0 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.8 CCNC1=NN=CC=C1 Z991530898 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.8 CNCC1=NC=CC=N1 Z2310727788 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.8 CNCC1=NC=CN=C1 Z385447136 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.8 CNCC1=NC=NC=C1 Z2871313713 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [0,0,0,0,0,0|1,0,2]=3 15 B9R1.8 N#CCC1=NC=CC=C1 Z104476888 [0,0,0,0,0,0|1,0,2]=3 16 B9R1.8 N#CCC1=NC=CN=C1 Z1098233793 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.8 N#CCC1=NC=NC=C1 Z1098233919 [0,0,0,0,0,0|2,0,2]=4 18 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [0,0,0,0,0,0|1,0,2]=3 19 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [0,0,0,0,0,0|1,0,0]=1 20 B9R1.8 NCCC1=CCOCC1 Z1511513665 [0,0,0,0,0,0|1,0,3]=4 21 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [0,0,0,0,0,0|1,0,0]=1 22 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [0,0,0,0,0,0|1,0,0]=1 24 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.8 NCCN1CC=CCC1 Z1946684598 [0,0,0,0,0,0|1,0,3]=4 27 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [0,0,0,0,0,0|1,0,0]=1 28 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [0,0,0,0,0,0|1,0,1]=2 31 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [0,0,0,0,0,0|1,0,0]=1 32 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.8 OCCC1=NC=NC=C1 Z1250886882 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [0,0,0,0,0,0|2,0,1]=3 37 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [1,0,0,0,0,0|0,0,2]=3 38 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [1,0,0,0,0,0|1,0,2]=4 39 B8R1.2 CCC1=CC=CC=C1 Z104473632 [1,0,0,0,0,0|0,0,0]=1 40 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [1,0,0,0,0,0|1,0,0]=2 41 B8R1.2 CCC1=CN=CC=C1 Z104476778 [1,0,0,0,0,0|1,0,0]=2 42 B8R1.2 CCC1=NC=CC=C1 Z113558650 [1,0,0,0,0,0|1,0,0]=2 43 B8R1.2 CCC1=NC=CC=N1 Z1198725952 [1,0,0,0,0,0|2,0,0]=3 44 B8R1.2 CCC1=NC=NC=C1 Z1198725956 [1,0,0,0,0,0|2,0,0]=3 45 B8R1.2 CCC1=NN=CC=C1 Z1222425026 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.2 CNC1=CC=CC=C1 Z104472478 [1,0,0,0,0,0|1,0,0]=2 47 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.2 CNC1=NC=CC=N1 Z54628578 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.2 CNC1=NC=NC=C1 Z800212728 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.2 CNC1=NN=CC=C1 Z991530894 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.2 COC1=CC=CC=C1 Z53833865 [1,0,0,0,0,0|1,0,0]=2 52 B8R1.2 CSC1=CC=NC=C1 Z1376456468 [1,0,0,0,0,0|2,0,0]=3 53 B8R1.2 CSC1=NC=CN=C1 Z1203162104 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [1,0,0,0,0,0|2,0,0]=3 55 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [1,0,0,0,0,0|0,0,2]=3 56 B8R1.2 N#CC1=CC=NC=C1 Z57899720 [1,0,0,0,0,0|1,0,2]=4 57 B8R1.2 N#CC1=CN=CC=C1 Z57899719 [1,0,0,0,0,0|1,0,2]=4 58 B8R1.2 NCC1=CC=CC=C1 Z54748260 [1,0,0,0,0,0|0,0,0]=1 59 B8R1.2 NCC1=CC=NC=C1 Z104474354 [1,0,0,0,0,0|1,0,0]=2 60 B8R1.2 NCC1=CN=CC=C1 Z104474366 [1,0,0,0,0,0|1,0,0]=2 61 B8R1.2 NCC1=CN=CN=C1 Z3244401628 [1,0,0,0,0,0|2,0,0]=3 62 B8R1.2 NCC1=NC=CC=C1 Z104474352 [1,0,0,0,0,0|1,0,0]=2 63 B8R1.2 NCC1=NC=CC=N1 Z1463350843 [1,0,0,0,0,0|2,0,0]=3 64 B8R1.2 NCC1=NC=CN=C1 Z241059702 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.2 NCC1=NC=NC=C1 Z254526552 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.2 NCC1=NN=CC=C1 Z1198165902 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.2 NNC1=CC=CC=C1 Z104472442 [1,0,0,0,0,0|1,0,0]=2 68 B8R1.2 NNC1=NC=CC=C1 Z56887722 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [1,0,0,0,0,0|2,0,1]=4 70 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.2 OCC1=CC=CC=C1 Z104476418 [1,0,0,0,0,0|1,0,0]=2 73 B8R1.2 OCC1=CC=NC=C1 Z335244866 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.2 OCC1=CN=CC=C1 Z104495622 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.2 OCC1=NC=CC=C1 Z57921252 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.1 CC1=CC=C(C=C1)/C=N/O Z49568558 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.1 CC1=CC=C(C=C1)CC#N Z285131444 [0,1,0,0,0,0|0,0,2]=3 78 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [0,1,0,0,0,0|1,0,1]=3 79 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [0,1,0,0,0,0|0,0,0]=1 80 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [0,1,0,0,0,0|1,0,0]=2 81 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [0,1,0,0,0,0|1,0,0]=2 82 B10R1.1 CC1=NC=C(N=C1)CCO Z1504684184 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [0,1,0,0,0,0|1,0,0]=2 84 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [0,1,0,0,0,0|1,0,0]=2 85 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.1 CCNC1=CNC(=O)C=C1 Z5871830340 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.1 CCNC1=NC=C(C=C1)Br Z359297778 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.1 CCNC1=NC=C(C=C1)I Z2233927789 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.1 CCOC1=NC=C(C=C1)N Z240084310 [0,1,0,0,0,0|3,0,0]=4 97 B10R1.1 CCSC1=NC=C(C=C1)Br Z742922262 [0,1,0,0,0,0|3,0,0]=4 98 B10R1.1 CCSC1=NC=C(C=C1)N Z332377604 [0,1,0,0,0,0|3,0,0]=4 99 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.1 CNCC1=CN=C(C=C1)Cl Z265498862 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.1 CNCC1=CN=C(C=C1)F Z1745074466 [0,1,0,0,0,0|3,0,0]=4 106 B10R1.1 CNCC1=CN=C(C=C1)N Z1255388567 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.1 CNCC1=NC=C(C=C1)Br Z5436471179 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.1 CNCC1=NC=C(C=C1)C Z1255425232 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.1 CSCC1=CN=C(C=C1)Cl Z732206922 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.1 N#CCC1=CC=C(C=C1)F Z89283961 [0,1,0,0,0,0|0,0,2]=3 114 B10R1.1 N#CCC1=CC=C(C=C1)N Z90122117 [0,1,0,0,0,0|0,0,2]=3 115 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [0,1,0,0,0,0|0,0,2]=3 116 B10R1.1 N#CCC1=NC=C(C=C1)F Z1098233918 [0,1,0,0,0,0|1,0,2]=4 117 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [0,1,0,0,0,0|1,0,0]=2 118 B10R1.1 NC1=CN=C(C=C1)CCO Z1898597735 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [0,1,0,0,0,0|0,0,0]=1 120 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [0,1,0,0,0,0|0,0,0]=1 121 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [0,1,0,0,0,0|0,0,0]=1 122 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [0,1,0,0,0,0|0,0,0]=1 123 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [0,1,0,0,0,0|0,0,0]=1 124 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.1 NCCC1=CN=C(N=C1)O Z2725055726 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [0,1,0,0,0,0|1,0,0]=2 127 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [0,1,0,0,0,0|1,0,0]=2 128 B10R1.1 NCCC1=NC=C(C=N1)Br Z4752114140 