1)Br AB71573 [1,0,0,0,0,0|2,0,0]=3 131 B7R1.2 Cc1cnc(o1)C AB72158 [1,0,0,0,0,0|1,0,1]=3 132 B7R1.2 Cc1cnc(o1)Cl AB53091 [1,0,0,0,0,0|2,0,0]=3 133 B7R1.2 Cc1cnc(o1)N AB52683 [1,0,0,0,0,0|2,0,0]=3 134 B7R1.2 Cc1cnc(o1)O AB53086 [1,0,0,0,0,0|1,0,1]=3 135 B7R1.2 Cc1cnc(s1)Br AB45716 [1,0,0,0,0,0|2,1,0]=4 136 B7R1.2 Cc1cnc(s1)Cl AB13892 [1,0,0,0,0,0|2,1,0]=4 137 B7R1.2 Cc1cnc(s1)N AB03001 [1,0,0,0,0,0|2,1,0]=4 138 B7R1.2 Cc1cnc(s1)O AB53102 [1,0,0,0,0,0|1,1,1]=4 139 B7R1.2 Cc1coc(n1)Br AB68303 [1,0,0,0,0,0|3,0,0]=4 140 B7R1.2 Cc1coc(n1)Cl AB68302 [1,0,0,0,0,0|3,0,0]=4 141 B7R1.2 Cc1coc(n1)N PB17112 [1,0,0,0,0,0|3,0,0]=4 142 B7R1.2 Cc1csc(n1)Br PB26224 [1,0,0,0,0,0|3,0,0]=4 143 B7R1.2 Cc1csc(n1)N AB00403 [1,0,0,0,0,0|3,0,0]=4 144 B7R1.2 Cc1nc(co1)N MB11373 [1,0,0,0,0,0|3,0,0]=4 145 B7R1.2 Cc1nc(cs1)Br AB23819 [1,0,0,0,0,0|3,0,0]=4 146 B7R1.2 Cc1ncc(o1)N MB11377 [1,0,0,0,0,0|2,0,0]=3 147 B7R1.2 Cc1ncc(s1)Br AB54339 [1,0,0,0,0,0|2,1,0]=4 148 B7R1.2 Cc1nnc(o1)N PB23353 [1,0,0,0,0,0|3,0,0]=4 149 B7R1.2 Cn1ccc(c1)Br AB63663 [1,0,0,0,0,0|3,0,0]=4 150 B7R1.2 Cn1ccc(n1)Br PB19136 [1,0,0,0,0,0|3,0,0]=4 151 B7R1.2 Cn1ccc(n1)I PB26365 [1,0,0,0,0,0|3,0,0]=4 152 B7R1.2 Cn1ccc(n1)N PB12171 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.21 CCC1=NN=C(C1)C=O AB60562 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.21 CCc1[nH]c(cn1)C=O AB08501 [0,1,0,0,0,0|2,0,0]=3 155 B9R1.21 CCc1[nH]c(nn1)C=O AB57357 [0,1,0,0,0,0|3,0,0]=4 156 B9R1.21 CCc1nc(on1)C=O AB57239 [0,1,0,0,0,0|3,0,0]=4 157 B9R1.21 CCc1nnc(o1)C=O AB57527 [0,1,0,0,0,0|2,0,0]=3 158 B9R1.21 COc1[nH]cc(n1)C=O AB57915 [0,1,0,0,0,0|2,0,0]=3 159 B9R1.21 COc1ncc(s1)C=O AB50989 [0,1,0,0,0,0|1,1,0]=3 160 B9R1.21 CSC1=NN=C(C1)C=O MB14625 [0,1,0,0,0,0|3,0,0]=4 161 B9R1.21 CSc1[nH]c(cn1)C=O AB56996 [0,1,0,0,0,0|2,0,0]=3 162 B9R1.21 c1c(nc(o1)C=O)C=O AB71575 [0,1,0,0,0,0|2,0,1]=4 163 B9R1.21 c1c(nc(o1)C=O)CCl AB71576 [0,1,0,0,0,0|2,0,0]=3 164 B9R1.21 c1cc(oc1C=O)C#N AB44041 [0,1,0,0,0,0|0,0,1]=2 165 B9R1.21 c1cc(oc1CO)C#N AB44038 [0,1,0,0,0,0|1,0,1]=3 166 B9R1.21 c1cc(sc1CBr)C#N AB44189 [0,1,0,0,0,0|1,1,1]=4 167 B9R1.21 c1cc(sc1CCl)C#N AB72609 [0,1,0,0,0,0|1,1,1]=4 168 B9R1.21 c1cc(sc1CN)C#N AB45511 [0,1,0,0,0,0|1,1,1]=4 169 B9R1.22 C(=O)c1c(nc(s1)Cl)Cl AB07132 [0,1,0,0,0,0|2,1,0]=4 170 B9R1.22 Cc1c(cn(n1)C)C=O AB04183 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.22 Cc1c(oc(n1)C)C=O AB27656 [0,1,0,0,0,0|1,0,0]=2 172 B9R1.22 Cc1c(oc(n1)C)CO MB08849 [0,1,0,0,0,0|1,0,2]=4 173 B9R1.22 Cc1c(oc(n1)Cl)C=O AB71590 [0,1,0,0,0,0|2,0,0]=3 174 B9R1.22 Cc1cc(c(s1)C#N)N AB48292 [0,1,0,0,0,0|1,1,1]=4 175 B9R1.22 Cc1cc(n(n1)C)C=O AB12155 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.22 Cc1cc(sc1C=O)Br AB55882 [0,1,0,0,0,0|1,1,0]=3 177 B9R1.23 C1=C(C(=NC1C=O)Br)Br AB30821 [0,1,0,0,0,0|2,0,1]=4 178 B9R1.23 Cc1c(oc(n1)NC)C AB65970 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.23 Cc1cc(sc1Br)C=O PB24914 [0,1,0,0,0,0|1,1,0]=3 180 B9R1.23 Cc1cc(sc1C)CN AB72614 [0,1,0,0,0,0|1,1,1]=4 181 B9R1.23 Cc1nc(nn1C)C=O AB76716 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.35 B(c1ccc(o1)C)(O)O AB08313 [0,1,0,0,0,0|1,0,1]=3 183 B9R1.35 B(c1ccc(s1)C)(O)O PB21738 [0,1,0,0,0,0|1,1,1]=4 184 B9R1.35 C1=NC(=O)N=C1C(=O)O AB09197 [0,1,0,0,0,0|3,0,0]=4 185 B9R1.35 C1C=C(N=C1Br)C(=O)N PB34419 [0,1,0,0,0,0|2,0,1]=4 186 B9R1.35 C1C=C(N=C1Br)C(=O)O MB19809 [0,1,0,0,0,0|2,0,1]=4 187 B9R1.35 CC(=O)C1=NC=C(C1)Cl AB52884 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.35 CC(=O)c1cc(cs1)Cl PB13009 [0,1,0,0,0,0|3,0,0]=4 189 B9R1.35 CC(=O)c1cc(sc1)Br AB71462 [0,1,0,0,0,0|3,0,0]=4 190 B9R1.35 CC(=O)c1cc(sc1)Cl PB18443 [0,1,0,0,0,0|3,0,0]=4 191 B9R1.35 CC(=O)c1ccc(o1)Br AB25597 [0,1,0,0,0,0|1,0,0]=2 192 B9R1.35 CC(=O)c1ccc(s1)Br PB24550 [0,1,0,0,0,0|1,1,0]=3 193 B9R1.35 CC(=O)c1ccc(s1)Cl PB11578 [0,1,0,0,0,0|1,1,0]=3 194 B9R1.35 CC(=O)c1cnc(o1)N AB54806 [0,1,0,0,0,0|2,0,0]=3 195 B9R1.35 CC(=O)c1cnc(s1)Br AB69536 [0,1,0,0,0,0|2,1,0]=4 196 B9R1.35 CC(=O)c1cnc(s1)N AB07075 [0,1,0,0,0,0|2,1,0]=4 197 B9R1.35 CC(=O)c1coc(n1)Cl AB77007 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.35 CC(=O)c1nc(cs1)Br AB59795 [0,1,0,0,0,0|3,0,0]=4 199 B9R1.35 CC(=O)c1ncc(s1)Br PB19039 [0,1,0,0,0,0|2,1,0]=4 200 B9R1.35 CC(=O)c1ncc(s1)Cl PB35653 [0,1,0,0,0,0|2,1,0]=4 201 B9R1.35 CC1=NC(=NC1)C(=O)O AB53262 [0,1,0,0,0,0|2,0,1]=4 202 B9R1.35 CC1=NN=C(C1)C(=O)O PB13019 [0,1,0,0,0,0|3,0,0]=4 203 B9R1.35 Cc1[nH]c(cn1)C(=O)C AB51549 [0,1,0,0,0,0|2,0,0]=3 204 B9R1.35 Cc1[nH]c(cn1)C(=O)O AB05025 [0,1,0,0,0,0|2,0,0]=3 205 B9R1.35 Cc1[nH]c(nn1)C(=O)O AB12749 [0,1,0,0,0,0|3,0,0]=4 206 B9R1.35 Cc1[nH]c(nn1)C(=O)O AB57423 [0,1,0,0,0,0|3,0,0]=4 207 B9R1.35 Cc1cc(cs1)C(=O)O PB14265 [0,1,0,0,0,0|2,0,0]=3 208 B9R1.35 Cc1cc(no1)C(=O)O CB10494 [0,1,0,0,0,0|3,0,0]=4 209 B9R1.35 Cc1cc(sc1)C(=O)O PB14117 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.35 Cc1ccc(s1)C(=O)C AB01148 [0,1,0,0,0,0|0,1,0]=2 211 B9R1.35 Cc1ccc(s1)C(=O)O AB00425 [0,1,0,0,0,0|0,1,0]=2 212 B9R1.35 Cc1cnc(o1)C(=O)O AB53258 [0,1,0,0,0,0|1,0,0]=2 213 B9R1.35 Cc1cnc(s1)C(=O)O AB43204 [0,1,0,0,0,0|1,1,0]=3 214 B9R1.35 Cc1coc(n1)C(=O)O PB31618 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.35 Cc1csc(n1)C(=O)C AB32246 [0,1,0,0,0,0|2,0,0]=3 216 B9R1.35 Cc1csc(n1)C(=O)O PB26270 [0,1,0,0,0,0|2,0,0]=3 217 B9R1.35 Cc1nc(co1)C(=O)O AB05124 [0,1,0,0,0,0|2,0,0]=3 218 B9R1.35 Cc1nc(cs1)C(=O)O AB14027 [0,1,0,0,0,0|2,0,0]=3 219 B9R1.35 Cc1nc(no1)C(=O)O AB44082 [0,1,0,0,0,0|3,0,0]=4 220 B9R1.35 Cc1nc(on1)C(=O)O AB55970 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.35 Cc1ncc(s1)C(=O)O PB12949 [0,1,0,0,0,0|1,1,0]=3 222 B9R1.35 Cc1nnc(o1)C(=O)[O-] PB14509 [0,1,0,0,0,0|2,0,0]=3 223 B9R1.35 Cc1nnc(s1)C(=O)O AB65141 [0,1,0,0,0,0|2,1,0]=4 224 B9R1.35 Cn1cc(cn1)C(=O)O PB27447 [0,1,0,0,0,0|3,0,0]=4 225 B9R1.35 Cn1cc(nc1)C(=O)O PB21172 [0,1,0,0,0,0|3,0,0]=4 226 B9R1.35 Cn1ccc(n1)C(=O)O PB29090 [0,1,0,0,0,0|2,0,0]=3 227 B9R1.35 c1c(coc1Br)C(=O)O AB45895 [0,1,0,0,0,0|3,0,0]=4 228 B9R1.35 c1c(coc1C(=O)N)Br AB65725 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.35 c1c(coc1C(=O)O)Br AB03318 [0,1,0,0,0,0|3,0,0]=4 230 B9R1.35 c1c(csc1Br)C(=O)O PB20302 [0,1,0,0,0,0|3,0,0]=4 231 B9R1.35 c1c(csc1C(=O)N)Br AB53759 [0,1,0,0,0,0|3,0,0]=4 232 B9R1.35 c1c(csc1C(=O)O)Br PB29256 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.35 c1c(csc1C(=O)O)Cl PB25964 [0,1,0,0,0,0|3,0,0]=4 234 B9R1.35 c1c(csc1Cl)C(=O)N AB09992 [0,1,0,0,0,0|3,0,0]=4 235 B9R1.35 c1c(csc1Cl)C(=O)O PB17106 [0,1,0,0,0,0|3,0,0]=4 236 B9R1.35 c1c(csc1F)C(=O)O PB18609 [0,1,0,0,0,0|3,0,0]=4 237 B9R1.35 c1c(nc(o1)Br)C(=O)O PB14959 [0,1,0,0,0,0|3,0,0]=4 238 B9R1.35 c1c(nc(o1)C(=O)O)Br AB59761 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.35 