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [0,1,0,0,0,0|1,0,0]=2 130 B10R1.1 O/N=C/C1=CC=C(C=C1)Br Z49568330 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.1 O/N=C/C1=CC=C(C=C1)Cl Z49568332 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.1 O/N=C/C1=CC=C(C=C1)F Z49568341 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.1 O=C1N=CC(=CN1)CCO Z2096659590 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.1 O=C=NC1=CC=C(C=C1)Br Z316172584 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.1 O=C=NC1=CC=C(C=C1)Cl Z104472166 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [0,1,0,0,0,0|1,0,1]=3 138 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [0,1,0,0,0,0|1,0,1]=3 139 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [0,1,0,0,0,0|1,0,1]=3 140 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [0,1,0,0,0,0|1,0,0]=2 143 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.1 [N-]=[N+]=NC1=CC=C(C=C1)Br Z235340111 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [0,1,0,0,0,0|1,0,1]=3 146 B10R1.4 CC1=C(C=CC=C1)/C=N/O Z49568554 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.4 CC1=C(C=CC=C1)CC#N Z57039593 [0,1,0,0,0,0|0,0,2]=3 148 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [0,1,0,0,0,0|1,0,1]=3 149 B10R1.4 CC1=C(C=CC=C1)CNN Z336481586 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.4 CC1=C(C=CC=N1)CC#N Z1198263560 [0,1,0,0,0,0|1,0,2]=4 151 B10R1.4 CC1=C(C=NC=C1)CCN Z1198264124 [0,1,0,0,0,0|1,0,0]=2 152 B10R1.4 CC1=C(N=CC=C1)CCN Z1098234132 [0,1,0,0,0,0|1,0,0]=2 153 B10R1.4 CC1=C(N=CC=C1)CCO Z1198169041 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.4 CC1=C(N=CC=N1)CCO Z1198163945 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.4 CCCC1=C(C=CC=C1)Br Z1479686725 [0,1,0,0,0,0|1,0,0]=2 156 B10R1.4 CCCC1=C(C=CC=C1)I Z821158622 [0,1,0,0,0,0|1,0,0]=2 157 B10R1.4 CCCC1=C(C=CC=C1)N Z336087926 [0,1,0,0,0,0|1,0,0]=2 158 B10R1.4 CCCC1=C(N=CC=N1)Cl Z1504680268 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.4 CCNC1=C(C=CC=C1)C Z104477886 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.4 CCNC1=C(C=CC=C1)F Z286518592 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.4 CCNC1=C(C=CC=C1)I Z4405452872 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.4 CCNC1=C(C=CC=C1)N Z359511482 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.4 CCNC1=C(C=CC=C1)O Z5185414820 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.4 CCNC1=C(C=CC=N1)C Z968907586 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.4 CCNC1=C(C=CC=N1)N Z803145254 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.4 CCNC1=C(C=CN=C1)C Z1946684572 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.4 CCNC1=C(C=NC=C1)N Z359511456 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.4 CCOC1=C(C=CC=C1)Br Z153728256 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.4 CCOC1=C(C=CC=C1)I Z406416174 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.4 CCOC1=C(C=CC=C1)N Z104478442 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.4 CCOC1=C(C=CC=N1)N Z240084312 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.4 CCOC1=C(N=CC=C1)N Z362783900 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.4 CCSC1=C(C=CC=C1)Br Z149386616 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.4 CCSC1=C(C=CC=C1)N Z316174690 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.4 CCSC1=CC=CNC1=O Z1509297963 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.4 CCSC1=[N+](C=CC=C1)[O-] Z18546433 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.4 CNCC1=C(C=CC=C1)Cl Z56955956 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.4 CNCC1=C(C=CC=C1)F Z56953087 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.4 CNCC1=C(C=CC=C1)N Z764242576 [0,1,0,0,0,0|2,0,0]=3 183 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.4 CNCC1=C(C=CC=N1)Cl Z5392638231 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.4 CNCC1=C(C=NC=C1)F Z4545616296 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.4 COCC1=C(C=CC=C1)I Z821093342 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.4 COCC1=C(N=CC=C1)N Z991490684 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.4 ClCCC1=C(N=CN=C1)Cl Z1262489672 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.4 N#CCC1=C(C=CC=C1)Cl Z56904744 [0,1,0,0,0,0|0,0,2]=3 192 B10R1.4 N#CCC1=C(C=CC=C1)F Z104477228 [0,1,0,0,0,0|0,0,2]=3 193 B10R1.4 N#CCC1=C(N=CC=C1)Cl Z1198263561 [0,1,0,0,0,0|1,0,2]=4 194 B10R1.4 N#CNC1=C(C=CC=C1)Cl Z991532350 [0,1,0,0,0,0|1,0,2]=4 195 B10R1.4 N#CSC1=C(C=CC=C1)F Z966424784 [0,1,0,0,0,0|1,0,2]=4 196 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [0,1,0,0,0,0|1,0,0]=2 197 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [0,1,0,0,0,0|0,0,0]=1 198 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [0,1,0,0,0,0|0,0,0]=1 199 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [0,1,0,0,0,0|0,0,0]=1 200 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [0,1,0,0,0,0|0,0,0]=1 201 B10R1.4 NCCC1=C(N=CC=C1)O Z5862214540 [0,1,0,0,0,0|1,0,0]=2 202 B10R1.4 NCCN1C=CC=CC1=O Z1891776659 [0,1,0,0,0,0|1,0,0]=2 203 B10R1.4 NCCN1C=CC=NC1=O Z3038857671 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.4 NCCN1C=NC=CC1=O Z2379084242 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.4 NCCN1N=CC=CC1=O Z1021422614 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.4 O/N=C/C1=C(C=CC=C1)Br Z49568618 [0,1,0,0,0,0|2,0,1]=4 207 B10R1.4 O/N=C/C1=C(C=CC=C1)F Z49568531 [0,1,0,0,0,0|2,0,1]=4 208 B10R1.4 O/N=C/C1=C(C=CC=C1)O Z49568319 [0,1,0,0,0,0|2,0,1]=4 209 B10R1.4 O=C1C=CC=CN1CCO Z234898059 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.4 O=C1C=CC=NN1CCO Z1021424276 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.4 O=C1C=CN=CN1CCO Z1154747269 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [0,1,0,0,0,0|1,0,1]=3 213 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [0,1,0,0,0,0|1,0,1]=3 214 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [0,1,0,0,0,0|1,0,0]=2 215 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [0,1,0,0,0,0|1,0,0]=2 216 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.10 CC1=CC(=CC=C1)CC#N Z285131450 [0,1,0,0,0,0|0,0,2]=3 218 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [0,1,0,0,0,0|0,0,0]=1 219 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [0,1,0,0,0,0|1,0,0]=2 220 B10R1.10 CC1=NC(=NC=C1)CCO Z1255460290 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [0,1,0,0,0,0|1,0,0]=2 222 B10R1.10 CCCC1=CC(=NN=C1)Cl Z4580564381 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.10 CCCC1=CC(=NN=C1)N Z4580562529 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.10 CCCC1=CC(=O)NN=C1 Z1198341234 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.10 CCCC1=NC(=CC=N1)N Z856211250 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.10 CCNC1=CC(=CC=C1)Br Z1217910559 [0,1,0,0,0,0|2,0,0]=3 227 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.10 CCNC1=CC(=CC=C1)Cl Z286371690 [0,1,0,0,0,0|2,0,0]=3 229 B10R1.10 CCNC1=CC(=NC=C1)Cl Z979422192 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.10 CCOC1=CC(=NC=C1)N Z1198157310 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.10 CCOC1=NC(=CC=C1)C Z1198168604 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.10 CCOC1=NC(=CC=C1)N Z1139188017 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.10 CCSC1=CC(=CC=C1)Br Z1090207966 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.10 CCSC1=CC(=CC=C1)N Z600393424 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.10 CCSC1=CC(=NC=C1)Cl Z1157653444 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.10 CCSC1=CC=CC(=O)N1 Z3004833863 [0,1,0,0,0,0|3,0,0]=4 239 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [0,1,0,0,0,0|2,0,0]=3 240 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.10 CNCC1=CC(=CN=C1)Br Z5095377359 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.10 CNCC1=CC=CC(=O)N1 Z2895739022 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.10 CNCC1=NC(=CC=C1)C Z1255523287 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.10 CNCC1=NC=CC(=C1)C Z5443664854 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.10 CNCC1=NC=CC(=C1)Cl Z3214695745 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.10 COCC1=CC(=NC=C1)N Z991490692 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.10 CSCC1=CC(=NC=C1)N Z991494168 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.10 N#CCC1=CC(=NC=C1)N Z1198329815 [0,1,0,0,0,0|1,0,2]=4 256 B10R1.10 N#CCC1=CC=CC(=C1)Cl Z57039594 [0,1,0,0,0,0|0,0,2]=3 257 B10R1.10 N#CCC1=CC=CC(=C1)F Z104477994 [0,1,0,0,0,0|0,0,2]=3 258 B10R1.10 N#CCC1=CC=CC(=C1)N Z90120426 [0,1,0,0,0,0|0,0,2]=3 259 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [0,1,0,0,0,0|0,0,2]=3 260 B10R1.10 N#CCC1=CC=CC(=N1)N Z1255362030 [0,1,0,0,0,0|1,0,2]=4 261 B10R1.10 N#CNC1=CC=CC(=C1)Cl Z991532332 [0,1,0,0,0,0|1,0,2]=4 262 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [0,1,0,0,0,0|1,0,0]=2 263 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [0,1,0,0,0,0|2,0,1]=4 264 B10R1.10 NC1=NC=CC(=C1)CCO Z1197888440 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [0,1,0,0,0,0|0,0,0]=1 266 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [0,1,0,0,0,0|0,0,0]=1 267 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [0,1,0,0,0,0|0,0,0]=1 268 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [0,1,0,0,0,0|0,0,0]=1 269 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [0,1,0,0,0,0|0,0,0]=1 270 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.10 NCCC1=CC(=NC=C1)N Z2310698980 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.10 NCCC1=NC(=NC=C1)N Z5619121124 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.10 NCCC1=NC=NC(=C1)Br Z4513781102 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.10 NCCC1=NC=NC(=C1)O Z2310716008 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [0,1,0,0,0,0|1,0,0]=2 276 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [0,1,0,0,0,0|1,0,1]=3 277 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [0,1,0,0,0,0|1,0,1]=3 278 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [0,1,0,0,0,0|1,0,0]=2 280 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [0,1,0,0,0,0|1,0,0]=2 281 B10R1.10 S=C=NC1=CC=CC(=C1)Cl Z56926571 [0,1,0,0,0,0|2,0,1]=4 282 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [0,1,0,0,0,0|0,0,1]=2 283 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [0,1,0,0,0,0|1,0,1]=3 284 B10R1.15 CC(C#N)C1=CC=NC=C1 Z415654740 [0,1,0,0,0,0|1,0,2]=4 285 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [0,1,0,0,0,0|1,0,1]=3 286 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [0,1,0,0,0,0|1,0,0]=2 287 B10R1.15 CC(CN)C1=CC=NC=C1 Z415654978 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [0,1,0,0,0,0|1,0,1]=3 289 B10R1.15 CCC(=O)C1=CC=NC=C1 Z513733916 [0,1,0,0,0,0|2,0,1]=4 290 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [0,1,0,0,0,0|1,0,0]=2 293 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.15 CN(N=O)C1=CC=CC=C1 Z87001980 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.15 CNC(=N)C1=CC=CC=C1 Z2096088186 [0,1,0,0,0,0|2,0,1]=4 296 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [0,1,0,0,0,0|2,0,1]=4 297 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.15 CNC(C)C1=CN=CC=C1 Z451350188 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.15 CNC(C)C1=NC=CC=C1 Z451350194 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.15 COC(=O)C1=CC=CC=C1 Z19825577 [0,1,0,0,0,0|2,0,1]=4 301 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [0,1,0,0,0,0|0,0,0]=1 302 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [0,1,0,0,0,0|0,0,2]=3 303 B10R1.15 N#CC(N)C1=CN=CC=C1 Z4339467200 [0,1,0,0,0,0|1,0,2]=4 304 B10R1.15 N/C(=N\O)/C1=CC=CC=C1 Z56827052 [0,1,0,0,0,0|2,0,1]=4 305 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [0,1,0,0,0,0|1,0,0]=2 306 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [0,1,0,0,0,0|0,0,1]=2 308 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [0,1,0,0,0,0|1,0,1]=3 309 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [0,1,0,0,0,0|0,0,0]=1 310 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [0,1,0,0,0,0|0,0,0]=1 311 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [0,1,0,0,0,0|1,0,0]=2 312 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [0,1,0,0,0,0|1,0,0]=2 313 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [0,1,0,0,0,0|1,0,1]=3 314 B10R1.15 NNC(=O)C1=CC=NC=C1 Z58981801 [0,1,0,0,0,0|2,0,1]=4 315 B10R1.15 NNC(=O)C1=CN=CC=C1 Z58981809 [0,1,0,0,0,0|2,0,1]=4 316 B10R1.15 NNC(=O)C1=NC=CC=C1 Z56922131 [0,1,0,0,0,0|2,0,1]=4 317 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [0,1,0,0,0,0|1,0,0]=2 318 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [0,1,0,0,0,0|1,0,0]=2 319 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [0,1,0,0,0,0|1,0,1]=3 320 B10R1.15 O=C(CCl)C1=CC=NC=C1 Z1198181039 [0,1,0,0,0,0|2,0,1]=4 321 B10R1.15 O=C(CCl)C1=CN=CC=C1 Z2768198137 [0,1,0,0,0,0|2,0,1]=4 322 B10R1.15 O=C(CCl)C1=NC=CC=C1 Z1205657985 [0,1,0,0,0,0|2,0,1]=4 323 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [0,1,0,0,0,0|1,0,1]=3 324 B10R1.15 O=C(NO)C1=CC=CC=C1 Z56912029 [0,1,0,0,0,0|2,0,1]=4 325 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [0,1,0,0,0,0|1,0,2]=4 326 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [0,1,0,0,0,0|1,0,0]=2 329 B10R1.17 CCCCC1=CC=CC=C1 Z104492496 [0,1,0,0,0,0|1,0,0]=2 330 B10R1.17 CCCNC1=CN=CC=C1 Z334882412 [0,1,0,0,0,0|2,0,0]=3 