c1c(nc(o1)Cl)C(=O)O PB20528 [0,1,0,0,0,0|3,0,0]=4 240 B9R1.35 c1c(nc(o1)N)C(=O)O PB31410 [0,1,0,0,0,0|3,0,0]=4 241 B9R1.35 c1c(nc(s1)Br)C(=O)N MB10372 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.35 c1c(nc(s1)Br)C(=O)O AB20482 [0,1,0,0,0,0|3,0,0]=4 243 B9R1.35 c1c(nc(s1)C(=O)N)Br AB65719 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.35 c1c(nc(s1)C(=O)O)Br PB32743 [0,1,0,0,0,0|3,0,0]=4 245 B9R1.35 c1c(nc(s1)Cl)C(=O)O CB11341 [0,1,0,0,0,0|3,0,0]=4 246 B9R1.35 c1c(nc(s1)N)C(=O)O AB07466 [0,1,0,0,0,0|3,0,0]=4 247 B9R1.35 c1c(sc(n1)Br)C(=O)N MB08396 [0,1,0,0,0,0|2,1,0]=4 248 B9R1.35 c1c(sc(n1)Br)C(=O)O PB12322 [0,1,0,0,0,0|2,1,0]=4 249 B9R1.35 c1c(sc(n1)C(=O)N)Br MB14267 [0,1,0,0,0,0|2,1,0]=4 250 B9R1.35 c1c(sc(n1)C(=O)O)Br PB31583 [0,1,0,0,0,0|2,1,0]=4 251 B9R1.35 c1c(sc(n1)C(=O)O)Cl PB26550 [0,1,0,0,0,0|2,1,0]=4 252 B9R1.35 c1c(sc(n1)C(=O)O)N PB33442 [0,1,0,0,0,0|2,1,0]=4 253 B9R1.35 c1c(sc(n1)C(=O)O)N PB37974 [0,1,0,0,0,0|2,1,0]=4 254 B9R1.35 c1c(sc(n1)N)C(=O)O AB23200 [0,1,0,0,0,0|2,1,0]=4 255 B9R1.35 c1cc(sc1C(=O)Cl)Cl AB01959 [0,1,0,0,0,0|1,1,0]=3 256 B9R1.35 c1cc(sc1C(=O)O)Br PB21666 [0,1,0,0,0,0|1,1,0]=3 257 B9R1.35 c1cc(sc1C(=O)O)Cl PB12047 [0,1,0,0,0,0|1,1,0]=3 258 B9R1.35 c1cc(sc1C(=O)O)F PB22097 [0,1,0,0,0,0|1,1,0]=3 259 B9R1.35 c1cc(sc1C(=O)O)N MB07244 [0,1,0,0,0,0|1,1,0]=3 260 B9R1.132 CC1=C(C(=NC1)C=O)C PB21628 [0,1,0,0,0,0|2,0,1]=4 261 B9R1.132 Cc1cnc(n1C)C=O AB62623 [0,1,0,0,0,0|2,0,0]=3 262 B9R1.132 Cc1nnc(n1C)C=O AB45819 [0,1,0,0,0,0|3,0,0]=4 263 B9R1.132 Cn1c(c(cn1)C=O)Cl AB71399 [0,1,0,0,0,0|3,0,0]=4 264 B9R1.132 Cn1c(cnc1Br)C=O AB56934 [0,1,0,0,0,0|3,0,0]=4 265 B9R1.132 Cn1c(cnc1Cl)C=O AB56928 [0,1,0,0,0,0|3,0,0]=4 266 B9R1.1 C1C(=O)N=CC(=N1)C=O AB60510 [0,0,0,0,0,1|3,0,0]=4 267 B9R1.1 Cc1ccc(cn1)C#N PB30561 [0,0,0,0,0,1|2,0,1]=4 268 B9R1.1 Cc1ccc(cn1)C=C PB17233 [0,0,0,0,0,1|2,0,0]=3 269 B9R1.1 Cc1ccc(cn1)C=O PB17503 [0,0,0,0,0,1|1,0,0]=2 270 B9R1.1 Cc1ccc(cn1)CCl AB59938 [0,0,0,0,0,1|2,0,1]=4 271 B9R1.1 Cc1ccc(cn1)CN PB20145 [0,0,0,0,0,1|2,0,1]=4 272 B9R1.1 Cc1ccc(cn1)NN PB15841 [0,0,0,0,0,1|3,0,0]=4 273 B9R1.1 Cc1ccc(cn1)OC AB52739 [0,0,0,0,0,1|3,0,0]=4 274 B9R1.1 Cc1ccc(nc1)C=O AB31466 [0,0,0,0,0,1|1,0,0]=2 275 B9R1.1 Cc1ccc(nc1)CCl AB59994 [0,0,0,0,0,1|2,0,1]=4 276 B9R1.1 Cc1ccc(nc1)CN AB48926 [0,0,0,0,0,1|2,0,1]=4 277 B9R1.1 Cc1ccc(nn1)C#N PB21293 [0,0,0,0,0,1|2,0,1]=4 278 B9R1.1 Cc1ccc(nn1)C=O AB44106 [0,0,0,0,0,1|1,0,0]=2 279 B9R1.1 Cc1ccc(nn1)CN PB19500 [0,0,0,0,0,1|2,0,1]=4 280 B9R1.1 Cc1ccc(nn1)CO AB44109 [0,0,0,0,0,1|1,0,2]=4 281 B9R1.1 Cc1ccc(nn1)NN AB02752 [0,0,0,0,0,1|3,0,0]=4 282 B9R1.1 Cc1ccc(nn1)OC AB51434 [0,0,0,0,0,1|3,0,0]=4 283 B9R1.1 Cc1cnc(cn1)C=O PB23818 [0,0,0,0,0,1|2,0,0]=3 284 B9R1.1 Cc1cnc(nc1)C=O PB31489 [0,0,0,0,0,1|2,0,0]=3 285 B9R1.1 Cc1ncc(cn1)C=O PB13046 [0,0,0,0,0,1|2,0,0]=3 286 B9R1.1 c1c(cnc(n1)C=O)Br AB59082 [0,0,0,0,0,1|3,0,0]=4 287 B9R1.1 c1c(cnc(n1)C=O)Cl PB22417 [0,0,0,0,0,1|3,0,0]=4 288 B9R1.1 c1c(cnc(n1)C=O)F PB26883 [0,0,0,0,0,1|3,0,0]=4 289 B9R1.1 c1c(cnc(n1)C=O)N AB58984 [0,0,0,0,0,1|3,0,0]=4 290 B9R1.1 c1c(cnc(n1)C=O)O AB59744 [0,0,0,0,0,1|3,0,0]=4 291 B9R1.1 c1c(cnc(n1)Cl)C=O PB31481 [0,0,0,0,0,1|3,0,0]=4 292 B9R1.1 c1c(cnc(n1)N)C=O PB12291 [0,0,0,0,0,1|3,0,0]=4 293 B9R1.1 c1c(cnc(n1)O)C=O AB58472 [0,0,0,0,0,1|3,0,0]=4 294 B9R1.1 c1c(ncc(n1)Cl)C=O PB20478 [0,0,0,0,0,1|3,0,0]=4 295 B9R1.1 c1cc(ncc1Br)C=O PB30785 [0,0,0,0,0,1|2,0,0]=3 296 B9R1.1 c1cc(ncc1C=O)Br PB27654 [0,0,0,0,0,1|2,0,0]=3 297 B9R1.1 c1cc(ncc1C=O)Cl PB18586 [0,0,0,0,0,1|2,0,0]=3 298 B9R1.1 c1cc(ncc1C=O)F PB23560 [0,0,0,0,0,1|2,0,0]=3 299 B9R1.1 c1cc(ncc1C=O)N PB19003 [0,0,0,0,0,1|2,0,0]=3 300 B9R1.1 c1cc(ncc1Cl)C=O AB44880 [0,0,0,0,0,1|2,0,0]=3 301 B9R1.1 c1cc(ncc1F)C=O AB42648 [0,0,0,0,0,1|2,0,0]=3 302 B9R1.1 c1cc(ncc1N)C=O AB67740 [0,0,0,0,0,1|2,0,0]=3 303 B9R1.1 c1cc(ncc1O)C=O AB59867 [0,0,0,0,0,1|2,0,0]=3 304 B9R1.1 c1cc(nnc1C=O)Cl PB13298 [0,0,0,0,0,1|2,0,0]=3 305 B9R1.2 C=Cc1cccc(n1)Br AB74634 [0,0,0,0,0,1|3,0,0]=4 306 B9R1.2 Cc1cc(ccn1)C#C AB66571 [0,0,0,0,0,1|2,0,1]=4 307 B9R1.2 Cc1cc(ccn1)C=O AB24827 [0,0,0,0,0,1|1,0,0]=2 308 B9R1.2 Cc1cc(ccn1)CCl AB59910 [0,0,0,0,0,1|2,0,1]=4 309 B9R1.2 Cc1cc(ccn1)CN AB25370 [0,0,0,0,0,1|2,0,1]=4 310 B9R1.2 Cc1cc(cnc1)C=O PB18860 [0,0,0,0,0,1|1,0,0]=2 311 B9R1.2 Cc1cc(cnc1)CCl AB55820 [0,0,0,0,0,1|2,0,1]=4 312 B9R1.2 Cc1cc(cnc1)CN AB23459 [0,0,0,0,0,1|2,0,1]=4 313 B9R1.2 Cc1cc(cnc1)CO PB10532 [0,0,0,0,0,1|1,0,2]=4 314 B9R1.2 Cc1cc(cnc1)OC AB64998 [0,0,0,0,0,1|3,0,0]=4 315 B9R1.2 Cc1cccc(n1)C#N AB04512 [0,0,0,0,0,1|2,0,1]=4 316 B9R1.2 Cc1cccc(n1)C=O AB00683 [0,0,0,0,0,1|1,0,0]=2 317 B9R1.2 Cc1cccc(n1)CCl AB49651 [0,0,0,0,0,1|2,0,1]=4 318 B9R1.2 Cc1cccc(n1)CN AB22796 [0,0,0,0,0,1|2,0,1]=4 319 B9R1.2 Cc1cccc(n1)NC AB60602 [0,0,0,0,0,1|3,0,0]=4 320 B9R1.2 Cc1ccnc(c1)C#C AB66576 [0,0,0,0,0,1|2,0,1]=4 321 B9R1.2 Cc1ccnc(c1)C#N AB03610 [0,0,0,0,0,1|2,0,1]=4 322 B9R1.2 Cc1ccnc(c1)CCl AB42303 [0,0,0,0,0,1|2,0,1]=4 323 B9R1.2 Cc1ccnc(c1)CN AB23452 [0,0,0,0,0,1|2,0,1]=4 324 B9R1.2 Cc1ccnc(n1)C#C AB69142 [0,0,0,0,0,1|2,0,1]=4 325 B9R1.2 Cc1ccnc(n1)C#N PB33166 [0,0,0,0,0,1|2,0,1]=4 326 B9R1.2 Cc1ccnc(n1)C=O PB28177 [0,0,0,0,0,1|1,0,0]=2 327 B9R1.2 Cc1ccnc(n1)CCl PB25297 [0,0,0,0,0,1|2,0,1]=4 328 B9R1.2 Cc1ccnc(n1)CN PB16292 [0,0,0,0,0,1|2,0,1]=4 329 B9R1.2 Cc1ccnc(n1)CO PB24151 [0,0,0,0,0,1|1,0,2]=4 330 B9R1.2 Cc1cncc(n1)C=O AB62637 [0,0,0,0,0,1|1,0,0]=2 331 B9R1.2 Cc1cncc(n1)CCl AB60498 [0,0,0,0,0,1|2,0,1]=4 332 B9R1.2 Cc1cncc(n1)CN AB72296 [0,0,0,0,0,1|2,0,1]=4 333 B9R1.2 Cc1nccc(n1)C=O AB52721 [0,0,0,0,0,1|1,0,0]=2 334 B9R1.2 Cc1nccc(n1)CCl AB58939 [0,0,0,0,0,1|2,0,1]=4 335 B9R1.2 Cc1nccc(n1)CN AB43194 [0,0,0,0,0,1|2,0,1]=4 336 B9R1.2 c1c(cncc1Br)C=O PB10234 [0,0,0,0,0,1|2,0,0]=3 337 B9R1.2 c1c(cncc1Cl)C=O PB29540 [0,0,0,0,0,1|2,0,0]=3 338 B9R1.2 c1c(cncc1F)C=O PB12469 [0,0,0,0,0,1|2,0,0]=3 339 B9R1.2 c1c(cncc1I)C=O AB45533 [0,0,0,0,0,1|2,0,0]=3 340 B9R1.2 c1c(cncc1N)C=O AB67741 [0,0,0,0,0,1|2,0,0]=3 341 B9R1.2 c1c(cncc1O)C=O AB67779 [0,0,0,0,0,1|2,0,0]=3 342 B9R1.2 c1c(nc(cn1)Cl)C=O PB16295 [0,0,0,0,0,1|2,0,0]=3 343 B9R1.2 c1c(ncnc1Cl)C=O AB58865 [0,0,0,0,0,1|3,0,0]=4 344 B9R1.2 c1c(ncnc1O)C=O AB58874 [0,0,0,0,0,1|3,0,0]=4 345 B9R1.2 c1cc(nc(c1)Br)C=O PB27582 [0,0,0,0,0,1|2,0,0]=3 346 B9R1.2 c1cc(nc(c1)Cl)C=O AB52723 [0,0,0,0,0,1|2,0,0]=3 347 B9R1.2 c1cc(nc(c1)F)C=O AB13533 [0,0,0,0,0,1|2,0,0]=3 348 B9R1.2 c1cnc(cc1Br)C=O PB10584 [0,0,0,0,0,1|2,0,0]=3 349 B9R1.2 c1cnc(cc1C=O)Br AB17326 [0,0,0,0,0,1|2,0,0]=3 350 B9R1.2 c1cnc(cc1C=O)Cl PB21899 [0,0,0,0,0,1|2,0,0]=3 351 B9R1.2 c1cnc(cc1C=O)F AB24818 [0,0,0,0,0,1|2,0,0]=3 352 B9R1.2 c1cnc(cc1Cl)C=O PB32513 [0,0,0,0,0,1|2,0,0]=3 353 B9R1.2 c1cnc(cc1F)C=O AB68024 [0,0,0,0,0,1|2,0,0]=3 354 B9R1.2 c1cnc(cc1N)C=O