331 B10R1.17 CCCOC1=NC=CN=C1 Z2182020100 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.17 CCCSC1=NC=CC=N1 Z18380759 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [0,1,0,0,0,0|1,0,0]=2 334 B10R1.17 CCNCC1=CC=NC=C1 Z57327181 [0,1,0,0,0,0|2,0,0]=3 335 B10R1.17 CCNCC1=NC=CC=C1 Z90513146 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.17 CCSCC1=NC=CC=C1 Z1607601848 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [0,1,0,0,0,0|0,0,0]=1 338 B10R1.17 CNCCC1=CC=NC=C1 Z235580560 [0,1,0,0,0,0|1,0,0]=2 339 B10R1.17 CNCCC1=CN=CC=C1 Z2418466818 [0,1,0,0,0,0|1,0,0]=2 340 B10R1.17 CNCCC1=NC=CC=C1 Z2238930991 [0,1,0,0,0,0|1,0,0]=2 341 B10R1.17 CNCCC1=NC=CC=N1 Z3023337072 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [0,1,0,0,0,0|1,0,0]=2 343 B10R1.17 N#CCCC1=CC=CC=C1 Z104507980 [0,1,0,0,0,0|0,0,1]=2 344 B10R1.17 N#CCNC1=CC=CC=C1 Z56347332 [0,1,0,0,0,0|0,0,2]=3 345 B10R1.17 N#CCNC1=NC=CC=C1 Z1203732480 [0,1,0,0,0,0|1,0,2]=4 346 B10R1.17 N#CCOC1=CC=CC=C1 Z53792061 [0,1,0,0,0,0|0,0,2]=3 347 B10R1.17 N#CCSC1=CC=CC=C1 Z19751391 [0,1,0,0,0,0|0,0,2]=3 348 B10R1.17 N#CCSC1=NC=CC=C1 Z54336898 [0,1,0,0,0,0|1,0,2]=4 349 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [0,1,0,0,0,0|0,0,1]=2 350 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [0,1,0,0,0,0|1,0,1]=3 351 B10R1.17 NCC#CC1=CC=CC=C1 Z227964210 [0,1,0,0,0,0|0,0,1]=2 352 B10R1.17 NCC#CC1=NC=CC=C1 Z1456201642 [0,1,0,0,0,0|1,0,1]=3 353 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [0,1,0,0,0,0|0,0,0]=1 354 B10R1.17 NCCCC1=CN=CC=C1 Z3058301115 [0,1,0,0,0,0|1,0,0]=2 355 B10R1.17 NCCCC1=CN=NC=C1 Z3270187722 [0,1,0,0,0,0|2,0,0]=3 356 B10R1.17 NCCCC1=NC=CC=C1 Z600381818 [0,1,0,0,0,0|1,0,0]=2 357 B10R1.17 NCCCC1=NC=CN=C1 Z1474025943 [0,1,0,0,0,0|2,0,0]=3 358 B10R1.17 NCCNC1=CC=NC=C1 Z317257862 [0,1,0,0,0,0|1,0,0]=2 359 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [0,1,0,0,0,0|1,0,0]=2 360 B10R1.17 NCCNC1=NC=CC=N1 Z381428982 [0,1,0,0,0,0|2,0,0]=3 361 B10R1.17 NCCNC1=NN=CC=C1 Z991530796 [0,1,0,0,0,0|2,0,0]=3 362 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [0,1,0,0,0,0|0,0,0]=1 363 B10R1.17 NCCOC1=CC=NC=C1 Z3243651499 [0,1,0,0,0,0|1,0,0]=2 364 B10R1.17 NCCOC1=CN=CC=C1 Z429662874 [0,1,0,0,0,0|1,0,0]=2 365 B10R1.17 NCCOC1=NC=CC=N1 Z4381809298 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [0,1,0,0,0,0|0,0,0]=1 367 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [0,1,0,0,0,0|0,0,0]=1 368 B10R1.17 O=C/C=C/C1=CC=CC=C1 Z3219847383 [0,1,0,0,0,0|1,0,2]=4 369 B10R1.17 O=CC#CC1=CC=CC=C1 Z1255485337 [0,1,0,0,0,0|1,0,2]=4 370 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [0,1,0,0,0,0|1,0,0]=2 371 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [0,1,0,0,0,0|2,0,0]=3 373 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [0,1,0,0,0,0|1,0,1]=3 375 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [0,1,0,0,0,0|2,0,1]=4 376 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [0,1,0,0,0,0|1,0,1]=3 377 B10R1.17 O=CNNC1=CC=CC=C1 Z1198148433 [0,1,0,0,0,0|2,0,1]=4 378 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [0,1,0,0,0,0|1,0,1]=3 379 B10R1.17 OCC#CC1=NC=CC=C1 Z1143356057 [0,1,0,0,0,0|2,0,1]=4 380 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [0,1,0,0,0,0|1,0,0]=2 381 B10R1.17 OCCCC1=CC=NC=C1 Z104475752 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [0,1,0,0,0,0|2,0,0]=3 383 B10R1.17 OCCCC1=NC=NC=C1 Z2044799287 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.17 OCCNC1=CC=NC=C1 Z359301874 [0,1,0,0,0,0|2,0,0]=3 385 B10R1.17 OCCNC1=NC=CC=C1 Z31212159 [0,1,0,0,0,0|2,0,0]=3 386 B10R1.17 OCCNC1=NC=CC=N1 Z31212160 [0,1,0,0,0,0|3,0,0]=4 387 B10R1.17 OCCNC1=NC=CN=C1 Z31212301 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.17 OCCNC1=NN=CC=C1 Z991531008 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [0,1,0,0,0,0|1,0,0]=2 390 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [0,1,0,0,0,0|2,0,0]=3 391 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [0,1,0,0,0,0|1,0,0]=2 392 B10R1.17 S=C=NCC1=CC=CC=C1 Z56869309 [0,1,0,0,0,0|1,0,1]=3 393 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [0,1,0,0,0,0|2,0,1]=4 394 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [0,1,0,0,0,0|2,0,1]=4 395 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [0,1,0,0,0,0|1,0,0]=2 396 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [0,1,0,0,0,0|2,0,0]=3 397 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [0,1,0,0,0,0|2,0,0]=3 398 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.18 CC(C)OC1=CC=NC=C1 Z1140308716 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [0,1,0,0,0,0|1,0,0]=2 402 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [0,1,0,0,0,0|1,0,0]=2 403 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [0,1,0,0,0,0|2,0,0]=3 404 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [0,1,0,0,0,0|2,0,0]=3 405 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [0,1,0,0,0,0|3,0,0]=4 406 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [0,1,0,0,0,0|3,0,0]=4 407 B10R1.18 FC(F)OC1=CN=CC=C1 Z808605476 [0,1,0,0,0,0|3,0,0]=4 408 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [0,1,0,0,0,0|0,0,1]=2 409 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [0,1,0,0,0,0|1,0,1]=3 410 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [0,1,0,0,0,0|1,0,1]=3 411 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [0,1,0,0,0,0|0,0,1]=2 412 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [0,1,0,0,0,0|1,0,1]=3 413 B10R1.18 NC(=O)CC1=CN=CN=C1 Z1203583458 [0,1,0,0,0,0|2,0,1]=4 414 B10R1.18 NC(=O)NC1=NC=CC=C1 Z208358454 [0,1,0,0,0,0|2,0,1]=4 415 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [0,1,0,0,0,0|1,0,1]=3 416 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [0,1,0,0,0,0|0,0,1]=2 417 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [0,1,0,0,0,0|1,0,1]=3 418 B10R1.18 NC(=S)NC1=NC=CC=C1 Z57106231 [0,1,0,0,0,0|2,0,1]=4 419 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [0,1,0,0,0,0|2,0,1]=4 420 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [0,1,0,0,0,0|2,0,1]=4 421 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [0,1,0,0,0,0|2,0,0]=3 422 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [0,1,0,0,0,0|2,0,0]=3 424 B10R2.6 C1=CC(=CC=N1)C2CC2 Z3042074264 [0,0,0,1,0,0|2,0,0]=3 425 B10R2.6 C1=CC(=CC=N1)C2CO2 Z1187818726 [0,0,0,1,0,0|2,0,0]=3 426 B10R2.6 C1=CC(=CN=C1)C2CO2 Z1187818722 [0,0,0,1,0,0|2,0,0]=3 427 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [0,0,0,1,0,0|1,0,0]=2 428 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [0,0,0,1,0,0|1,0,0]=2 429 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [0,0,0,1,0,0|1,0,0]=2 430 B10R2.6 C1=CN=C(C=C1)C2CO2 Z1187818707 [0,0,0,1,0,0|2,0,0]=3 431 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [0,0,0,1,0,0|1,0,1]=3 432 B10R2.7 C1=CC2=C(C=C1)CNC2 Z1263820391 [0,0,0,1,0,0|2,0,0]=3 433 B10R2.7 C1=CC2=C(C=C1)COC2 Z839134770 [0,0,0,1,0,0|2,0,0]=3 434 B10R2.7 C1=CC2=C(C=C1)N=[Se]=N2 Z56941035 [0,0,0,1,0,0|2,0,1]=4 435 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [0,0,0,1,0,0|0,0,2]=3 436 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [0,0,0,1,0,0|1,0,1]=3 437 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [0,0,0,1,0,0|0,0,0]=1 438 B10R2.7 C1=CC2=C(C=C1)NN=C2 Z276614452 [0,0,0,1,0,0|1,0,1]=3 439 B10R2.7 C1=CC2=C(C=C1)NN=N2 Z57127352 [0,0,0,1,0,0|2,0,0]=3 440 B10R2.7 C1=CC2=C(C=C1)OC=C2 Z56347207 [0,0,0,1,0,0|1,0,2]=4 441 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [0,0,0,1,0,0|1,0,0]=2 442 B10R2.7 C1=CC2=C(C=C1)ON=C2 Z220335556 [0,0,0,1,0,0|2,0,1]=4 443 B10R2.7 C1=CC2=C(C=C1)SC=C2 Z370711590 [0,0,0,1,0,0|1,0,2]=4 444 B10R2.7 C1=CC2=C(C=C1)SC=N2 Z104472964 [0,0,0,1,0,0|1,0,2]=4 445 B10R2.7 C1=CC2=C(C=C1)SN=N2 Z1198148806 [0,0,0,1,0,0|2,0,1]=4 446 B10R2.7 C1=CC2=C(C=CN2)C=N1 Z1079456082 [0,0,0,1,0,0|1,0,2]=4 447 B10R2.7 C1=CC2=C(C=N1)C=NN2 Z1157651607 [0,0,0,1,0,0|2,0,1]=4 448 B10R2.7 C1=CC2=C(C=N1)CCN2 Z1650168304 [0,0,0,1,0,0|1,0,0]=2 449 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [0,0,0,1,0,0|2,0,0]=3 450 B10R2.7 C1=CC2=C(C=N1)NC=C2 Z871773918 [0,0,0,1,0,0|1,0,2]=4 451 B10R2.7 C1=CC2=C(C=N1)NC=N2 Z1117890443 [0,0,0,1,0,0|2,0,1]=4 452 B10R2.7 C1=CC2=C(C=N1)NCC2 Z1603826893 [0,0,0,1,0,0|1,0,0]=2 453 B10R2.7 C1=CC2=C(CCN2)N=C1 Z1203748137 [0,0,0,1,0,0|1,0,0]=2 454 B10R2.7 C1=CC2=C(CNC2)N=C1 Z1741974952 [0,0,0,1,0,0|3,0,0]=4 455 B10R2.7 C1=CC2=C(N=C1)NC=C2 Z271099378 [0,0,0,1,0,0|1,0,2]=4 456 B10R2.7 C1=CC2=C(N=C1)NC=N2 Z276130126 [0,0,0,1,0,0|2,0,1]=4 457 B10R2.7 C1=CC2=C(N=C1)NCC2 Z979438826 [0,0,0,1,0,0|1,0,0]=2 458 B10R2.7 C1=CC2=C(N=C1)NN=C2 Z1147474011 [0,0,0,1,0,0|2,0,1]=4 459 B10R2.7 C1=CC2=C(N=C1)NN=N2 Z3235024586 [0,0,0,1,0,0|3,0,0]=4 460 B10R2.7 C1=CC2=NSN=C2C=C1 Z56893124 [0,0,0,1,0,0|2,0,1]=4 461 B10R2.7 C1=NC=C2N=NNC2=C1 Z56777354 [0,0,0,1,0,0|3,0,0]=4 462 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [0,0,0,1,0,0|0,0,0]=1 463 B8R1.8 C#CCN1C=CC=C1 Z440631944 [0,0,0,0,1,0|2,0,1]=4 464 B8R1.8 CCCC1=CNN=C1 Z1263714332 [0,0,0,0,1,0|3,0,0]=4 465 B8R1.8 CCCC1=NC=CN1 Z1201043633 [0,0,0,0,1,0|3,0,0]=4 466 B8R1.8 CNCC1=CC=CN1 Z102767010 [0,0,0,0,1,0|3,0,0]=4 467 B8R1.8 CNCC1=CC=CO1 Z57051072 [0,0,0,0,1,0|3,0,0]=4 468 B8R1.8 CNCC1=CC=CS1 Z56948283 [0,0,0,0,1,0|3,0,0]=4 469 B8R1.8 CNCC1=COC=C1 Z385447092 [0,0,0,0,1,0|3,0,0]=4 470 B8R1.8 CNCC1=CSC=C1 Z57206125 [0,0,0,0,1,0|3,0,0]=4 471 B8R1.8 ClCCN1C=CN=C1 Z94599643 [0,0,0,0,1,0|3,0,0]=4 472 B8R1.8 N#CCC1=CC=CN1 Z810507734 [0,0,0,0,1,0|1,0,2]=4 473 B8R1.8 N#CCC1=CSC=C1 Z111869576 [0,0,0,0,1,0|1,0,2]=4 474 B8R1.8 NCCC1=CC=CN1 Z810507730 [0,0,0,0,1,0|1,0,0]=2 475 B8R1.8 NCCC1=CC=CO1 Z1694636467 [0,0,0,0,1,0|1,0,0]=2 476 B8R1.8 NCCC1=CC=CS1 Z90662945 [0,0,0,0,1,0|1,0,0]=2 477 B8R1.8 NCCC1=CC=NS1 Z2768432862 [0,0,0,0,1,0|2,0,0]=3 478 B8R1.8 NCCC1=CNC=N1 Z1267773750 [0,0,0,0,1,0|2,0,0]=3 479 B8R1.8 NCCC1=CNN=C1 Z336080532 [0,0,0,0,1,0|2,0,0]=3 480 B8R1.8 NCCC1=CNN=N1 Z3005762594 [0,0,0,0,1,0|3,0,0]=4 481 B8R1.8 NCCC1=COC=C1 Z2310701825 [0,0,0,0,1,0|1,0,0]=2 482 B8R1.8 NCCC1=NC=CO1 Z4925106850 [0,0,0,0,1,0|2,0,0]=3 483 B8R1.8 NCCC1=NC=CS1 Z2724334997 [0,0,0,0,1,0|2,0,0]=3 484 B8R1.8 NCCC1=NN=CN1 Z1687906395 [0,0,0,0,1,0|3,0,0]=4 485 B8R1.8 NCCC1=NN=CS1 Z3067374940 [0,0,0,0,1,0|3,0,0]=4 486 B8R1.8 NCCC1=NNC=C1 Z2867120994 [0,0,0,0,1,0|2,0,0]=3 487 B8R1.8 NCCC1=NOC=N1 Z1262691677 [0,0,0,0,1,0|3,0,0]=4 488 B8R1.8 NCCC1CC=CC1 Z2310699161 [0,0,0,0,1,0|0,0,3]=4 489 B8R1.8 NCCN1C=CC=N1 Z271005714 [0,0,0,0,1,0|2,0,0]=3 490 B8R1.8 NCCN1C=CN=C1 Z147642864 [0,0,0,0,1,0|2,0,0]=3 491 B8R1.8 NCCN1C=CN=N1 Z2491107416 [0,0,0,0,1,0|3,0,0]=4 492 B8R1.8 NCCN1C=NC=N1 Z381061410 [0,0,0,0,1,0|3,0,0]=4 493 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [0,0,0,0,1,0|2,0,1]=4 494 B8R1.8 O=CCC1=CC=CS1 Z993017816 [0,0,0,0,1,0|2,0,1]=4 495 B8R1.8 O=CCC1=CSC=C1 Z1079442684 [0,0,0,0,1,0|2,0,1]=4 496 B8R1.8 OCCC1=CC=CO1 Z1179944660 [0,0,0,0,1,0|2,0,0]=3 497 B8R1.8 OCCC1=CC=CS1 Z397587354 [0,0,0,0,1,0|2,0,0]=3 498 B8R1.8 OCCC1=CN=CS1 Z1198334159 [0,0,0,0,1,0|3,0,0]=4 499 B8R1.8 OCCC1=CNN=C1 Z1333876037 [0,0,0,0,1,0|3,0,0]=4 500 B8R1.8 OCCC1=COC=C1 Z1179944659 [0,0,0,0,1,0|2,0,0]=3 501 B8R1.8 OCCC1=CSC=C1 Z397587098 [0,0,0,0,1,0|2,0,0]=3 502 B8R1.8 OCCC1=CSC=N1 Z1263714384 [0,0,0,0,1,0|3,0,0]=4 503 B8R1.8 OCCN1C=CC=N1 Z425794824 [0,0,0,0,1,0|3,0,0]=4 504 B7R1.3 CC1=CN=CC=C1 Z104475010 [2,0,0,0,0,0|1,0,0]=3 505 B7R1.3 CC1=CN=NC=C1 Z1255398931 [2,0,0,0,0,0|2,0,0]=4 506 B7R1.3 CC1=NC=CC=C1 Z104472800 [2,0,0,0,0,0|1,0,0]=3 507 B7R1.3 CC1=NC=CN=C1 Z415628164 [2,0,0,0,0,0|2,0,0]=4 508 B7R1.3 CC1=NN=CC=C1 Z1245648324 [2,0,0,0,0,0|2,0,0]=4 509 B7R1.3 C[N+]1=CC=CC=C1 Z57947843 [2,0,0,0,0,0|1,0,0]=3 510 B7R1.3 NC1=CC=CC=C1 Z2301541997 [2,0,0,0,0,0|0,0,0]=2 511 B7R1.3 NC1=CC=NC=C1 Z104495272 [2,0,0,0,0,0|1,0,0]=3 512 B7R1.3 NC1=CN=CC=C1 Z104494800 [2,0,0,0,0,0|1,0,0]=3 513 B7R1.3 NC1=CN=CN=C1 Z800187814 [2,0,0,0,0,0|2,0,0]=4 514 B7R1.3 NC1=NC=CC=C1 Z104472278 [2,0,0,0,0,0|1,0,0]=3 515 B7R1.3 NC1=NC=CC=N1 Z2895177097 [2,0,0,0,0,0|2,0,0]=4 516 B7R1.3 NC1=NC=CN=C1 Z56899063 [2,0,0,0,0,0|2,0,0]=4 517 B7R1.3 NC1=NC=NC=C1 Z3244659415 [2,0,0,0,0,0|2,0,0]=4 518 B7R1.3 NC1=NN=CC=C1 Z991531024 [2,0,0,0,0,0|2,0,0]=4 519 B7R1.3 N[N+]1=CC=CC=C1 Z56872220 [2,0,0,0,0,0|1,0,0]=3 520 B7R1.3 O=C1C=CC=CN1 Z1245646663 [2,0,0,0,0,0|2,0,0]=4 521 B7R1.3 O=C1C=COC=C1 Z586248016 [2,0,0,0,0,0|2,0,0]=4 522 B7R1.3 OC1=CC=CC=C1 Z104473830 [2,0,0,0,0,0|1,0,0]=3 523 B7R1.3 OC1=CN=CC=C1 Z104476790 [2,0,0,0,0,0|2,0,0]=4 524 B7R1.3 SC1=NC=CC=C1 Z203045372 [2,0,0,0,0,0|2,0,0]=4 525 B9R1.1 CC1=CC=C(C=C1)C#N Z56965882 [1,1,0,0,0,0|0,0,2]=4 526 B9R1.1 CC1=CC=C(C=C1)C=O Z104477698 [1,1,0,0,0,0|1,0,1]=4 527 B9R1.1 CC1=CC=C(C=C1)NN Z56911942 [1,1,0,0,0,0|1,0,0]=3 528 B9R1.1 CC1=CN=C(C=C1)CO Z1198270889 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.1 CC1=CN=C(N=C1)CN Z2327893645 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.1 CC1=NC=C(C=C1)CN Z444349734 [1,1,0,0,0,0|1,0,0]=3 531 B9R1.1 CC1=NC=C(C=C1)CO Z397587474 [1,1,0,0,0,0|2,0,0]=4 532 B9R1.1 CC1=NC=C(N=C1)CN Z3271770568 [1,1,0,0,0,0|2,0,0]=4 533 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [1,1,0,0,0,0|0,0,0]=2 534 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [1,1,0,0,0,0|0,0,0]=2 535 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [1,1,0,0,0,0|0,0,0]=2 536 B9R1.1 CCC1=CN=C(C=C1)N Z1198224278 [1,1,0,0,0,0|1,0,0]=3 537 B9R1.1 CCC1=CN=C(N=C1)Br Z1255367602 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.1 CCC1=CN=C(N=C1)Cl Z1255423971 