AB68102 [0,0,0,0,0,1|2,0,0]=3 355 B9R1.2 c1cnc(cc1O)C=O AB68125 [0,0,0,0,0,1|2,0,0]=3 356 B9R1.2 c1cnc(nc1C=O)Cl PB16282 [0,0,0,0,0,1|2,0,0]=3 357 B9R1.2 c1cnc(nc1Cl)C=O AB52774 [0,0,0,0,0,1|2,0,0]=3 358 B6R0.1 CCNC(=O)C=C CB10170 [1,0,1,0,0,0|1,0,1]=4 359 B6R0.4 CC(=O)\C=C\OC AB00959 [1,0,1,0,0,0|2,0,0]=4 360 B6R1.2 C1=NC(=O)N=C1 AB01798 [2,0,0,0,0,0|2,0,0]=4 361 B6R1.2 CC1=CCCO1 AB00300 [2,0,0,0,0,0|0,0,2]=4 362 B6R1.2 CC1=CN=CC1 PB12076 [2,0,0,0,0,0|2,0,0]=4 363 B6R1.2 CC1=NC=CC1 AB12705 [2,0,0,0,0,0|1,0,1]=4 364 B6R1.2 Cc1ccon1 AB01288 [2,0,0,0,0,0|2,0,0]=4 365 B6R1.2 Cc1cocn1 AB63545 [2,0,0,0,0,0|2,0,0]=4 366 B6R1.2 Cn1cccn1 PB33818 [2,0,0,0,0,0|2,0,0]=4 367 B6R1.2 c1c(ocn1)Br AB68491 [2,0,0,0,0,0|2,0,0]=4 368 B6R1.2 c1c(ocn1)N MB10132 [2,0,0,0,0,0|2,0,0]=4 369 B6R1.2 c1cc(oc1)Br AB04890 [2,0,0,0,0,0|1,0,0]=3 370 B6R1.2 c1cc(sc1)N AB08372 [2,0,0,0,0,0|1,1,0]=4 371 B6R1.2 c1cnoc1N MB00706 [2,0,0,0,0,0|2,0,0]=4 372 B6R1.2 c1coc(n1)Br AB53255 [2,0,0,0,0,0|2,0,0]=4 373 B6R1.2 c1coc(n1)I PB15201 [2,0,0,0,0,0|2,0,0]=4 374 B6R1.2 c1coc(n1)N MB04324 [2,0,0,0,0,0|2,0,0]=4 375 B8R1.7 B(c1ccco1)(O)O AB07247 [1,1,0,0,0,0|1,0,1]=4 376 B8R1.7 CC(=O)C1=CN=CC1 AB02749 [1,1,0,0,0,0|2,0,0]=4 377 B8R1.7 CC(=O)c1ccsc1 PB17033 [1,1,0,0,0,0|2,0,0]=4 378 B8R1.7 CC(=O)c1cocn1 AB73503 [1,1,0,0,0,0|2,0,0]=4 379 B8R1.7 CC(=O)c1ncco1 AB42105 [1,1,0,0,0,0|1,0,0]=3 380 B8R1.7 c1c(nco1)C(=O)O PB14470 [1,1,0,0,0,0|2,0,0]=4 381 B8R1.7 c1c(nco1)C(=O)[O-] AB28203 [1,1,0,0,0,0|2,0,0]=4 382 B8R1.7 c1c(ncs1)C(=O)N AB06564 [1,1,0,0,0,0|2,0,0]=4 383 B8R1.7 c1c(ncs1)C(=O)O AB06561 [1,1,0,0,0,0|2,0,0]=4 384 B8R1.7 c1c(ocn1)C(=O)N AB19298 [1,1,0,0,0,0|1,0,0]=3 385 B8R1.7 c1c(ocn1)C(=O)O AB19293 [1,1,0,0,0,0|1,0,0]=3 386 B8R1.7 c1c(ocn1)C(=S)N AB19301 [1,1,0,0,0,0|1,1,0]=4 387 B8R1.7 c1c(scn1)C(=O)O AB15430 [1,1,0,0,0,0|1,1,0]=4 388 B8R1.7 c1cc(oc1)C(=N)N AB07706 [1,1,0,0,0,0|1,0,0]=3 389 B8R1.7 c1cnsc1C(=O)O AB32452 [1,1,0,0,0,0|1,1,0]=4 390 B8R1.7 c1coc(n1)C(=O)N AB19289 [1,1,0,0,0,0|1,0,0]=3 391 B8R1.7 c1coc(n1)C(=O)O AB19305 [1,1,0,0,0,0|1,0,0]=3 392 B8R1.7 c1coc(n1)C(=S)N AB19285 [1,1,0,0,0,0|1,1,0]=4 393 B8R1.7 c1cocc1C(=O)O PB30525 [1,1,0,0,0,0|2,0,0]=4 394 B8R1.7 c1conc1C(=O)O PB26232 [1,1,0,0,0,0|2,0,0]=4 395 B8R1.7 c1csc(n1)C(=O)O AB10888 [1,1,0,0,0,0|1,1,0]=4 396 B8R1.7 c1cscc1C(=O)O PB18386 [1,1,0,0,0,0|2,0,0]=4 397 B8R1.7 c1csnc1C(=O)O PB34433 [1,1,0,0,0,0|2,0,0]=4 398 B8R1.7 c1nnc(o1)C(=O)O AB57583 [1,1,0,0,0,0|2,0,0]=4 399 B8R1.8 c1cc(oc1)N=C=O AB53758 [1,1,0,0,0,0|0,0,1]=3 400 B8R1.8 c1coc(n1)CC=O AB57661 [1,1,0,0,0,0|1,0,0]=3 401 B8R1.8 c1coc(n1)N=C=O AB74260 [1,1,0,0,0,0|1,0,1]=4 402 B8R1.8 c1csc(n1)CC=O AB57662 [1,1,0,0,0,0|1,1,0]=4 403 B8R1.11 C1C=C(C(=N1)C=O)Br PB29916 [1,1,0,0,0,0|1,0,1]=4 404 B8R1.11 C1C=C(C(=N1)C=O)Cl PB23804 [1,1,0,0,0,0|1,0,1]=4 405 B8R1.11 CC1=C(N=CC1)C=O AB01496 [1,1,0,0,0,0|1,0,1]=4 406 B8R1.11 Cc1c(ccs1)C=O AB53893 [1,1,0,0,0,0|2,0,0]=4 407 B8R1.11 Cc1c(nco1)C=O AB62633 [1,1,0,0,0,0|2,0,0]=4 408 B8R1.11 Cc1c(ncs1)C=O AB62627 [1,1,0,0,0,0|2,0,0]=4 409 B8R1.11 Cc1c(scn1)C=O CB10986 [1,1,0,0,0,0|1,1,0]=4 410 B8R1.11 Cn1c(ccn1)C=O PB21218 [1,1,0,0,0,0|2,0,0]=4 411 B8R1.11 Cn1ccnc1C=O PB12922 [1,1,0,0,0,0|2,0,0]=4 412 B8R1.11 Cn1cncc1C=O PB21631 [1,1,0,0,0,0|2,0,0]=4 413 B8R1.11 c1c(c(cs1)Br)C=O AB08778 [1,1,0,0,0,0|2,0,0]=4 414 B8R1.11 c1coc(c1Br)C=O AB31934 [1,1,0,0,0,0|0,0,0]=2 415 B8R1.11 c1csc(c1Br)C=O PB25976 [1,1,0,0,0,0|0,1,0]=3 416 B8R1.11 c1csc(c1Cl)C=O PB32269 [1,1,0,0,0,0|0,1,0]=3 417 B8R1.18 CC1C(=O)NC(=O)O1 AB26261 [1,1,0,0,0,0|1,0,1]=4 418 B8R1.18 Cc1c(cc(s1)Br)Br MB04800 [1,1,0,0,0,0|1,1,0]=4 419 B8R1.18 Cc1c(oc(n1)N)C AB25421 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.1 Cc1ccc(cc1)CC=O AB02059 [0,1,0,0,0,1|1,0,0]=3 421 B10R1.1 Cc1ccc(cc1)\C=C\Br AB73509 [0,1,0,0,0,1|2,0,0]=4 422 B10R1.1 Cc1ccc(cn1)N=C=O AB43377 [0,1,0,0,0,1|1,0,1]=4 423 B10R1.1 Cc1ccc(nc1)\C=N\O AB72002 [0,1,0,0,0,1|1,0,1]=4 424 B10R1.1 c1cc(ccc1CC=O)Br AB11790 [0,1,0,0,0,1|2,0,0]=4 425 B10R1.1 c1cc(ccc1CC=O)Cl AB11793 [0,1,0,0,0,1|2,0,0]=4 426 B10R1.1 c1cc(ccc1CC=O)F AB11805 [0,1,0,0,0,1|2,0,0]=4 427 B10R1.1 c1cc(ccc1CC=O)N AB27688 [0,1,0,0,0,1|2,0,0]=4 428 B10R1.3 C#Cc1ccc(cc1)C=O AB22364 [0,1,0,0,0,1|1,0,1]=4 429 B10R1.3 CNc1ncc(cn1)C=O AB30585 [0,1,0,0,0,1|2,0,0]=4 430 B10R1.3 COc1ccc(nc1)C=O PB17495 [0,1,0,0,0,1|1,0,0]=3 431 B10R1.3 COc1ccc(nn1)C=O AB61123 [0,1,0,0,0,1|1,0,0]=3 432 B10R1.3 COc1cnc(cn1)C=O AB60467 [0,1,0,0,0,1|2,0,0]=4 433 B10R1.3 COc1cnc(nc1)C=O AB59742 [0,1,0,0,0,1|2,0,0]=4 434 B10R1.3 COc1ncc(cn1)C=O AB15446 [0,1,0,0,0,1|2,0,0]=4 435 B10R1.3 CSc1ncc(cn1)C=O PB17314 [0,1,0,0,0,1|2,0,0]=4 436 B10R1.3 c1c(cnc(n1)CCl)C=O AB59413 [0,1,0,0,0,1|2,0,0]=4 437 B10R1.3 c1c(cnc(n1)CN)C=O AB63214 [0,1,0,0,0,1|2,0,0]=4 438 B10R1.3 c1cc(ncc1C#N)C=O AB67705 [0,1,0,0,0,1|1,0,1]=4 439 B10R1.3 c1cc(ncc1C=O)C#N AB66011 [0,1,0,0,0,1|1,0,1]=4 440 B10R1.3 c1cc(ncc1C=O)CCl AB69673 [0,1,0,0,0,1|1,0,0]=3 441 B10R1.3 c1cc(ncc1CCl)C=O AB59921 [0,1,0,0,0,1|1,0,0]=3 442 B10R1.3 c1cc(nnc1C=O)C=O AB74050 [0,1,0,0,0,1|1,0,1]=4 443 B10R1.13 CC(=O)c1ccc(cn1)Br AB21518 [0,1,0,0,0,1|2,0,0]=4 444 B10R1.13 CC(=O)c1ccc(cn1)Cl AB41101 [0,1,0,0,0,1|2,0,0]=4 445 B10R1.13 CC(=O)c1ccc(cn1)F AB62503 [0,1,0,0,0,1|2,0,0]=4 446 B10R1.13 CC(=O)c1ccc(cn1)N AB60315 [0,1,0,0,0,1|2,0,0]=4 447 B10R1.13 CC(=O)c1ccc(cn1)O AB60308 [0,1,0,0,0,1|2,0,0]=4 448 B10R1.13 CC(=O)c1ccc(nc1)Br AB21520 [0,1,0,0,0,1|2,0,0]=4 449 B10R1.13 CC(=O)c1ccc(nc1)Cl AB14033 [0,1,0,0,0,1|2,0,0]=4 450 B10R1.13 CC(=O)c1ccc(nc1)F AB41115 [0,1,0,0,0,1|2,0,0]=4 451 B10R1.13 CC(=O)c1ccc(nc1)N AB49552 [0,1,0,0,0,1|2,0,0]=4 452 B10R1.13 CC(=O)c1ccc(nc1)O AB60297 [0,1,0,0,0,1|2,0,0]=4 453 B10R1.13 CC(=O)c1ccc(nn1)Cl PB20488 [0,1,0,0,0,1|2,0,0]=4 454 B10R1.13 Cc1ccc(cc1)C(=N)N AB01792 [0,1,0,0,0,1|2,0,0]=4 455 B10R1.13 Cc1ccc(cc1)C(=S)N AB04365 [0,1,0,0,0,1|1,1,0]=4 456 B10R1.13 Cc1ccc(cn1)C(=O)C AB03568 [0,1,0,0,0,1|1,0,0]=3 457 B10R1.13 Cc1ccc(cn1)C(=O)Cl AB44670 [0,1,0,0,0,1|1,0,0]=3 458 B10R1.13 Cc1ccc(cn1)C(=O)O AB00723 [0,1,0,0,0,1|1,0,0]=3 459 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] PB18660 [0,1,0,0,0,1|2,0,0]=4 460 B10R1.13 Cc1ccc(nc1)C(=O)C AB25779 [0,1,0,0,0,1|1,0,0]=3 461 B10R1.13 Cc1ccc(nc1)C(=O)O AB09798 [0,1,0,0,0,1|1,0,0]=3 462 B10R1.13 Cc1ccc(nn1)C(=O)C AB75459 [0,1,0,0,0,1|1,0,0]=3 463 B10R1.13 Cc1ccc(nn1)C(=O)O AB52759 [0,1,0,0,0,1|1,0,0]=3 464 B10R1.13 Cc1cnc(cn1)C(=O)C AB02269 [0,1,0,0,0,1|2,0,0]=4 465 B10R1.13 Cc1cnc(cn1)C(=O)N CB10282 [0,1,0,0,0,1|2,0,0]=4 466 B10R1.13 Cc1cnc(cn1)C(=O)O PB12995 [0,1,0,0,0,1|2,0,0]=4 467 B10R1.13 Cc1cnc(nc1)C(=O)O PB29748 [0,1,0,0,0,1|2,0,0]=4 468 B10R1.13 Cc1ncc(cn1)C(=O)O PB27884 [0,1,0,0,0,1|2,0,0]=4 469 B10R1.13 c1cc(ncc1Br)C(=O)O PB32197 [0,1,0,0,0,1|2,0,0]=4 470 B10R1.13 c1cc(ncc1Br)C(=O)[O-] AB42654 [0,1,0,0,0,1|2,0,0]=4 471 B10R1.13 c1cc(ncc1C(=O)Cl)F AB42627 [0,1,0,0,0,1|2,0,0]=4 472 B10R1.13 c1cc(ncc1C(=O)N)Br MB01098 [0,1,0,0,0,1|2,0,0]=4 473 B10R1.13 c1cc(ncc1C(=O)O)Br PB18554 [0,1,0,0,0,1|2,0,0]=4 474 B10R1.13 c1cc(ncc1C(=O)O)Cl AB00659 [0,1,0,0,0,1|2,0,0]=4 475 B10R1.13 c1cc(ncc1C(=O)O)F AB09999 [0,1,0,0,0,1|2,0,0]=4 476 B10R1.13 c1cc(ncc1C(=O)O)N AB17940 [0,1,0,0,0,1|2,0,0]=4 477 B10R1.13 c1cc(ncc1C(=O)O)N PB21621 [0,1,0,0,0,1|2,0,0]=4 478 B10R1.13 c1cc(ncc1C(=O)O)O PB17040 [0,1,0,0,0,1|2,0,0]=4 479 B10R1.13 c1cc(ncc1Cl)C(=O)O AB17962 [0,1,0,0,0,1|2,0,0]=4 480 B10R1.13 c1cc(ncc1F)C(=O)O AB17969 [0,1,0,0,0,1|2,0,0]=4 481 B10R1.13 c1cc(ncc1N)C(=O)O AB12645 [0,1,0,0,0,1|2,0,0]=4 482 B10R1.13 c1cc(ncc1O)C(=O)N MB11444 [0,1,0,0,0,1|2,0,0]=4 483 B10R1.13 c1cc(ncc1O)C(=O)O PB26027 [0,1,0,0,0,1|2,0,0]=4 484 B10R1.13 c1cc(nnc1C(=O)O)Cl PB27458 [0,1,0,0,0,1|2,0,0]=4 485 B10R1.13 c1cc(nnc1C(=O)O)N PB30836 [0,1,0,0,0,1|2,0,0]=4 486 B10R1.13 c1cc(nnc1C(=O)O)O PB20339 [0,1,0,0,0,1|2,0,0]=4 487 B10R1.25 Cc1c(ccc(n1)Br)C=O AB66856 [0,1,0,0,0,1|2,0,0]=4 488 B10R1.25 Cc1c(ccc(n1)Cl)C=O AB32133 [0,1,0,0,0,1|2,0,0]=4 489 B10R1.25 Cc1cc(c(cn1)C=O)Br AB66855 [0,1,0,0,0,1|1,0,0]=3 490 B10R1.25 Cc1cc(c(cn1)C=O)Cl AB66849 [0,1,0,0,0,1|1,0,0]=3 491 B10R1.25 Cc1cc(c(cn1)C=O)F AB75172 [0,1,0,0,0,1|1,0,0]=3 492 B10R1.25 Cc1cc(c(cn1)C=O)N AB83689 [0,1,0,0,0,1|1,0,0]=3 493 B10R1.25 Cc1cc(c(cn1)C=O)O AB75249 [0,1,0,0,0,1|1,0,0]=3 494 B10R1.25 Cc1cc(c(nc1)C=O)C AB53525 [0,1,0,0,0,1|1,0,0]=3 495 B10R1.25 Cc1cc(c(nc1)C=O)Cl AB75087 [0,1,0,0,0,1|1,0,0]=3 496 B10R1.25 Cc1cc(c(nc1)C=O)F AB75163 [0,1,0,0,0,1|1,0,0]=3 497 B10R1.25 Cc1cc(c(nc1)C=O)N AB83746 [0,1,0,0,0,1|1,0,0]=3 498 B10R1.25 Cc1cc(c(nc1)C=O)O AB75242 [0,1,0,0,0,1|1,0,0]=3 499 B10R1.25 Cc1cc(cnc1C=O)Br AB42359 [0,1,0,0,0,1|2,0,0]=4 500 B10R1.25 Cc1cc(cnc1C=O)Cl AB75118 [0,1,0,0,0,1|2,0,0]=4 501 B10R1.25 Cc1cc(cnc1C=O)F AB74798 [0,1,0,0,0,1|2,0,0]=4 502 B10R1.25 Cc1cc(ncc1C=O)Br AB67814 [0,1,0,0,0,1|2,0,0]=4 503 B10R1.25 Cc1cc(ncc1C=O)C AB74124 [0,1,0,0,0,1|1,0,0]=3 504 B10R1.25 Cc1cc(ncc1C=O)Cl AB32140 [0,1,0,0,0,1|2,0,0]=4 505 B10R1.25 Cc1cc(ncc1C=O)F AB75824 [0,1,0,0,0,1|2,0,0]=4 506 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [0,1,0,0,0,1|1,0,0]=3 507 B10R1.25 Cc1ccc(c(n1)Br)C=O AB55809 [0,1,0,0,0,1|1,0,0]=3 508 B10R1.25 Cc1ccc(c(n1)C)C=O AB13970 [0,1,0,0,0,1|1,0,0]=3 509 B10R1.25 Cc1ccc(c(n1)Cl)C=O AB32135 [0,1,0,0,0,1|1,0,0]=3 510 B10R1.25 Cc1ccc(c(n1)N)C=O AB27631 [0,1,0,0,0,1|1,0,0]=3 511 B10R1.25 Cc1ccc(c(n1)O)C=O AB42321 [0,1,0,0,0,1|1,0,0]=3 512 B10R1.25 Cc1cnc(c(n1)C)C=O AB73104 [0,1,0,0,0,1|2,0,0]=4 513 B10R1.25 Cc1ncc(c(n1)N)C=O AB53802 [0,1,0,0,0,1|2,0,0]=4 514 B10R1.25 c1c(c(cnc1Br)C=O)Cl AB67260 [0,1,0,0,0,1|2,0,0]=4 515 B10R1.25 c1c(c(cnc1Br)C=O)F AB68032 [0,1,0,0,0,1|2,0,0]=4 516 B10R1.25 c1c(c(cnc1Br)C=O)N AB68108 [0,1,0,0,0,1|2,0,0]=4 517 B10R1.25 c1c(c(cnc1Br)C=O)O AB72645 [0,1,0,0,0,1|2,0,0]=4 518 B10R1.25 c1c(c(cnc1Cl)C=O)Br AB67955 [0,1,0,0,0,1|2,0,0]=4 519 B10R1.25 c1c(c(cnc1Cl)C=O)Cl PB13495 [0,1,0,0,0,1|2,0,0]=4 520 B10R1.25 c1c(c(cnc1Cl)C=O)F AB68027 [0,1,0,0,0,1|2,0,0]=4 521 B10R1.25 c1c(c(cnc1Cl)C=O)N AB52769 [0,1,0,0,0,1|2,0,0]=4 522 B10R1.25 c1c(c(cnc1Cl)C=O)O AB69327 [0,1,0,0,0,1|2,0,0]=4 523 B10R1.25 c1c(c(cnc1F)C=O)Cl AB75063 [0,1,0,0,0,1|2,0,0]=4 524 B10R1.25 c1c(c(cnc1N)C=O)Cl AB71947 [0,1,0,0,0,1|2,0,0]=4 525 B10R1.25 c1c(c(cnc1N)C=O)N AB43397 [0,1,0,0,0,1|2,0,0]=4 526 B10R1.25 c1c(c(cnc1N)C=O)O AB84438 [0,1,0,0,0,1|2,0,0]=4 527 B10R1.25 c1c(c(cnc1O)C=O)O AB69704 [0,1,0,0,0,1|2,0,0]=4 528 B10R1.25 c1c(cnc(c1Br)C=O)Br AB48580 [0,1,0,0,0,1|2,0,0]=4 529 B10R1.25 c1c(cnc(c1Cl)C=O)F AB70954 [0,1,0,0,0,1|2,0,0]=4 530 B10R1.25 c1c(cnc(c1F)C=O)Br PB11091 [0,1,0,0,0,1|2,0,0]=4 531 B10R1.25 c1c(cnc(c1F)C=O)Cl AB70957 [0,1,0,0,0,1|2,0,0]=4 532 B10R1.25 c1c(cnc(c1N)C=O)Br AB83734 [0,1,0,0,0,1|2,0,0]=4 533 B10R1.25 c1c(cnc(c1N)C=O)Cl AB83735 [0,1,0,0,0,1|2,0,0]=4 534 B10R1.25 c1c(cnc(c1N)C=O)N AB83749 [0,1,0,0,0,1|2,0,0]=4 535 B10R1.25 c1c(cnc(c1O)C=O)Br AB70969 [0,1,0,0,0,1|2,0,0]=4 536 B10R1.25 c1c(cnc(c1O)C=O)Cl AB75009 [0,1,0,0,0,1|2,0,0]=4 537 B10R1.25 c1c(cnc(c1O)C=O)N AB84581 [0,1,0,0,0,1|2,0,0]=4 538 B10R1.25 c1cc(c(cc1Br)Br)C=O AB66752 [0,1,0,0,0,1|2,0,0]=4 539 B10R1.25 c1cc(c(cc1Br)N)C=O AB45657 [0,1,0,0,0,1|2,0,0]=4 540 B10R1.25 c1cc(c(cc1Br)O)C=O AB23661 [0,1,0,0,0,1|2,0,0]=4 541 B10R1.25 c1cc(c(cc1Cl)Br)C=O MB06997 [0,1,0,0,0,1|2,0,0]=4 542 B10R1.25 c1cc(c(cc1Cl)N)C=O AB58432 [0,1,0,0,0,1|2,0,0]=4 543 B10R1.25 c1cc(c(cc1Cl)O)C=O AB23660 [0,1,0,0,0,1|2,0,0]=4 544 B10R1.25 c1cc(c(cc1F)Br)C=O AB06851 [0,1,0,0,0,1|2,0,0]=4 545 B10R1.25 c1cc(c(cc1F)N)C=O AB55874 [0,1,0,0,0,1|2,0,0]=4 546 B10R1.25 c1cc(c(cc1I)O)C=O MB06220 [0,1,0,0,0,1|2,0,0]=4 547 B10R1.25 c1cc(c(cc1N)O)C=O MB09039 [0,1,0,0,0,1|2,0,0]=4 548 B10R1.25 c1cc(c(cc1O)Br)C=O MB25584 [0,1,0,0,0,1|2,0,0]=4 549 B10R1.25 c1cc(c(cc1O)I)C=O MB25658 [0,1,0,0,0,1|2,0,0]=4 550 B10R1.25 c1cc(c(cc1O)N)C=O MB38477 [0,1,0,0,0,1|2,0,0]=4 551 B10R1.25 c1cc(nc(c1C=O)Br)Br PB20462 [0,1,0,0,0,1|2,0,0]=4 552 B10R1.25 c1cc(nc(c1C=O)Br)Cl AB64562 [0,1,0,0,0,1|2,0,0]=4 553 B10R1.25 c1cc(nc(c1C=O)Cl)Cl PB17413 [0,1,0,0,0,1|2,0,0]=4 554 B10R1.25 c1cc(nc(c1C=O)F)Br AB70853 [0,1,0,0,0,1|2,0,0]=4 555 B10R1.25 c1cc(nc(c1C=O)N)Br AB69709 [0,1,0,0,0,1|2,0,0]=4 556 B10R1.25 c1cc(nc(c1C=O)N)Cl AB69707 [0,1,0,0,0,1|2,0,0]=4 557 B10R1.25 c1cc(nc(c1C=O)N)N AB76145 [0,1,0,0,0,1|2,0,0]=4 558 B10R1.25 c1cc(nc(c1C=O)O)Br AB84532 [0,1,0,0,0,1|2,0,0]=4 559 B10R1.25 c1cc(nc(c1C=O)O)Cl AB84535 [0,1,0,0,0,1|2,0,0]=4 560 B10R1.25 c1cc(nc(c1C=O)O)N AB84539 [0,1,0,0,0,1|2,0,0]=4 561 B10R1.176 Cc1c(cc(cn1)C=O)Cl AB74641 [0,1,0,0,0,1|1,0,0]=3 562 B10R1.176 Cc1c(cc(cn1)C=O)F AB62781 [0,1,0,0,0,1|1,0,0]=3 563 B10R1.176 Cc1c(ccc(n1)C=O)Br MB09863 [0,1,0,0,0,1|2,0,0]=4 564 B10R1.176 Cc1c(ccc(n1)C=O)Cl AB70731 [0,1,0,0,0,1|2,0,0]=4 565 B10R1.176 Cc1c(ccc(n1)C=O)F AB44884 [0,1,0,0,0,1|2,0,0]=4 566 B10R1.176 Cc1c(nc(cn1)C=O)C AB77048 [0,1,0,0,0,1|2,0,0]=4 567 B10R1.176 Cc1cc(ccc1Br)C=O AB42951 [0,1,0,0,0,1|2,0,0]=4 568 B10R1.176 Cc1cc(ccc1Cl)C=O AB11800 [0,1,0,0,0,1|2,0,0]=4 569 B10R1.176 Cc1cc(cnc1Br)C=O AB44906 [0,1,0,0,0,1|2,0,0]=4 570 B10R1.176 Cc1cc(cnc1C)C=O AB75407 [0,1,0,0,0,1|1,0,0]=3 571 B10R1.176 Cc1cc(cnc1Cl)C=O AB64236 [0,1,0,0,0,1|2,0,0]=4 572 B10R1.176 Cc1cc(cnc1F)C=O AB25943 [0,1,0,0,0,1|2,0,0]=4 573 B10R1.176 Cc1cc(ncc1Br)C=O AB41159 [0,1,0,0,0,1|2,0,0]=4 574 B10R1.176 Cc1cc(ncc1C)C=O AB74125 [0,1,0,0,0,1|1,0,0]=3 575 B10R1.176 Cc1cc(ncc1Cl)C=O AB41161 [0,1,0,0,0,1|2,0,0]=4 576 B10R1.176 Cc1cc(ncc1F)C=O AB75169 [0,1,0,0,0,1|2,0,0]=4 577 B10R1.176 Cc1ccc(cc1O)C=O MB01933 [0,1,0,0,0,1|1,0,0]=3 578 B10R1.176 Cc1ccc(nc1C)C=O AB74104 [0,1,0,0,0,1|1,0,0]=3 579 B10R1.176 Cc1ccc(nc1Cl)C=O AB75097 [0,1,0,0,0,1|1,0,0]=3 580 B10R1.176 Cc1ccc(nc1F)C=O AB72847 [0,1,0,0,0,1|1,0,0]=3 581 B10R1.176 Cc1cnc(cc1Br)C=O AB70162 [0,1,0,0,0,1|1,0,0]=3 582 B10R1.176 Cc1cnc(cc1Cl)C=O AB67497 [0,1,0,0,0,1|1,0,0]=3 583 B10R1.176 Cc1cnc(cc1F)C=O AB82952 [0,1,0,0,0,1|1,0,0]=3 584 B10R1.176 Cn1ccc(cc1=O)C=O PB35148 [0,1,0,0,0,1|2,0,0]=4 585 B10R1.176 c1c(cnc(c1Br)Cl)C=O AB64592 [0,1,0,0,0,1|2,0,0]=4 586 B10R1.176 c1c(cnc(c1Cl)Br)C=O AB70941 [0,1,0,0,0,1|2,0,0]=4 587 B10R1.176 c1c(cnc(c1Cl)F)C=O AB70931 [0,1,0,0,0,1|2,0,0]=4 588 B10R1.176 c1c(cnc(c1Cl)N)C=O AB76562 [0,1,0,0,0,1|2,0,0]=4 589 B10R1.176 c1c(cnc(c1Cl)O)C=O AB20957 [0,1,0,0,0,1|2,0,0]=4 590 B10R1.176 c1c(cnc(c1F)Br)C=O AB70942 [0,1,0,0,0,1|2,0,0]=4 591 B10R1.176 c1c(cnc(c1F)Cl)C=O AB67661 [0,1,0,0,0,1|2,0,0]=4 592 B10R1.176 c1c(cnc(c1F)F)C=O AB70938 [0,1,0,0,0,1|2,0,0]=4 593 B10R1.176 c1c(cnc(c1N)Cl)C=O AB67746 [0,1,0,0,0,1|2,0,0]=4 594 B10R1.176 c1c(cnc(c1O)Cl)C=O AB62785 [0,1,0,0,0,1|2,0,0]=4 595 B10R1.176 c1c(ncc(c1Cl)Br)C=O AB67641 [0,1,0,0,0,1|2,0,0]=4 596 B10R1.176 c1c(ncc(c1Cl)Cl)C=O AB67602 [0,1,0,0,0,1|2,0,0]=4 597 B10R1.176 c1c(ncc(c1Cl)F)C=O AB67655 [0,1,0,0,0,1|2,0,0]=4 598 B10R1.176 c1c(ncc(c1Cl)N)C=O AB67744 [0,1,0,0,0,1|2,0,0]=4 599 B10R1.176 c1c(ncc(c1Cl)O)C=O AB67780 [0,1,0,0,0,1|2,0,0]=4 600 B10R1.176 c1c(ncc(c1F)Cl)C=O AB82983 [0,1,0,0,0,1|2,0,0]=4 601 B10R1.176 c1c(ncc(c1F)F)C=O AB73186 [0,1,0,0,0,1|2,0,0]=4 602 B10R1.176 c1c(ncc(c1N)Cl)C=O AB83912 [0,1,0,0,0,1|2,0,0]=4 603 B10R1.176 c1c(ncc(c1O)Cl)C=O AB75002 [0,1,0,0,0,1|2,0,0]=4 604 B10R1.176 c1cc(c(cc1C=O)Cl)Br AB43050 [0,1,0,0,0,1|2,0,0]=4 605 B10R1.176 c1cc(c(cc1C=O)I)F AB44172 [0,1,0,0,0,1|2,0,0]=4 606 B10R1.176 c1cc(c(cc1C=O)I)O MB00259 [0,1,0,0,0,1|2,0,0]=4 607 B10R1.176 c1cc(c(cc1C=O)N)O MB13575 [0,1,0,0,0,1|2,0,0]=4 608 B10R1.176 c1cc(c(cc1C=O)O)Br MB09255 [0,1,0,0,0,1|2,0,0]=4 609 B10R1.176 c1cc(c(cc1C=O)O)Cl MB25536 [0,1,0,0,0,1|2,0,0]=4 610 B10R1.176 c1cc(c(cc1C=O)O)F MB09319 [0,1,0,0,0,1|2,0,0]=4 611 B10R1.176 c1cc(c(cc1C=O)O)N MB34962 [0,1,0,0,0,1|2,0,0]=4 612 B10R1.176 c1cc(c(nc1C=O)Cl)F AB70948 [0,1,0,0,0,1|2,0,0]=4 613 B10R1.176 c1cc(c(nc1C=O)Cl)N AB75366 [0,1,0,0,0,1|2,0,0]=4 614 B10R1.176 c1cc(c(nc1C=O)Cl)O AB74848 [0,1,0,0,0,1|2,0,0]=4 615 B10R1.176 c1cc(c(nc1C=O)F)Cl AB70952 [0,1,0,0,0,1|2,0,0]=4 616 B10R1.176 c1cc(c(nc1C=O)F)F AB70940 [0,1,0,0,0,1|2,0,0]=4 617 B10R1.176 c1cc(c(nc1C=O)N)Cl AB83955 [0,1,0,0,0,1|2,0,0]=4 618 B10R1.176 c1cc(c(nc1C=O)O)Cl AB70962 [0,1,0,0,0,1|2,0,0]=4 619 B10R1.2 Cc1c(c(ccn1)C=O)Cl AB71247 [0,1,0,0,0,1|1,0,0]=3 620 B10R1.2 Cc1c(c(ccn1)C=O)N AB70908 [0,1,0,0,0,1|1,0,0]=3 621 B10R1.2 Cc1c(c(ccn1)C=O)O AB24800 [0,1,0,0,0,1|1,0,0]=3 622 B10R1.2 Cc1c(cccc1O)C=O MB08410 [0,1,0,0,0,1|2,0,0]=4 623 B10R1.2 Cc1c(ccnc1C=O)Br AB40731 [0,1,0,0,0,1|2,0,0]=4 624 B10R1.2 Cc1c(ccnc1C=O)Cl AB40720 [0,1,0,0,0,1|2,0,0]=4 625 B10R1.2 Cc1c(ccnc1C=O)F AB82923 [0,1,0,0,0,1|2,0,0]=4 626 B10R1.2 Cc1c(ccnc1Cl)C=O AB55074 [0,1,0,0,0,1|2,0,0]=4 627 B10R1.2 Cc1c(ccnc1F)C=O AB71343 [0,1,0,0,0,1|2,0,0]=4 628 B10R1.2 Cc1c(cncc1Cl)C=O AB75131 [0,1,0,0,0,1|2,0,0]=4 629 B10R1.2 Cc1c(nccc1C=O)C AB62887 [0,1,0,0,0,1|1,0,0]=3 630 B10R1.2 Cc1ccnc(c1C)C=O AB66597 [0,1,0,0,0,1|1,0,0]=3 631 B10R1.2 Cc1ccnc(c1Cl)C=O AB44896 [0,1,0,0,0,1|1,0,0]=3 632 B10R1.2 Cc1ccnc(c1N)C=O AB83759 [0,1,0,0,0,1|1,0,0]=3 633 B10R1.2 Cc1ccnc(c1O)C=O AB75246 [0,1,0,0,0,1|1,0,0]=3 634 B10R1.2 Cc1cncc(c1C)C=O AB76785 [0,1,0,0,0,1|1,0,0]=3 635 B10R1.2 Cc1cncc(c1Cl)C=O AB67499 [0,1,0,0,0,1|1,0,0]=3 636 B10R1.2 Cc1cncc(c1F)C=O AB75176 [0,1,0,0,0,1|1,0,0]=3 637 B10R1.2 Cc1cncc(c1N)C=O AB83665 [0,1,0,0,0,1|1,0,0]=3 638 B10R1.2 Cc1cncc(c1O)C=O AB75247 [0,1,0,0,0,1|1,0,0]=3 639 B10R1.2 c1c(c(c(cn1)Br)Cl)C=O AB67643 [0,1,0,0,0,1|2,0,0]=4 640 B10R1.2 c1c(c(c(cn1)Br)N)C=O AB83649 [0,1,0,0,0,1|2,0,0]=4 641 B10R1.2 c1c(c(c(cn1)Br)O)C=O AB84418 [0,1,0,0,0,1|2,0,0]=4 642 B10R1.2 c1c(c(c(cn1)Cl)Cl)C=O AB67605 [0,1,0,0,0,1|2,0,0]=4 643 B10R1.2 c1c(c(c(cn1)Cl)F)C=O AB82970 [0,1,0,0,0,1|2,0,0]=4 644 B10R1.2 c1c(c(c(cn1)Cl)N)C=O AB83651 [0,1,0,0,0,1|2,0,0]=4 645 B10R1.2 c1c(c(c(cn1)Cl)O)C=O AB84026 [0,1,0,0,0,1|2,0,0]=4 646 B10R1.2 c1c(c(c(cn1)F)Cl)C=O AB67658 [0,1,0,0,0,1|2,0,0]=4 647 B10R1.2 c1c(c(c(cn1)N)Cl)C=O AB67745 [0,1,0,0,0,1|2,0,0]=4 648 B10R1.2 c1c(c(c(cn1)N)N)C=O AB83667 [0,1,0,0,0,1|2,0,0]=4 649 B10R1.2 c1c(c(c(cn1)N)O)C=O AB84419 [0,1,0,0,0,1|2,0,0]=4 650 B10R1.2 c1c(c(c(cn1)O)Cl)C=O AB67784 [0,1,0,0,0,1|2,0,0]=4 651 B10R1.2 c1cc(c(c(c1)Br)O)C=O AB01203 [0,1,0,0,0,1|2,0,0]=4 652 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O MB08895 [0,1,0,0,0,1|2,0,0]=4 653 B10R1.2 c1cc(c(c(c1)Cl)F)C=O AB09379 [0,1,0,0,0,1|2,0,0]=4 654 B10R1.2 c1cc(c(c(c1)Cl)O)C=O AB21383 [0,1,0,0,0,1|2,0,0]=4 655 B10R1.2 c1cc(c(c(c1)F)O)C=O AB00313 [0,1,0,0,0,1|2,0,0]=4 656 B10R1.2 c1cc(c(c(c1)I)O)C=O MB12368 [0,1,0,0,0,1|2,0,0]=4 657 B10R1.2 c1cc(c(c(c1)O)Br)C=O AB03304 [0,1,0,0,0,1|2,0,0]=4 658 B10R1.2 c1cc(c(c(c1)O)F)C=O AB63446 [0,1,0,0,0,1|2,0,0]=4 659 B10R1.2 c1cc(c(c(c1)O)I)C=O MB07518 [0,1,0,0,0,1|2,0,0]=4 660 B10R1.2 c1cc(c(c(c1)O)N)C=O MB38000 [0,1,0,0,0,1|2,0,0]=4 661 B10R1.2 c1cnc(c(c1Br)N)C=O AB83752 [0,1,0,0,0,1|2,0,0]=4 662 B10R1.2 c1cnc(c(c1Br)O)C=O AB84603 [0,1,0,0,0,1|2,0,0]=4 663 B10R1.2 c1cnc(c(c1C=O)Cl)F AB66309 [0,1,0,0,0,1|2,0,0]=4 664 B10R1.2 c1cnc(c(c1C=O)Cl)N AB83932 [0,1,0,0,0,1|2,0,0]=4 665 B10R1.2 c1cnc(c(c1C=O)Cl)O AB70959 [0,1,0,0,0,1|2,0,0]=4 666 B10R1.2 c1cnc(c(c1C=O)F)Cl AB20966 [0,1,0,0,0,1|2,0,0]=4 667 B10R1.2 c1cnc(c(c1C=O)N)Br AB71718 [0,1,0,0,0,1|2,0,0]=4 668 B10R1.2 c1cnc(c(c1C=O)N)Cl AB71714 [0,1,0,0,0,1|2,0,0]=4 669 B10R1.2 c1cnc(c(c1C=O)N)N AB83595 [0,1,0,0,0,1|2,0,0]=4 670 B10R1.2 c1cnc(c(c1C=O)O)Br AB69695 [0,1,0,0,0,1|2,0,0]=4 671 B10R1.2 c1cnc(c(c1C=O)O)Cl AB69323 [0,1,0,0,0,1|2,0,0]=4 672 B10R1.2 c1cnc(c(c1C=O)O)N AB84363 [0,1,0,0,0,1|2,0,0]=4 673 B10R1.2 c1cnc(c(c1Cl)F)C=O AB70766 [0,1,0,0,0,1|2,0,0]=4 674 B10R1.2 c1cnc(c(c1Cl)N)C=O AB83753 [0,1,0,0,0,1|2,0,0]=4 675 B10R1.2 c1cnc(c(c1Cl)O)C=O AB75013 [0,1,0,0,0,1|2,0,0]=4 676 B10R1.2 c1cnc(c(c1F)Cl)C=O AB83001 [0,1,0,0,0,1|2,0,0]=4 677 B10R1.2 c1cnc(c(c1N)Cl)C=O AB83926 [0,1,0,0,0,1|2,0,0]=4 678 B10R1.2 c1cnc(c(c1N)O)C=O AB84604 [0,1,0,0,0,1|2,0,0]=4 679 B10R1.2 c1cnc(c(c1O)Cl)C=O AB75006 [0,1,0,0,0,1|2,0,0]=4 680 B10R1.8 Cc1cc(cc(c1)Br)C=O AB53369 [0,1,0,0,0,1|1,0,0]=3 681 B10R1.8 Cc1cc(cc(c1)C=O)C AB03134 [0,1,0,0,0,1|1,0,0]=3 682 B10R1.8 Cc1cc(cc(c1)Cl)C=O AB64288 [0,1,0,0,0,1|1,0,0]=3 683 B10R1.8 Cc1cc(cc(c1)F)C=O AB13319 [0,1,0,0,0,1|1,0,0]=3 684 B10R1.8 Cc1cc(cc(c1)I)C=O AB75646 [0,1,0,0,0,1|1,0,0]=3 685 B10R1.8 Cc1cc(cc(c1)O)C=O AB71633 [0,1,0,0,0,1|1,0,0]=3 