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.1 CCC1=CN=C(N=C1)N Z1137168329 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.1 CCC1=NC=C(C=N1)N Z381402598 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.1 CCC1=NC=C(N=C1)Br Z1198319305 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.1 CNC1=CC=C(C=C1)I Z744582716 [1,1,0,0,0,0|1,0,0]=3 543 B9R1.1 CNC1=CC=C(C=C1)O Z940713298 [1,1,0,0,0,0|1,0,0]=3 544 B9R1.1 CNC1=NC=C(C=C1)Br Z359297630 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.1 CNC1=NC=C(C=C1)C Z359297596 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.1 CNC1=NC=C(C=C1)Cl Z359297632 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.1 CNC1=NC=C(C=C1)F Z802823886 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.1 COC1=CC=C(C=C1)C Z53834227 [1,1,0,0,0,0|1,0,0]=3 549 B9R1.1 COC1=CC=C(C=C1)F Z53834743 [1,1,0,0,0,0|1,0,0]=3 550 B9R1.1 COC1=CC=C(C=C1)N Z56938150 [1,1,0,0,0,0|1,0,0]=3 551 B9R1.1 COC1=CC=C(C=C1)O Z104474598 [1,1,0,0,0,0|1,0,0]=3 552 B9R1.1 COC1=CN=C(C=C1)C Z1198232754 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.1 COC1=NC=C(C=C1)Br Z808608370 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.1 COC1=NC=C(C=C1)Cl Z1094698482 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.1 COC1=NC=C(C=C1)N Z56899049 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.1 CSC1=CC=C(C=C1)N Z104511114 [1,1,0,0,0,0|1,0,0]=3 558 B9R1.1 CSC1=CN=C(C=C1)N Z412025068 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.1 CSC1=NC=C(C=C1)N Z412022842 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.1 FC1=CC=C(C=C1)CBr Z89269613 [1,1,0,0,0,0|1,0,0]=3 561 B9R1.1 N#CC1=CC=C(C=C1)Br Z55928801 [1,1,0,0,0,0|0,0,2]=4 562 B9R1.1 N#CC1=CC=C(C=C1)Cl Z56942044 [1,1,0,0,0,0|0,0,2]=4 563 B9R1.1 N#CC1=CC=C(C=C1)I Z57899725 [1,1,0,0,0,0|0,0,2]=4 564 B9R1.1 N#CC1=CC=C(C=C1)N Z57073771 [1,1,0,0,0,0|0,0,2]=4 565 B9R1.1 N#CC1=CC=C(C=C1)O Z104473840 [1,1,0,0,0,0|0,0,2]=4 566 B9R1.1 NC1=NC=C(C=C1)CO Z960446254 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.1 NCC1=CC=C(C=C1)F Z54748266 [1,1,0,0,0,0|0,0,0]=2 568 B9R1.1 NCC1=CC=C(C=C1)O Z235348101 [1,1,0,0,0,0|0,0,0]=2 569 B9R1.1 NCC1=CN=C(C=C1)Cl Z247612574 [1,1,0,0,0,0|1,0,0]=3 570 B9R1.1 NCC1=CN=C(C=C1)F Z1198311144 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.1 NCC1=CN=C(C=C1)O Z1269638445 [1,1,0,0,0,0|1,0,0]=3 572 B9R1.1 NCC1=CN=C(N=C1)Cl Z3244522008 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.1 NCC1=NC=C(C=C1)Br Z3241254216 [1,1,0,0,0,0|1,0,0]=3 574 B9R1.1 NCC1=NC=C(C=C1)Cl Z636367336 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.1 NCC1=NC=C(C=C1)F Z1198277779 [1,1,0,0,0,0|1,0,0]=3 576 B9R1.1 NCC1=NC=C(C=C1)N Z3244746175 [1,1,0,0,0,0|1,0,0]=3 577 B9R1.1 NCC1=NC=C(C=C1)O Z3324887230 [1,1,0,0,0,0|1,0,0]=3 578 B9R1.1 NCC1=NC=C(C=N1)Br Z2901974002 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.1 NCC1=NC=C(C=N1)Cl Z3243815124 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.1 NCC1=NC=C(N=C1)Br Z1416181963 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.1 NCC1=NC=C(N=C1)Cl Z1198278893 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.1 NCC1=NN=C(C=C1)Cl Z3976570544 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.1 NCC1=NNC(=O)C=C1 Z2230911335 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.1 NNC1=CC=C(C=C1)Cl Z56776889 [1,1,0,0,0,0|1,0,0]=3 585 B9R1.1 O=CC1=CC=C(C=C1)Br Z57162109 [1,1,0,0,0,0|1,0,1]=4 586 B9R1.1 O=CC1=CC=C(C=C1)Cl Z57772447 [1,1,0,0,0,0|1,0,1]=4 587 B9R1.1 O=CC1=CC=C(C=C1)F Z104472914 [1,1,0,0,0,0|1,0,1]=4 588 B9R1.1 O=CC1=CC=C(C=C1)I Z57887684 [1,1,0,0,0,0|1,0,1]=4 589 B9R1.1 O=CC1=CC=C(C=C1)O Z57127520 [1,1,0,0,0,0|1,0,1]=4 590 B9R1.1 O=CC1=CC=C(C=C1)S Z1198150788 [1,1,0,0,0,0|1,0,1]=4 591 B9R1.1 OCC1=CC=C(C=C1)Br Z335244742 [1,1,0,0,0,0|1,0,0]=3 592 B9R1.1 OCC1=CC=C(C=C1)Cl Z104478032 [1,1,0,0,0,0|1,0,0]=3 593 B9R1.1 OCC1=CC=C(C=C1)F Z104477460 [1,1,0,0,0,0|1,0,0]=3 594 B9R1.1 OCC1=CC=C(C=C1)I Z385370342 [1,1,0,0,0,0|1,0,0]=3 595 B9R1.1 OCC1=NC=C(C=C1)Br Z1065600752 [1,1,0,0,0,0|2,0,0]=4 596 B9R1.1 OCC1=NC=C(C=C1)Cl Z1198272591 [1,1,0,0,0,0|2,0,0]=4 597 B9R1.1 OCC1=NC=C(C=C1)O Z1217915045 [1,1,0,0,0,0|2,0,0]=4 598 B9R1.1 SCC1=CC=C(C=C1)Cl Z55948216 [1,1,0,0,0,0|1,0,0]=3 599 B9R1.2 C#CC1=CC=CC(=C1)Cl Z1080385596 [1,1,0,0,0,0|0,0,2]=4 600 B9R1.2 C#CC1=CC=CC(=C1)N Z235485474 [1,1,0,0,0,0|0,0,2]=4 601 B9R1.2 CC1=CC(=CC=C1)C=O Z104478208 [1,1,0,0,0,0|1,0,1]=4 602 B9R1.2 CC1=CC(=CC=C1)NN Z56943685 [1,1,0,0,0,0|1,0,0]=3 603 B9R1.2 CC1=CC(=CN=C1)CN Z1198167984 [1,1,0,0,0,0|1,0,0]=3 604 B9R1.2 CC1=CC(=CN=C1)CO Z4562296729 [1,1,0,0,0,0|2,0,0]=4 605 B9R1.2 CC1=NC(=CC=C1)CN Z291234028 [1,1,0,0,0,0|1,0,0]=3 606 B9R1.2 CC1=NC(=CC=C1)CO Z397587486 [1,1,0,0,0,0|2,0,0]=4 607 B9R1.2 CC1=NC(=NC=C1)CN Z2372278985 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.2 CC1=NC=CC(=C1)CO Z1198175905 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [1,1,0,0,0,0|0,0,0]=2 610 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [1,1,0,0,0,0|0,0,0]=2 611 B9R1.2 CCC1=NC(=CC=C1)C Z1255485781 [1,1,0,0,0,0|1,0,0]=3 612 B9R1.2 CCC1=NC(=CC=N1)Cl Z445153086 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.2 CCC1=NC(=NC=C1)Cl Z1198279743 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.2 CCC1=NC(=NC=C1)N Z1203579436 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.2 CCC1=NC=NC(=C1)Br Z798339806 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.2 CCC1=NC=NC(=C1)Cl Z798251108 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.2 CCC1=NC=NC(=C1)N Z798339040 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.2 CCC1=NC=NC(=C1)O Z798251110 [1,1,0,0,0,0|2,0,0]=4 619 B9R1.2 CC[N+]1=CC(=CC=C1)O Z2168499555 [1,1,0,0,0,0|1,0,0]=3 620 B9R1.2 CNC1=CC(=CC=C1)F Z335274194 [1,1,0,0,0,0|1,0,0]=3 621 B9R1.2 CNC1=CC(=CC=C1)I Z4085232023 [1,1,0,0,0,0|1,0,0]=3 622 B9R1.2 CNC1=CC(=CC=C1)N Z376447548 [1,1,0,0,0,0|1,0,0]=3 623 B9R1.2 CNC1=CC(=CC=C1)O Z1082872246 [1,1,0,0,0,0|1,0,0]=3 624 B9R1.2 CNC1=CC(=CN=C1)Br Z1255444030 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.2 CNC1=CC(=NC=C1)C Z1203748481 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.2 CNC1=NC(=CC=C1)C Z600403388 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.2 COC1=CC(=CC=C1)C Z53834440 [1,1,0,0,0,0|1,0,0]=3 628 B9R1.2 COC1=CC(=CC=C1)N Z104472536 [1,1,0,0,0,0|1,0,0]=3 629 B9R1.2 COC1=CC(=CC=C1)O Z104478798 [1,1,0,0,0,0|1,0,0]=3 630 B9R1.2 COC1=CC(=NC=C1)N Z1201624123 [1,1,0,0,0,0|2,0,0]=4 631 B9R1.2 COC1=CC(=O)NC=C1 Z1741975851 [1,1,0,0,0,0|2,0,0]=4 632 B9R1.2 COC1=NC(=CC=C1)O Z1198172138 [1,1,0,0,0,0|2,0,0]=4 633 B9R1.2 COC1=NC=CC(=C1)Cl Z1201623697 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.2 CSC1=CC(=CC=C1)N Z104472758 [1,1,0,0,0,0|1,0,0]=3 635 B9R1.2 CSC1=CC(=CN=C1)N