686 B10R1.8 Cc1cc(cc(n1)Br)C=O AB66852 [0,1,0,0,0,1|1,0,0]=3 687 B10R1.8 Cc1cc(cc(n1)C)C=O AB24839 [0,1,0,0,0,1|1,0,0]=3 688 B10R1.8 Cc1cc(cc(n1)C=O)Br AB40795 [0,1,0,0,0,1|1,0,0]=3 689 B10R1.8 Cc1cc(cc(n1)C=O)Cl AB40806 [0,1,0,0,0,1|1,0,0]=3 690 B10R1.8 Cc1cc(cc(n1)C=O)F AB75160 [0,1,0,0,0,1|1,0,0]=3 691 B10R1.8 Cc1cc(cc(n1)C=O)I AB79033 [0,1,0,0,0,1|1,0,0]=3 692 B10R1.8 Cc1cc(cc(n1)C=O)O AB78936 [0,1,0,0,0,1|1,0,0]=3 693 B10R1.8 Cc1cc(cc(n1)Cl)C=O AB24805 [0,1,0,0,0,1|1,0,0]=3 694 B10R1.8 Cc1cc(cc(n1)F)C=O AB70701 [0,1,0,0,0,1|1,0,0]=3 695 B10R1.8 Cc1cc(cc(n1)I)C=O AB79154 [0,1,0,0,0,1|1,0,0]=3 696 B10R1.8 Cc1cc(cc(n1)O)C=O AB71363 [0,1,0,0,0,1|1,0,0]=3 697 B10R1.8 Cc1cc(nc(c1)Br)C=O AB67811 [0,1,0,0,0,1|1,0,0]=3 698 B10R1.8 Cc1cc(nc(c1)C=O)C AB04218 [0,1,0,0,0,1|1,0,0]=3 699 B10R1.8 Cc1cc(nc(c1)Cl)C=O AB67809 [0,1,0,0,0,1|1,0,0]=3 700 B10R1.8 Cc1cc(nc(c1)F)C=O AB75168 [0,1,0,0,0,1|1,0,0]=3 701 B10R1.8 Cc1cc(nc(c1)I)C=O AB78891 [0,1,0,0,0,1|1,0,0]=3 702 B10R1.8 Cc1cc(nc(c1)O)C=O AB79065 [0,1,0,0,0,1|1,0,0]=3 703 B10R1.8 Cc1cc(nc(n1)C)C=O AB58698 [0,1,0,0,0,1|1,0,0]=3 704 B10R1.8 Cc1cc(nc(n1)N)C=O AB58695 [0,1,0,0,0,1|2,0,0]=4 705 B10R1.8 Cc1cc(nc(n1)O)C=O AB58710 [0,1,0,0,0,1|2,0,0]=4 706 B10R1.8 Cc1nc(cc(n1)Cl)C=O AB58880 [0,1,0,0,0,1|1,0,0]=3 707 B10R1.8 Cc1nc(cc(n1)O)C=O AB58876 [0,1,0,0,0,1|1,0,0]=3 708 B10R1.8 c1c(cc(cc1Br)Br)C=O AB04160 [0,1,0,0,0,1|2,0,0]=4 709 B10R1.8 c1c(cc(cc1Br)I)C=O AB42478 [0,1,0,0,0,1|2,0,0]=4 710 B10R1.8 c1c(cc(cc1Cl)Br)C=O AB29574 [0,1,0,0,0,1|2,0,0]=4 711 B10R1.8 c1c(cc(cc1Cl)Cl)C=O AB00316 [0,1,0,0,0,1|2,0,0]=4 712 B10R1.8 c1c(cc(cc1Cl)I)C=O AB65246 [0,1,0,0,0,1|2,0,0]=4 713 B10R1.8 c1c(cc(cc1F)Br)C=O AB20677 [0,1,0,0,0,1|2,0,0]=4 714 B10R1.8 c1c(cc(cc1F)Cl)C=O AB11796 [0,1,0,0,0,1|2,0,0]=4 715 B10R1.8 c1c(cc(cc1F)F)C=O AB01034 [0,1,0,0,0,1|2,0,0]=4 716 B10R1.8 c1c(cc(cc1F)I)C=O AB42482 [0,1,0,0,0,1|2,0,0]=4 717 B10R1.8 c1c(cc(cc1I)I)C=O AB42481 [0,1,0,0,0,1|2,0,0]=4 718 B10R1.8 c1c(cc(cc1N)O)C=O MB35596 [0,1,0,0,0,1|2,0,0]=4 719 B10R1.8 c1c(cc(cc1O)Br)C=O AB29745 [0,1,0,0,0,1|2,0,0]=4 720 B10R1.8 c1c(cc(cc1O)Cl)C=O AB43616 [0,1,0,0,0,1|2,0,0]=4 721 B10R1.8 c1c(cc(cc1O)F)C=O AB66765 [0,1,0,0,0,1|2,0,0]=4 722 B10R1.8 c1c(cc(cc1O)I)C=O AB71641 [0,1,0,0,0,1|2,0,0]=4 723 B10R1.8 c1c(cc(cc1O)O)C=O AB01206 [0,1,0,0,0,1|2,0,0]=4 724 B10R1.8 c1c(cc(nc1Br)Br)C=O AB24810 [0,1,0,0,0,1|2,0,0]=4 725 B10R1.8 c1c(cc(nc1Br)I)C=O AB79139 [0,1,0,0,0,1|2,0,0]=4 726 B10R1.8 c1c(cc(nc1C=O)Br)Br AB68241 [0,1,0,0,0,1|2,0,0]=4 727 B10R1.8 c1c(cc(nc1C=O)Br)Cl AB67258 [0,1,0,0,0,1|2,0,0]=4 728 B10R1.8 c1c(cc(nc1C=O)Br)F AB68031 [0,1,0,0,0,1|2,0,0]=4 729 B10R1.8 c1c(cc(nc1C=O)Br)I AB78872 [0,1,0,0,0,1|2,0,0]=4 730 B10R1.8 c1c(cc(nc1C=O)Br)N AB68107 [0,1,0,0,0,1|2,0,0]=4 731 B10R1.8 c1c(cc(nc1C=O)Br)O AB78887 [0,1,0,0,0,1|2,0,0]=4 732 B10R1.8 c1c(cc(nc1C=O)Cl)Br AB67308 [0,1,0,0,0,1|2,0,0]=4 733 B10R1.8 c1c(cc(nc1C=O)Cl)Cl AB62517 [0,1,0,0,0,1|2,0,0]=4 734 B10R1.8 c1c(cc(nc1C=O)Cl)F AB68025 [0,1,0,0,0,1|2,0,0]=4 735 B10R1.8 c1c(cc(nc1C=O)Cl)I AB78865 [0,1,0,0,0,1|2,0,0]=4 736 B10R1.8 c1c(cc(nc1C=O)Cl)N AB68105 [0,1,0,0,0,1|2,0,0]=4 737 B10R1.8 c1c(cc(nc1C=O)Cl)O AB74846 [0,1,0,0,0,1|2,0,0]=4 738 B10R1.8 c1c(cc(nc1C=O)F)Br AB72838 [0,1,0,0,0,1|2,0,0]=4 739 B10R1.8 c1c(cc(nc1C=O)F)Cl AB78846 [0,1,0,0,0,1|2,0,0]=4 740 B10R1.8 c1c(cc(nc1C=O)F)F AB78843 [0,1,0,0,0,1|2,0,0]=4 741 B10R1.8 c1c(cc(nc1C=O)F)I AB78848 [0,1,0,0,0,1|2,0,0]=4 742 B10R1.8 c1c(cc(nc1C=O)F)O AB78862 [0,1,0,0,0,1|2,0,0]=4 743 B10R1.8 c1c(cc(nc1C=O)I)Br AB79019 [0,1,0,0,0,1|2,0,0]=4 744 B10R1.8 c1c(cc(nc1C=O)I)Cl AB79008 [0,1,0,0,0,1|2,0,0]=4 745 B10R1.8 c1c(cc(nc1C=O)I)F AB78986 [0,1,0,0,0,1|2,0,0]=4 746 B10R1.8 c1c(cc(nc1C=O)I)O AB78911 [0,1,0,0,0,1|2,0,0]=4 747 B10R1.8 c1c(cc(nc1C=O)O)Br AB79027 [0,1,0,0,0,1|2,0,0]=4 748 B10R1.8 c1c(cc(nc1C=O)O)Cl AB79017 [0,1,0,0,0,1|2,0,0]=4 749 B10R1.8 c1c(cc(nc1C=O)O)F AB79005 [0,1,0,0,0,1|2,0,0]=4 750 B10R1.8 c1c(cc(nc1C=O)O)I AB79041 [0,1,0,0,0,1|2,0,0]=4 751 B10R1.8 c1c(cc(nc1C=O)O)O AB78985 [0,1,0,0,0,1|2,0,0]=4 752 B10R1.8 c1c(cc(nc1Cl)Br)C=O AB67259 [0,1,0,0,0,1|2,0,0]=4 753 B10R1.8 c1c(cc(nc1Cl)Cl)C=O AB03506 [0,1,0,0,0,1|2,0,0]=4 754 B10R1.8 c1c(cc(nc1Cl)I)C=O AB79128 [0,1,0,0,0,1|2,0,0]=4 755 B10R1.8 c1c(cc(nc1F)Br)C=O AB70772 [0,1,0,0,0,1|2,0,0]=4 756 B10R1.8 c1c(cc(nc1F)Cl)C=O AB70951 [0,1,0,0,0,1|2,0,0]=4 757 B10R1.8 c1c(cc(nc1O)Br)C=O AB79149 [0,1,0,0,0,1|2,0,0]=4 758 B10R1.8 c1c(cc(nc1O)Cl)C=O AB70932 [0,1,0,0,0,1|2,0,0]=4 759 B10R1.8 c1c(cc(nc1O)F)C=O AB71295 [0,1,0,0,0,1|2,0,0]=4 760 B10R1.8 c1c(cc(nc1O)I)C=O AB79167 [0,1,0,0,0,1|2,0,0]=4 761 B10R1.8 c1c(cc(nc1O)O)C=O AB79223 [0,1,0,0,0,1|2,0,0]=4 762 B10R1.8 c1c(nc(nc1Cl)Cl)C=O AB58699 [0,1,0,0,0,1|2,0,0]=4 763 B10R1.10 Cc1cc(ccn1)N=C=O AB74181 [0,1,0,0,0,1|1,0,1]=4 764 B10R1.10 Cc1cc(ccn1)\C=N\O AB72010 [0,1,0,0,0,1|1,0,1]=4 765 B10R1.10 Cc1cc(cnc1)N=C=O AB74220 [0,1,0,0,0,1|1,0,1]=4 766 B10R1.10 Cc1cccc(c1)CC=O AB11815 [0,1,0,0,0,1|1,0,0]=3 767 B10R1.10 c1cc(cc(c1)Br)CC=O AB11787 [0,1,0,0,0,1|2,0,0]=4 768 B10R1.10 c1cc(cc(c1)Cl)CC=O AB11792 [0,1,0,0,0,1|2,0,0]=4 769 B10R1.10 c1cc(cc(c1)F)CC=O AB11802 [0,1,0,0,0,1|2,0,0]=4 770 B10R1.30 Cc1c(cc(cn1)Cl)C=O AB62434 [0,1,0,0,0,1|2,0,0]=4 771 B10R1.30 Cc1cc(c(cn1)Br)C=O AB68164 [0,1,0,0,0,1|1,0,0]=3 772 B10R1.30 Cc1cc(c(cn1)C)C=O AB74126 [0,1,0,0,0,1|1,0,0]=3 773 B10R1.30 Cc1cc(c(cn1)Cl)C=O AB68146 [0,1,0,0,0,1|1,0,0]=3 774 B10R1.30 Cc1cc(c(cn1)N)C=O AB83642 [0,1,0,0,0,1|1,0,0]=3 775 B10R1.30 Cc1cc(c(cn1)O)C=O AB76792 [0,1,0,0,0,1|1,0,0]=3 776 B10R1.30 Cc1cc(c(nc1)Br)C=O AB71097 [0,1,0,0,0,1|1,0,0]=3 777 B10R1.30 Cc1cc(c(nc1)C)C=O AB71657 [0,1,0,0,0,1|1,0,0]=3 778 B10R1.30 Cc1cc(c(nc1)Cl)C=O AB41813 [0,1,0,0,0,1|1,0,0]=3 779 B10R1.30 Cc1cc(c(nc1)F)C=O AB65261 [0,1,0,0,0,1|1,0,0]=3 780 B10R1.30 Cc1cc(c(nc1)N)C=O AB51533 [0,1,0,0,0,1|1,0,0]=3 781 B10R1.30 Cc1cc(c(nc1)O)C=O AB71365 [0,1,0,0,0,1|1,0,0]=3 782 B10R1.30 Cc1ccc(c(c1)C=O)N AB58438 [0,1,0,0,0,1|1,0,0]=3 783 B10R1.30 Cc1ccc(c(n1)C=O)Br AB68163 [0,1,0,0,0,1|1,0,0]=3 784 B10R1.30 Cc1ccc(c(n1)C=O)Cl AB68143 [0,1,0,0,0,1|1,0,0]=3 785 B10R1.30 Cc1ccc(c(n1)C=O)N AB76244 [0,1,0,0,0,1|1,0,0]=3 786 B10R1.30 Cc1ccc(c(n1)C=O)O AB62933 [0,1,0,0,0,1|1,0,0]=3 787 B10R1.30 Cc1ccc(cc1C=O)Cl AB63586 [0,1,0,0,0,1|2,0,0]=4 788 B10R1.30 Cc1ccc(cc1C=O)O MB23457 [0,1,0,0,0,1|2,0,0]=4 789 B10R1.30 Cc1ccc(nc1C=O)C AB75403 [0,1,0,0,0,1|1,0,0]=3 790 B10R1.30 Cc1ccc(nc1C=O)Cl AB75110 [0,1,0,0,0,1|2,0,0]=4 791 B10R1.30 Cc1ccc(nc1C=O)F AB75170 [0,1,0,0,0,1|2,0,0]=4 792 B10R1.30 Cc1cnc(c(n1)C=O)C AB77040 [0,1,0,0,0,1|1,0,0]=3 793 B10R1.30 Cc1cnc(cc1C=O)Cl AB67498 [0,1,0,0,0,1|2,0,0]=4 794 B10R1.30 Cc1cnc(cc1C=O)F AB71344 [0,1,0,0,0,1|2,0,0]=4 795 B10R1.30 c1c(c(cnc1Br)Br)C=O AB56403 [0,1,0,0,0,1|2,0,0]=4 796 B10R1.30 c1c(c(cnc1Br)Cl)C=O AB54689 [0,1,0,0,0,1|2,0,0]=4 797 B10R1.30 c1c(c(cnc1Br)F)C=O AB52575 [0,1,0,0,0,1|2,0,0]=4 798 B10R1.30 c1c(c(cnc1Br)N)C=O AB76683 [0,1,0,0,0,1|2,0,0]=4 799 B10R1.30 c1c(c(cnc1Br)O)C=O AB69284 [0,1,0,0,0,1|2,0,0]=4 800 B10R1.30 c1c(c(cnc1Cl)Br)C=O PB13444 [0,1,0,0,0,1|2,0,0]=4 801 B10R1.30 c1c(c(cnc1Cl)Cl)C=O AB24822 [0,1,0,0,0,1|2,0,0]=4 802 B10R1.30 c1c(c(cnc1Cl)F)C=O AB20993 [0,1,0,0,0,1|2,0,0]=4 803 B10R1.30 c1c(c(cnc1Cl)N)C=O AB64790 [0,1,0,0,0,1|2,0,0]=4 804 B10R1.30 c1c(c(cnc1Cl)O)C=O AB67782 [0,1,0,0,0,1|2,0,0]=4 805 B10R1.30 c1c(c(cnc1N)Br)C=O AB66638 [0,1,0,0,0,1|2,0,0]=4 806 B10R1.30 c1c(c(cnc1N)Cl)C=O AB72352 [0,1,0,0,0,1|2,0,0]=4 807 B10R1.30 c1c(c(cnc1N)F)C=O AB72351 [0,1,0,0,0,1|2,0,0]=4 808 B10R1.30 c1c(c(cnc1N)N)C=O AB76707 [0,1,0,0,0,1|2,0,0]=4 809 B10R1.30 c1c(c(cnc1N)O)C=O AB84402 [0,1,0,0,0,1|2,0,0]=4 810 B10R1.30 c1c(cnc(c1C=O)Br)F AB70943 [0,1,0,0,0,1|2,0,0]=4 811 B10R1.30 c1c(cnc(c1C=O)Cl)Br PB20287 [0,1,0,0,0,1|2,0,0]=4 812 B10R1.30 c1c(cnc(c1C=O)Cl)F AB13605 [0,1,0,0,0,1|2,0,0]=4 813 B10R1.30 c1c(cnc(c1C=O)F)Br PB29718 [0,1,0,0,0,1|2,0,0]=4 814 B10R1.30 c1c(cnc(c1C=O)F)Cl AB20969 [0,1,0,0,0,1|2,0,0]=4 815 B10R1.30 c1c(cnc(c1C=O)N)Br AB50973 [0,1,0,0,0,1|2,0,0]=4 816 B10R1.30 c1c(cnc(c1C=O)N)Cl AB58421 [0,1,0,0,0,1|2,0,0]=4 817 B10R1.30 c1c(cnc(c1C=O)N)F AB70294 [0,1,0,0,0,1|2,0,0]=4 818 B10R1.30 c1c(cnc(c1C=O)O)Br AB70946 [0,1,0,0,0,1|2,0,0]=4 819 B10R1.30 c1c(cnc(c1C=O)O)Cl AB70935 [0,1,0,0,0,1|2,0,0]=4 820 B10R1.30 c1c(cnc(c1C=O)O)N AB84511 [0,1,0,0,0,1|2,0,0]=4 821 B10R1.30 c1c(nc(c(n1)Cl)C=O)Cl AB85727 [0,1,0,0,0,1|2,0,0]=4 822 B10R1.30 c1c(nc(c(n1)N)C=O)Br AB69711 [0,1,0,0,0,1|2,0,0]=4 823 B10R1.30 c1c(nc(c(n1)N)C=O)Cl AB60422 [0,1,0,0,0,1|2,0,0]=4 824 B10R1.30 c1cc(c(cc1Br)C=O)Br MB01225 [0,1,0,0,0,1|2,0,0]=4 825 B10R1.30 c1cc(c(cc1Br)C=O)N AB58429 [0,1,0,0,0,1|2,0,0]=4 826 B10R1.30 c1cc(c(cc1Cl)C=O)O AB00314 [0,1,0,0,0,1|2,0,0]=4 827 B10R1.30 c1cc(c(cc1F)C=O)Br AB03821 [0,1,0,0,0,1|2,0,0]=4 828 B10R1.30 c1cc(c(cc1F)C=O)N AB58443 [0,1,0,0,0,1|2,0,0]=4 829 B10R1.30 c1cc(c(cc1N)C=O)O MB01352 [0,1,0,0,0,1|2,0,0]=4 830 B10R1.30 c1cc(c(cc1O)C=O)Br AB13035 [0,1,0,0,0,1|2,0,0]=4 831 B10R1.30 c1cc(c(cc1O)C=O)Cl MB05036 [0,1,0,0,0,1|2,0,0]=4 832 B10R1.30 c1cc(c(cc1O)C=O)F MB06891 [0,1,0,0,0,1|2,0,0]=4 833 B10R1.30 c1cc(c(cc1O)C=O)N MB29975 [0,1,0,0,0,1|2,0,0]=4 834 B10R1.30 c1cc(nc(c1Br)C=O)Cl AB68225 [0,1,0,0,0,1|2,0,0]=4 835 B10R1.30 c1cc(nc(c1Cl)C=O)Br AB68236 [0,1,0,0,0,1|2,0,0]=4 836 B10R1.30 c1cc(nc(c1Cl)C=O)Cl AB66502 [0,1,0,0,0,1|2,0,0]=4 837 B10R1.30 c1cc(nc(c1F)C=O)Br PB23527 [0,1,0,0,0,1|2,0,0]=4 838 B10R1.30 c1cc(nc(c1F)C=O)Cl AB20968 [0,1,0,0,0,1|2,0,0]=4 839 B10R1.30 c1cc(nc(c1N)C=O)Br AB83719 [0,1,0,0,0,1|2,0,0]=4 840 B10R1.30 c1cc(nc(c1N)C=O)Cl AB76329 [0,1,0,0,0,1|2,0,0]=4 841 B10R1.30 c1cc(nc(c1N)C=O)N AB83733 [0,1,0,0,0,1|2,0,0]=4 842 B10R1.30 c1cc(nc(c1O)C=O)Br AB84561 [0,1,0,0,0,1|2,0,0]=4 843 B10R1.30 c1cc(nc(c1O)C=O)Cl AB74851 [0,1,0,0,0,1|2,0,0]=4 844 B10R1.30 c1cc(nc(c1O)C=O)N AB84562 [0,1,0,0,0,1|2,0,0]=4 845 B10R1.113 CC(=O)c1cc(ccn1)Br AB67963 [0,1,0,0,0,1|2,0,0]=4 846 B10R1.113 CC(=O)c1cc(ccn1)Cl AB60198 [0,1,0,0,0,1|2,0,0]=4 847 B10R1.113 CC(=O)c1cc(ccn1)F AB68049 [0,1,0,0,0,1|2,0,0]=4 848 B10R1.113 CC(=O)c1cc(ccn1)O AB69730 [0,1,0,0,0,1|2,0,0]=4 849 B10R1.113 CC(=O)c1cc(cnc1)Br PB20794 [0,1,0,0,0,1|2,0,0]=4 850 B10R1.113 CC(=O)c1cc(cnc1)F AB41114 [0,1,0,0,0,1|2,0,0]=4 851 B10R1.113 CC(=O)c1cc(cnc1)N AB30920 [0,1,0,0,0,1|2,0,0]=4 852 B10R1.113 CC(=O)c1cccc(n1)Br AB05570 [0,1,0,0,0,1|2,0,0]=4 853 B10R1.113 CC(=O)c1cccc(n1)Cl AB41100 [0,1,0,0,0,1|2,0,0]=4 854 B10R1.113 CC(=O)c1cccc(n1)F AB50226 [0,1,0,0,0,1|2,0,0]=4 855 B10R1.113 CC(=O)c1cccc(n1)N AB67452 [0,1,0,0,0,1|2,0,0]=4 856 B10R1.113 CC(=O)c1ccnc(c1)Br AB31302 [0,1,0,0,0,1|2,0,0]=4 857 B10R1.113 CC(=O)c1ccnc(c1)Cl PB18811 [0,1,0,0,0,1|2,0,0]=4 858 B10R1.113 CC(=O)c1ccnc(c1)F AB50237 [0,1,0,0,0,1|2,0,0]=4 859 B10R1.113 CC(=O)c1ccnc(c1)N AB67454 [0,1,0,0,0,1|2,0,0]=4 860 B10R1.113 CC(=O)c1ccnc(n1)Cl AB76950 [0,1,0,0,0,1|2,0,0]=4 861 B10R1.113 CC(=O)c1ccnc(n1)N PB23634 [0,1,0,0,0,1|2,0,0]=4 862 B10R1.113 Cc1cc(ccn1)C(=O)C AB41122 [0,1,0,0,0,1|1,0,0]=3 863 B10R1.113 Cc1cc(ccn1)C(=O)Cl AB60195 [0,1,0,0,0,1|1,0,0]=3 864 B10R1.113 Cc1cc(ccn1)C(=O)O AB06393 [0,1,0,0,0,1|1,0,0]=3 865 B10R1.113 Cc1cc(ccn1)[N+](=O)[O-] PB24788 [0,1,0,0,0,1|2,0,0]=4 866 B10R1.113 Cc1cc(cnc1)C(=O)O PB12710 [0,1,0,0,0,1|1,0,0]=3 867 B10R1.113 Cc1cc(cnc1)[N+](=O)[O-] AB17987 [0,1,0,0,0,1|2,0,0]=4 868 B10R1.113 Cc1cc(ncn1)C(=O)C AB50216 [0,1,0,0,0,1|2,0,0]=4 869 B10R1.113 Cc1cc(ncn1)C(=O)O PB20450 [0,1,0,0,0,1|2,0,0]=4 870 B10R1.113 Cc1cccc(c1)C(=N)N AB11452 [0,1,0,0,0,1|2,0,0]=4 871 B10R1.113 Cc1cccc(c1)C(=S)N AB08506 [0,1,0,0,0,1|1,1,0]=4 872 B10R1.113 Cc1cccc(n1)C(=O)C AB25782 [0,1,0,0,0,1|1,0,0]=3 873 B10R1.113 Cc1cccc(n1)C(=O)O AB01368 [0,1,0,0,0,1|1,0,0]=3 874 B10R1.113 Cc1ccnc(c1)C(=O)C AB10395 [0,1,0,0,0,1|1,0,0]=3 875 B10R1.113 Cc1ccnc(c1)C(=O)O AB15851 [0,1,0,0,0,1|1,0,0]=3 876 B10R1.113 Cc1ccnc(n1)C(=N)N PB15470 [0,1,0,0,0,1|2,0,0]=4 877 B10R1.113 Cc1ccnc(n1)C(=O)O PB31505 [0,1,0,0,0,1|1,0,0]=3 878 B10R1.113 Cc1cncc(n1)C(=O)O AB48615 [0,1,0,0,0,1|1,0,0]=3 879 B10R1.113 Cc1nccc(n1)C(=O)C AB04788 [0,1,0,0,0,1|1,0,0]=3 880 B10R1.113 c1c(cncc1Cl)C(=O)O PB25983 [0,1,0,0,0,1|2,0,0]=4 881 B10R1.113 c1c(cncc1F)C(=O)O PB23226 [0,1,0,0,0,1|2,0,0]=4 882 B10R1.113 c1c(cncc1N)C(=O)O PB13029 [0,1,0,0,0,1|2,0,0]=4 883 B10R1.113 c1c(cncc1O)C(=O)N MB01725 [0,1,0,0,0,1|2,0,0]=4 884 B10R1.113 c1c(cncc1O)C(=O)O PB33816 [0,1,0,0,0,1|2,0,0]=4 885 B10R1.113 c1c(nc(cn1)Br)C(=O)N MB14307 [0,1,0,0,0,1|2,0,0]=4 886 B10R1.113 c1c(nc(cn1)Br)C(=O)O AB69955 [0,1,0,0,0,1|2,0,0]=4 887 B10R1.113 c1c(nc(cn1)Cl)C(=O)O PB21720 [0,1,0,0,0,1|2,0,0]=4 888 B10R1.113 c1c(nc(cn1)N)C(=O)O AB60537 [0,1,0,0,0,1|2,0,0]=4 889 B10R1.113 c1cc(cc(c1)Br)C(=O)N MB00265 [0,1,0,0,0,1|2,0,0]=4 890 B10R1.113 c1cc(cc(c1)O)C(=O)N MB00281 [0,1,0,0,0,1|2,0,0]=4 891 B10R1.113 c1cc(nc(c1)Br)C(=O)N MB00999 [0,1,0,0,0,1|2,0,0]=4 892 B10R1.113 c1cc(nc(c1)Br)C(=O)O AB03328 [0,1,0,0,0,1|2,0,0]=4 893 B10R1.113 c1cc(nc(c1)Cl)C(=O)O AB04138 [0,1,0,0,0,1|2,0,0]=4 894 B10R1.113 c1cc(nc(c1)F)C(=O)O AB11487 [0,1,0,0,0,1|2,0,0]=4 895 B10R1.113 c1cc(nc(c1)I)C(=O)N AB42518 [0,1,0,0,0,1|2,0,0]=4 896 B10R1.113 c1cc(nc(c1)I)C(=O)O AB42497 [0,1,0,0,0,1|2,0,0]=4 897 B10R1.113 c1cc(nc(c1)N)C(=O)O PB23179 [0,1,0,0,0,1|2,0,0]=4 898 B10R1.113 c1cnc(cc1Br)C(=O)O PB21234 [0,1,0,0,0,1|2,0,0]=4 899 B10R1.113 c1cnc(cc1C(=O)N)Br AB05162 [0,1,0,0,0,1|2,0,0]=4 900 B10R1.113 c1cnc(cc1C(=O)N)Cl AB04952 [0,1,0,0,0,1|2,0,0]=4 901 B10R1.113 c1cnc(cc1C(=O)N)N AB16207 [0,1,0,0,0,1|2,0,0]=4 902 B10R1.113 c1cnc(cc1C(=O)O)Br AB09563 [0,1,0,0,0,1|2,0,0]=4 903 B10R1.113 c1cnc(cc1C(=O)O)Cl PB12125 [0,1,0,0,0,1|2,0,0]=4 904 B10R1.113 c1cnc(cc1C(=O)O)F AB11490 [0,1,0,0,0,1|2,0,0]=4 905 B10R1.113 c1cnc(cc1C(=O)O)I AB29977 [0,1,0,0,0,1|2,0,0]=4 906 B10R1.113 c1cnc(cc1C(=O)O)N PB19872 [0,1,0,0,0,1|2,0,0]=4 907 B10R1.113 c1cnc(cc1C(=O)O)O PB29144 [0,1,0,0,0,1|2,0,0]=4 908 B10R1.113 c1cnc(cc1Cl)C(=O)N AB08235 [0,1,0,0,0,1|2,0,0]=4 909 B10R1.113 c1cnc(cc1Cl)C(=O)O AB04585 [0,1,0,0,0,1|2,0,0]=4 910 B10R1.113 c1cnc(cc1F)C(=O)O AB40659 [0,1,0,0,0,1|2,0,0]=4 911 B10R1.113 c1cnc(cc1I)C(=O)O AB28008 [0,1,0,0,0,1|2,0,0]=4 912 B10R1.113 c1cnc(cc1I)C(=O)O PB20818 [0,1,0,0,0,1|2,0,0]=4 913 B10R1.113 c1cnc(cc1N)C(=O)N AB43415 [0,1,0,0,0,1|2,0,0]=4 914 B10R1.113 c1cnc(cc1N)C(=O)O PB23313 [0,1,0,0,0,1|2,0,0]=4 915 B10R1.113 c1cnc(cc1O)C(=O)N MB05243 [0,1,0,0,0,1|2,0,0]=4 916 B10R1.113 c1cnc(cc1O)C(=O)O AB06407 [0,1,0,0,0,1|2,0,0]=4 917 B10R1.113 c1cnc(nc1Br)C(=O)N MB14225 [0,1,0,0,0,1|2,0,0]=4 918 B10R1.113 c1cnc(nc1C(=O)N)Br MB14149 [0,1,0,0,0,1|2,0,0]=4 919 B10R1.113 c1cnc(nc1C(=O)N)Cl PB21684 [0,1,0,0,0,1|2,0,0]=4 920 B10R1.113 c1cnc(nc1C(=O)O)Cl AB28457 [0,1,0,0,0,1|2,0,0]=4 921 B10R1.113 c1cnc(nc1C(=O)O)N AB42844 [0,1,0,0,0,1|2,0,0]=4 922 B10R1.113 c1cnc(nc1Cl)C(=O)O AB55866 [0,1,0,0,0,1|2,0,0]=4 923 B10R1.172 C#Cc1cc(cnc1)C=O AB63411 [0,1,0,0,0,1|1,0,1]=4 924 B10R1.172 C#Cc1cccc(c1)C=O AB23573 [0,1,0,0,0,1|1,0,1]=4 925 B10R1.172 C#Cc1ccnc(c1)C=O AB69038 [0,1,0,0,0,1|1,0,1]=4 926 B10R1.172 COc1cc(ccn1)C=O PB32415 [0,1,0,0,0,1|1,0,0]=3 927 B10R1.172 COc1cc(cnc1)C=O PB23495 [0,1,0,0,0,1|1,0,0]=3 928 B10R1.172 COc1cccc(c1)C=O AB00318 [0,1,0,0,0,1|1,0,0]=3 929 B10R1.172 COc1cccc(n1)C=O AB22243 [0,1,0,0,0,1|1,0,0]=3 930 B10R1.172 COc1ccnc(c1)C=O AB43663 [0,1,0,0,0,1|1,0,0]=3 931 B10R1.172 COc1cncc(n1)C=O AB73162 [0,1,0,0,0,1|1,0,0]=3 932 B10R1.172 COc1nccc(n1)C=O AB44816 [0,1,0,0,0,1|1,0,0]=3 933 B10R1.172 CSc1nccc(n1)C=O PB17294 [0,1,0,0,0,1|1,0,0]=3 934 B10R1.172 c1c(cncc1C#N)C=O AB31380 [0,1,0,0,0,1|1,0,1]=4 935 B10R1.172 c1c(cncc1C=O)CCl AB69676 [0,1,0,0,0,1|1,0,0]=3 936 B10R1.172 c1c(cncc1C=O)CN AB31382 [0,1,0,0,0,1|1,0,0]=3 937 B10R1.172 c1c(nc(cn1)C=O)C=O AB74048 [0,1,0,0,0,1|1,0,1]=4 938 B10R1.172 c1cc(nc(c1)C#N)C=O AB08283 [0,1,0,0,0,1|1,0,1]=4 939 B10R1.172 c1cc(nc(c1)C=O)CCl AB54693 [0,1,0,0,0,1|1,0,0]=3 940 B10R1.172 c1cnc(cc1C=O)C#N AB24814 [0,1,0,0,0,1|1,0,1]=4 941 B10R1.172 c1cnc(cc1C=O)CN AB31349 [0,1,0,0,0,1|1,0,0]=3 942 B10R1.172 c1cnc(nc1C#N)C=O AB74052 [0,1,0,0,0,1|1,0,1]=4 943 B10R1.172 c1cnc(nc1C=O)C#N AB74054 [0,1,0,0,0,1|1,0,1]=4 944 B10R1.172 c1cnc(nc1C=O)C=O AB58716 [0,1,0,0,0,1|1,0,1]=4 945 B10R1.172 c1cnc(nc1C=O)CBr MB10437 [0,1,0,0,0,1|1,0,0]=3 946 B10R1.172 c1cnc(nc1C=O)CCl AB58728 [0,1,0,0,0,1|1,0,0]=3 947 B10R1.172 c1cnc(nc1C=O)CO AB58724 [0,1,0,0,0,1|1,0,0]=3 948 B10R1.14 COC(=O)c1ccc(s1)Br PB24794 [0,2,0,0,0,0|1,1,0]=4 949 B10R1.14 COC(=O)c1ccc(s1)Cl MB03690 [0,2,0,0,0,0|1,1,0]=4 950 B10R1.14 Cc1ccc(s1)C(=O)OC AB23205 [0,2,0,0,0,0|0,1,0]=3 951 B10R1.14 Cc1cnc(o1)C(=O)OC AB53495 [0,2,0,0,0,0|1,0,0]=3 952 B10R1.14 Cc1cnc(s1)C(=O)OC AB10517 [0,2,0,0,0,0|1,1,0]=4 953 B10R1.14 Cc1csc(n1)C(=O)OC AB44701 [0,2,0,0,0,0|2,0,0]=4 954 B10R1.14 Cc1nc(co1)C(=O)OC AB13936 [0,2,0,0,0,0|2,0,0]=4 955 B10R1.14 Cc1ncc(o1)C(=O)OC AB27653 [0,2,0,0,0,0|1,0,0]=3 956 B10R1.14 c1cc(oc1C(=O)CBr)Br AB42923 [0,2,0,0,0,0|1,0,0]=3 957 B10R1.14 c1cc(sc1C(=O)C=O)Br AB48670 [0,2,0,0,0,0|1,1,0]=4 958 B10R1.54 Cc1ccn(n1)CC(=O)O AB14474 [0,2,0,0,0,0|2,0,0]=4 959 B10R1.54 Cc1nc(cs1)CC(=O)O AB12126 [0,2,0,0,0,0|2,0,0]=4 960 B10R1.54 Cc1ncc(o1)CC(=O)C AB44093 [0,2,0,0,0,0|1,0,0]=3 961 B10R1.31 B(c1ccc(o1)CO)(O)O AB13728 [0,2,0,0,0,0|1,0,1]=4 962 B10R1.31 CC(=O)c1nc(co1)CCl AB77016 [0,2,0,0,0,0|2,0,0]=4 963 B10R1.31 CC(C)c1csc(n1)C=O AB53820 [0,2,0,0,0,0|2,0,0]=4 964 B10R1.31 CC(C)c1nc(cs1)C=O AB26694 [0,2,0,0,0,0|2,0,0]=4 965 B10R1.31 CC(C)c1nnc(o1)C=O AB57528 [0,2,0,0,0,0|2,0,0]=4 966 B10R1.31 CCc1[nH]c(cn1)C(=O)O AB23181 [0,2,0,0,0,0|2,0,0]=4 967 B10R1.31 CCc1nnc(o1)C(=O)O AB57587 [0,2,0,0,0,0|2,0,0]=4 968 B10R1.31 CN(C)c1ncc(s1)C=O AB16787 [0,2,0,0,0,0|1,1,0]=4 969 B10R1.31 COc1ncc(s1)C(=O)O AB50992 [0,2,0,0,0,0|1,1,0]=4 970 B10R1.31 c1cc(sc1C#N)C(=O)N AB65695 [0,2,0,0,0,0|0,1,1]=4 971 B10R1.31 c1cc(sc1C=O)C(=O)N AB65691 [0,2,0,0,0,0|0,1,1]=4 972 B10R1.31 c1cc(sc1C=O)[N+](=O)[O-] PB23150 [0,2,0,0,0,0|1,1,0]=4 973 B10R1.31 c1cc(sc1CN)[N+](=O)[O-] AB23311 [0,2,0,0,0,0|1,1,0]=4 974 B10R1.34 CC1=C(C(=NC1C=O)C)Br AB43595 [0,2,0,0,0,0|1,0,1]=4 975 B10R1.34 Cc1c(sc(c1Br)Br)C=O AB10018 [0,2,0,0,0,0|1,1,0]=4 976 B10R1.59 CC1=C(N=C(C1)C)C(=O)O AB12161 [0,2,0,0,0,0|1,0,1]=4 977 B10R1.59 Cc1cc(c(o1)C)C(=O)O AB03078 [0,2,0,0,0,0|2,0,0]=4 978 B10R1.59 Cc1cc(c(s1)N)C(=O)N AB03142 [0,2,0,0,0,0|2,0,0]=4 979 B10R1.59 Cc1cc(c(s1)N)C(=O)O AB22303 [0,2,0,0,0,0|2,0,0]=4 980 B10R1.59 Cc1cc(sc1C(=O)O)Br CB11471 [0,2,0,0,0,0|1,1,0]=4 981 B10R1.59 Cn1cc(c(n1)C(=O)O)Br CB10384 [0,2,0,0,0,0|2,0,0]=4 982 B10R1.59 c1c(c(sc1Br)C(=O)N)N AB65687 [0,2,0,0,0,0|1,1,0]=4 983 B10R1.58 Cc1cc(nn1C)C(=O)O AB03175 [0,2,0,0,0,0|2,0,0]=4 984 B10R1.58 Cn1c(cc(n1)C(=O)O)N PB19094 [0,2,0,0,0,0|2,0,0]=4 985 B10R1.58 Cn1c(cc(n1)C(=O)O)O AB62568 [0,2,0,0,0,0|2,0,0]=4 986 B10R1.58 c1c(c(sc1C(=O)N)Br)Br AB06057 [0,2,0,0,0,0|1,1,0]=4 987 B10R1.55 Cc1ccc(s1)S(=O)(=O)Cl AB22770 [0,2,0,0,0,0|1,1,0]=4 988 B10R1.194 Cc1cnc(n1C)C(=O)O AB70178 [0,2,0,0,0,0|2,0,0]=4 989 B10R1.194 Cc1ncc(n1C)C(=O)C AB45828 [0,2,0,0,0,0|2,0,0]=4 990 B8R1.2 c1cc(cnc1)C=O AB00744 [0,0,1,1,0,0|2,0,0]=4 991 B8R1.2 c1cc(nnc1)C=O PB20119 [0,0,1,1,0,0|2,0,0]=4 992 B8R1.2 c1ccnc(c1)C=O AB00680 [0,0,1,1,0,0|1,0,1]=4 993 B8R1.3 Cc1ccc(=O)[nH]n1 PB21643 [0,0,1,1,0,0|2,0,0]=4 994 B8R1.3 Cc1ccc(cn1)Br AB06624 [0,0,1,1,0,0|2,0,0]=4 995 B8R1.3 Cc1ccc(cn1)Cl AB17956 [0,0,1,1,0,0|2,0,0]=4 996 B8R1.3 Cc1ccc(cn1)F PB18589 [0,0,1,1,0,0|2,0,0]=4 997 B8R1.3 Cc1ccc(cn1)N PB32227 [0,0,1,1,0,0|2,0,0]=4 998 B8R1.3 Cc1ccc(cn1)O PB30543 [0,0,1,1,0,0|1,0,0]=3 999 B8R1.3 Cc1ccc(nc1)O AB13138 [0,0,1,1,0,0|2,0,0]=4 1000 B8R1.3 Cc1ncc(cn1)O AB54467 [0,0,1,1,0,0|2,0,0]=4 1001 B8R1.3 c1cc(ncc1O)Br PB15771 [0,0,1,1,0,0|2,0,0]=4 1002 B8R1.3 c1cc(ncc1O)Cl PB32188 [0,0,1,1,0,0|2,0,0]=4 1003 B8R1.3 c1cc(ncc1O)F AB08123 [0,0,1,1,0,0|2,0,0]=4 1004 B8R1.3 c1cc(ncc1O)I AB50021 [0,0,1,1,0,0|2,0,0]=4 1005 B8R1.3 c1cc(ncc1O)N AB15563 [0,0,1,1,0,0|2,0,0]=4 1006 B8R1.5 Cc1c(cccn1)O PB18442 [0,0,1,1,0,0|2,0,0]=4 1007 B8R1.5 c1cc(c(nc1)Br)O PB28951 [0,0,1,1,0,0|2,0,0]=4 1008 B8R1.5 c1cc(c(nc1)Cl)O PB21615 [0,0,1,1,0,0|2,0,0]=4 1009 B8R1.5 c1cc(c(nc1)I)O MB00322 [0,0,1,1,0,0|2,0,0]=4 1010 B8R1.5 c1cc(c(nc1)N)O AB00700 [0,0,1,1,0,0|2,0,0]=4 1011 B8R1.5 c1cc(c(nc1)N)O AB17906 [0,0,1,1,0,0|2,0,0]=4