Z2239020735 [1,1,0,0,0,0|2,0,0]=4 636 B9R1.2 CSC1=CC(=NC=C1)Cl Z1157653499 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.2 CSC1=CC(=NC=C1)N Z1203581667 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.2 CSC1=NC=CC(=C1)N Z851811592 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.2 CSC1=NC=CC(=C1)O Z1255421960 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.2 ClCC1=CC(=CN=C1)Br Z381037204 [1,1,0,0,0,0|2,0,0]=4 641 B9R1.2 N#CC1=CC=CC(=C1)Br Z57899727 [1,1,0,0,0,0|0,0,2]=4 642 B9R1.2 N#CC1=CC=CC(=C1)I Z57899724 [1,1,0,0,0,0|0,0,2]=4 643 B9R1.2 N#CC1=CC=CC(=C1)N Z104477194 [1,1,0,0,0,0|0,0,2]=4 644 B9R1.2 N#CC1=CC=CC(=C1)O Z56969327 [1,1,0,0,0,0|0,0,2]=4 645 B9R1.2 NC1=CC(=NC=C1)CO Z1198310848 [1,1,0,0,0,0|2,0,0]=4 646 B9R1.2 NC1=NC(=CC=C1)CO Z154209994 [1,1,0,0,0,0|2,0,0]=4 647 B9R1.2 NC1=NC=CC(=C1)CO Z991492364 [1,1,0,0,0,0|2,0,0]=4 648 B9R1.2 NCC1=CC(=CC=C1)Br Z1262246228 [1,1,0,0,0,0|0,0,0]=2 649 B9R1.2 NCC1=CC(=CC=C1)I Z1269220799 [1,1,0,0,0,0|0,0,0]=2 650 B9R1.2 NCC1=CC(=CC=C1)O Z744729056 [1,1,0,0,0,0|0,0,0]=2 651 B9R1.2 NCC1=CC(=CN=C1)Br Z2692250391 [1,1,0,0,0,0|1,0,0]=3 652 B9R1.2 NCC1=CC(=CN=C1)Cl Z3244925674 [1,1,0,0,0,0|1,0,0]=3 653 B9R1.2 NCC1=CC(=CN=C1)O Z2310701794 [1,1,0,0,0,0|1,0,0]=3 654 B9R1.2 NCC1=NC(=CC=C1)N Z2310698959 [1,1,0,0,0,0|1,0,0]=3 655 B9R1.2 NCC1=NC(=CC=N1)Cl Z3244401673 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.2 NCC1=NC(=CC=N1)N Z1431904697 [1,1,0,0,0,0|2,0,0]=4 657 B9R1.2 NCC1=NC(=CN=C1)Cl Z3235038825 [1,1,0,0,0,0|2,0,0]=4 658 B9R1.2 NCC1=NC(=NC=C1)Cl Z2768204537 [1,1,0,0,0,0|2,0,0]=4 659 B9R1.2 NCC1=NC(=NC=C1)N Z235362841 [1,1,0,0,0,0|2,0,0]=4 660 B9R1.2 NCC1=NC=CC(=C1)Cl Z1198173013 [1,1,0,0,0,0|1,0,0]=3 661 B9R1.2 NCC1=NC=CC(=C1)N Z2310678270 [1,1,0,0,0,0|1,0,0]=3 662 B9R1.2 NCC1=NC=NC(=C1)O Z2511806596 [1,1,0,0,0,0|2,0,0]=4 663 B9R1.2 NNC1=CC(=CC=C1)Br Z118530090 [1,1,0,0,0,0|1,0,0]=3 664 B9R1.2 NNC1=CC(=CC=C1)Cl Z56940998 [1,1,0,0,0,0|1,0,0]=3 665 B9R1.2 O=C1C=C(C=CN1)CO Z1203733303 [1,1,0,0,0,0|2,0,0]=4 666 B9R1.2 O=CC1=CC=CC(=C1)Br Z104472918 [1,1,0,0,0,0|1,0,1]=4 667 B9R1.2 O=CC1=CC=CC(=C1)Cl Z104476504 [1,1,0,0,0,0|1,0,1]=4 668 B9R1.2 O=CC1=CC=CC(=C1)F Z104476574 [1,1,0,0,0,0|1,0,1]=4 669 B9R1.2 O=CC1=CC=CC(=C1)I Z57887683 [1,1,0,0,0,0|1,0,1]=4 670 B9R1.2 O=CC1=CC=CC(=C1)O Z57772446 [1,1,0,0,0,0|1,0,1]=4 671 B9R1.2 O=CC1=CC=CC(=C1)S Z969587160 [1,1,0,0,0,0|1,0,1]=4 672 B9R1.2 OC1=CC(=CC=C1)CCl Z1198169502 [1,1,0,0,0,0|1,0,0]=3 673 B9R1.2 OCC1=CC(=CC=C1)Br Z335244752 [1,1,0,0,0,0|1,0,0]=3 674 B9R1.2 OCC1=CC(=CC=C1)Cl Z212055560 [1,1,0,0,0,0|1,0,0]=3 675 B9R1.2 OCC1=CC(=CC=C1)F Z104477458 [1,1,0,0,0,0|1,0,0]=3 676 B9R1.2 OCC1=CC(=CC=C1)O Z335245000 [1,1,0,0,0,0|1,0,0]=3 677 B9R1.2 OCC1=CC(=CN=C1)Br Z381037198 [1,1,0,0,0,0|2,0,0]=4 678 B9R1.2 OCC1=CC(=NC=C1)Cl Z979439344 [1,1,0,0,0,0|2,0,0]=4 679 B9R1.2 OCC1=NC(=CC=C1)O Z1198343459 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.2 OCC1=NC=CC(=C1)Cl Z979714554 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [1,1,0,0,0,0|0,0,1]=3 682 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [1,1,0,0,0,0|1,0,1]=4 683 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [1,1,0,0,0,0|1,0,1]=4 684 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [1,1,0,0,0,0|1,0,0]=3 685 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [1,1,0,0,0,0|0,0,0]=2 686 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [1,1,0,0,0,0|1,0,0]=3 687 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [1,1,0,0,0,0|1,0,0]=3 688 B9R1.6 CC(N)C1=NC=CC=N1 Z2945456281 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [1,1,0,0,0,0|0,0,0]=2 690 B9R1.6 CC(O)C1=CC=NC=C1 Z335245082 [1,1,0,0,0,0|1,0,0]=3 691 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [1,1,0,0,0,0|1,0,0]=3 692 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [1,1,0,0,0,0|1,0,0]=3 693 B9R1.6 CC(O)C1=NC=CN=C1 Z513751834 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.6 CN(C)C1=CC=NC=C1 Z104478964 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.6 CN(C)C1=CN=CC=C1 Z1201619922 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [1,1,0,0,0,0|1,0,0]=3 697 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [1,1,0,0,0,0|0,0,0]=2 698 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Z1197994836 [1,1,0,0,0,0|1,0,0]=3 699 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [1,1,0,0,0,0|0,0,0]=2 700 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [1,1,0,0,0,0|0,0,0]=2 701 B9R1.6 C[C@H](N)C1=CC=NC=C1 Z1492781304 [1,1,0,0,0,0|1,0,0]=3 702 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [1,1,0,0,0,0|0,0,0]=2 703 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [1,1,0,0,0,0|0,0,1]=3 704 B9R1.6 N=C(N)C1=CC=NC=C1 Z444349574 [1,1,0,0,0,0|1,0,1]=4 705 B9R1.6 N=C(N)C1=CN=CC=C1 Z444349586 [1,1,0,0,0,0|1,0,1]=4 706 B9R1.6 N=C(N)C1=NC=CC=C1 Z540728738 [1,1,0,0,0,0|1,0,1]=4 707 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [1,1,0,0,0,0|1,0,1]=4 708 B9R1.6 NC(=O)C1=NC=CC=C1 Z33546380 [1,1,0,0,0,0|1,0,1]=4 709 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [1,1,0,0,0,0|0,0,1]=3 710 B9R1.6 NC(=S)C1=CC=NC=C1 Z317055504 [1,1,0,0,0,0|1,0,1]=4 711 B9R1.6 NC(=S)C1=CN=CC=C1 Z56960184 [1,1,0,0,0,0|1,0,1]=4 712 B9R1.6 NC(=S)C1=NC=CC=C1 Z56956073 [1,1,0,0,0,0|1,0,1]=4 713 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [1,1,0,0,0,0|1,0,1]=4 714 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.15 BrCC1=C(C=CC=C1)Br Z56969700 [1,1,0,0,0,0|1,0,0]=3 717 B9R1.15 C#CC1=C(C=CC=C1)Cl Z1080385584 [1,1,0,0,0,0|0,0,2]=4 718 B9R1.15 C#CC1=C(C=CC=C1)F Z1080385538 [1,1,0,0,0,0|0,0,2]=4 719 B9R1.15 C=CC1=C(C=CC=C1)Cl Z957339910 [1,1,0,0,0,0|0,0,2]=4 720 B9R1.15 CC1=C(C=CC=C1)C=O Z104478122 [1,1,0,0,0,0|1,0,1]=4 721 B9R1.15 CC1=C(C=CC=C1)CO Z335244790 [1,1,0,0,0,0|1,0,0]=3 722 B9R1.15 CC1=C(C=CC=C1)NN Z56933829 [1,1,0,0,0,0|1,0,0]=3 723 B9R1.15 CC1=C(C=CN=C1)CO Z1198163942 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.15 CC1=C(C=NC=C1)CO Z1198156922 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.15 CC1=C(N=CC=C1)CO Z976637084 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.15 CC1=C(N=CC=N1)CN Z3671696702 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.15 CCC1=C(C=CC=C1)Br Z1255457372 [1,1,0,0,0,0|0,0,0]=2 728 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [1,1,0,0,0,0|0,0,0]=2 729 B9R1.15 CCC1=C(C=NC=C1)N Z1203586904 [1,1,0,0,0,0|1,0,0]=3 730 B9R1.15 CCC1=C(C=NC=N1)O Z1618133826 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.15 CCC1=C(N=CC=C1)N Z1192017773 [1,1,0,0,0,0|1,0,0]=3 732 B9R1.15 CCC1=C(N=CC=C1)O Z1198266674 [1,1,0,0,0,0|1,0,0]=3 733 B9R1.15 CCC1=C(N=CC=N1)Cl Z1198149374 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.15 CCC1=C(N=CC=N1)N Z1203580180 [1,1,0,0,0,0|2,0,0]=4 735 B9R1.15 CCC1=CNC=CC1=N Z1525649973 [1,1,0,0,0,0|1,0,0]=3 736 B9R1.15 CCC1=NC=CNC1=O Z3274889193 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.15 CC[N+]1=C(C=CC=C1)N Z56791107 [1,1,0,0,0,0|1,0,0]=3 738 B9R1.15 CNC1=C(C=CC=C1)Br Z2588063702 [1,1,0,0,0,0|1,0,0]=3 739 B9R1.15 CNC1=C(C=CC=C1)F Z335276746 [1,1,0,0,0,0|1,0,0]=3 740 B9R1.15 CNC1=C(C=CC=C1)N Z57472969 [1,1,0,0,0,0|1,0,0]=3 741 B9R1.15 CNC1=C(C=CC=N1)Br Z808603280 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.15 CNC1=C(C=CC=N1)C Z968907582 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.15 CNC1=C(C=CC=N1)F Z997723632 [1,1,0,0,0,0|2,0,0]=4 744 B9R1.15 CNC1=C(C=CC=N1)N Z803145504 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.15 CNC1=C(C=CN=C1)C Z1124504699 [1,1,0,0,0,0|2,0,0]=4 746 B9R1.15 CNC1=C(C=NC=C1)Br Z1198175026 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.15 CNC1=C(C=NC=C1)C Z1147200119 [1,1,0,0,0,0|2,0,0]=4 748 B9R1.15 CNC1=C(C=NC=C1)F Z1946124201 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.15 CNC1=C(C=NC=C1)N Z57396117 [1,1,0,0,0,0|2,0,0]=4 750 B9R1.15 CNC1=C(N=CC=C1)C Z1295808975 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.15 CNC1=C(N=CC=C1)N Z1203578357 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.15 CNC1=CNC=CC1=N Z2130740350 [1,1,0,0,0,0|2,0,0]=4 753 B9R1.15 COC1=C(C=CC=C1)F Z54600290 [1,1,0,0,0,0|1,0,0]=3 754 B9R1.15 COC1=C(C=CC=C1)O Z104474028 [1,1,0,0,0,0|1,0,0]=3 755 B9R1.15 COC1=C(C=CC=N1)N Z240084308 [1,1,0,0,0,0|2,0,0]=4 756 B9R1.15 COC1=C(C=CC=N1)O Z1255423921 [1,1,0,0,0,0|2,0,0]=4 757 B9R1.15 COC1=C(C=NC=C1)Br Z1198165840 [1,1,0,0,0,0|2,0,0]=4 758 B9R1.15 COC1=C(C=NC=C1)N Z359373528 [1,1,0,0,0,0|2,0,0]=4 759 B9R1.15 COC1=C(N=CC=C1)C Z1198150814 [1,1,0,0,0,0|2,0,0]=4 760 B9R1.15 COC1=C(N=CC=C1)N Z362783902 [1,1,0,0,0,0|2,0,0]=4 761 B9R1.15 COC1=CC=CNC1=O Z2678251321 [1,1,0,0,0,0|2,0,0]=4 762 B9R1.15 CSC1=C(C=CC=C1)C Z785054008 [1,1,0,0,0,0|1,0,0]=3 763 B9R1.15 CSC1=C(C=CC=C1)N Z104478220 [1,1,0,0,0,0|1,0,0]=3 764 B9R1.15 CSC1=C(C=CC=N1)Br Z808605456 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.15 CSC1=C(C=NC=C1)N Z412017790 [1,1,0,0,0,0|2,0,0]=4 766 B9R1.15 CSC1=C(N=CC=C1)N Z1203640622 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.15 N#CC1=C(C=CC=C1)Br Z57899728 [1,1,0,0,0,0|0,0,2]=4 768 B9R1.15 N#CC1=C(C=CC=C1)Cl Z57756581 [1,1,0,0,0,0|0,0,2]=4 769 B9R1.15 N#CC1=C(C=CC=C1)I Z57899723 [1,1,0,0,0,0|0,0,2]=4 770 B9R1.15 N#CC1=C(C=CC=C1)N Z104478174 [1,1,0,0,0,0|0,0,2]=4 771 B9R1.15 N#CC1=C(C=CC=C1)O Z104477750 [1,1,0,0,0,0|0,0,2]=4 772 B9R1.15 NC1=C(C=CC=C1)C=O Z3034936011 [1,1,0,0,0,0|1,0,1]=4 773 B9R1.15 NC1=C(C=CC=C1)CO Z104495736 [1,1,0,0,0,0|1,0,0]=3 774 B9R1.15 NC1=C(C=CN=C1)CO Z1201623606 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.15 NCC1=C(C=CC=C1)Cl Z55002587 [1,1,0,0,0,0|0,0,0]=2 776 B9R1.15 NCC1=C(C=CC=C1)I Z2574934431 [1,1,0,0,0,0|0,0,0]=2 777 B9R1.15 NCC1=C(C=CC=C1)O Z993991142 [1,1,0,0,0,0|0,0,0]=2 778 B9R1.15 NCC1=C(C=CC=N1)F Z1575304378 [1,1,0,0,0,0|1,0,0]=3 779 B9R1.15 NCC1=C(C=CC=N1)N Z1198181626 [1,1,0,0,0,0|1,0,0]=3 780 B9R1.15 NCC1=C(C=CC=N1)O Z1198156472 [1,1,0,0,0,0|1,0,0]=3 781 B9R1.15 NCC1=C(C=CN=C1)Cl Z3386909551 [1,1,0,0,0,0|1,0,0]=3 782 B9R1.15 NCC1=C(C=CN=C1)N Z1742055036 [1,1,0,0,0,0|1,0,0]=3 783 B9R1.15 NCC1=C(C=NC=C1)Br Z2731710898 [1,1,0,0,0,0|1,0,0]=3 784 B9R1.15 NCC1=C(N=CC=N1)Cl Z2472857434 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.15 NCC1=C(N=CN=C1)N Z1456202381 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.15 NNC1=C(C=CC=C1)Br Z216309278 [1,1,0,0,0,0|1,0,0]=3 787 B9R1.15 NNC1=C(C=CC=C1)Cl Z56928643 [1,1,0,0,0,0|1,0,0]=3 788 B9R1.15 NNC1=C(C=CC=C1)F Z220383458 [1,1,0,0,0,0|1,0,0]=3 789 B9R1.15 NNC1=C(C=CC=N1)N Z1203148325 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.15 O=CC1=C(C=CC=C1)Br Z104478338 [1,1,0,0,0,0|1,0,1]=4 791 B9R1.15 O=CC1=C(C=CC=C1)Cl Z104472866 [1,1,0,0,0,0|1,0,1]=4 792 B9R1.15 O=CC1=C(C=CC=C1)F Z104476570 [1,1,0,0,0,0|1,0,1]=4 793 B9R1.15 O=CC1=C(C=CC=C1)I Z56899024 [1,1,0,0,0,0|1,0,1]=4 794 B9R1.15 O=CC1=C(C=CC=C1)O Z57127523 [1,1,0,0,0,0|1,0,1]=4 795 B9R1.15 OCC1=C(C=CC=C1)Br Z335245004 [1,1,0,0,0,0|1,0,0]=3 796 B9R1.15 OCC1=C(C=CC=C1)Cl Z104476786 [1,1,0,0,0,0|1,0,0]=3 797 B9R1.15 OCC1=C(C=CC=C1)F Z104495204 [1,1,0,0,0,0|1,0,0]=3 798 B9R1.15 OCC1=C(C=CC=C1)I Z57472670 [1,1,0,0,0,0|1,0,0]=3 799 B9R1.15 OCC1=C(C=CC=C1)O Z335244902 [1,1,0,0,0,0|1,0,0]=3 800 B9R1.15 OCC1=C(C=CN=C1)Cl Z1741982140 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.15 OCC1=C(C=NC=C1)Cl Z1198261848 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.15 OCC1=C(C=NC=C1)F Z1251273325 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.15 OCC1=C(N=CC=C1)Cl Z979431808 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.15 SCC1=C(C=CC=C1)Cl Z55948221 [1,1,0,0,0,0|1,0,0]=3 805 B9R1.7 CC1=CC=C(S1)CCN Z3038322398 [0,1,0,0,1,0|1,0,0]=3 806 B9R1.7 CC1=CN(N=C1)CCN Z600430704 [0,1,0,0,1,0|2,0,0]=4 807 B9R1.7 CC1=CN=C(S1)CCN Z994267436 [0,1,0,0,1,0|2,0,0]=4 808 B9R1.7 CC1=NC(=CS1)CCN Z1744689874 [0,1,0,0,1,0|2,0,0]=4 809 B9R1.7 CC1=NC=C(O1)CCN Z3251575034 [0,1,0,0,1,0|2,0,0]=4 810 B9R1.7 CC1=NC=C(S1)CCN Z1079164344 [0,1,0,0,1,0|2,0,0]=4 811 B9R1.7 CC1=NN(C=C1)CCN Z3248014730 [0,1,0,0,1,0|2,0,0]=4 812 B9R1.7 CC1=NOC(=C1)CCN Z2092369291 [0,1,0,0,1,0|2,0,0]=4 813 B9R1.7 CN1C=C(C=N1)CCN Z335291636 [0,1,0,0,1,0|2,0,0]=4 814 B9R1.7 CN1C=NC(=C1)CCN Z5632546328 [0,1,0,0,1,0|2,0,0]=4 815 B9R1.7 NCCC1=CC(=O)NN1 Z1483956795 [0,1,0,0,1,0|2,0,0]=4 816 B9R1.7 NCCC1=CC=C(O1)Br Z1442016604 [0,1,0,0,1,0|1,0,0]=3 817 B9R1.7 NCCC1=CC=C(S1)Cl Z432066930 [0,1,0,0,1,0|1,0,0]=3 818 B9R1.7 NCCC1=CC=C(S1)I Z1262398458 [0,1,0,0,1,0|1,0,0]=3 819 B9R1.7 NCCC1=CSC(=C1)Br Z4125344523 [0,1,0,0,1,0|1,0,0]=3 820 B9R1.7 NCCC1=CSC(=N1)N Z1901070719 [0,1,0,0,1,0|2,0,0]=4 821 B9R1.7 NCCN1C=C(C=N1)I Z3183972621 [0,1,0,0,1,0|2,0,0]=4 822 B9R1.11 CC(CN)C1=CC=CS1 Z803101386 [0,1,0,0,1,0|1,0,0]=3 823 B9R1.11 CC(CN)C1=CN=CN1 Z2865711302 [0,1,0,0,1,0|2,0,0]=4 824 B9R1.11 CC(CN)C1=NC=CN1 Z3205686355 [0,1,0,0,1,0|2,0,0]=4 825 B9R1.11 CC(CN)C1=NC=CS1 Z994266314 [0,1,0,0,1,0|2,0,0]=4 826 B9R1.11 CCC(N)C1=CC=CS1 Z744593088 [0,1,0,0,1,0|2,0,0]=4 827 B9R1.11 NC(CO)C1=CC=CO1 Z1255405023 [0,1,0,0,1,0|2,0,0]=4 828 B9R1.11 NCC(=O)C1=CC=CO1 Z1193968923 [0,1,0,0,1,0|1,0,1]=4 829 B9R1.11 NCC(O)C1=CN=CS1 Z2310732372 [0,1,0,0,1,0|2,0,0]=4 830 B9R1.11 NCC(O)C1=CNC=N1 Z2310707384 [0,1,0,0,1,0|2,0,0]=4 831 B9R1.11 NCC(O)C1=COC=C1 Z1198261509 [0,1,0,0,1,0|1,0,0]=3 832 B9R1.11 NCC(O)C1=CSC=C1 Z330910460 [0,1,0,0,1,0|1,0,0]=3 833 B9R1.12 CCNCC1=CC=CO1 Z90513169 [0,1,0,0,1,0|2,0,0]=4 834 B9R1.12 CCNCC1=COC=C1 Z385447452 [0,1,0,0,1,0|2,0,0]=4 835 B9R1.12 CNCCC1=CC=CS1 Z162416950 [0,1,0,0,1,0|1,0,0]=3 836 B9R1.12 CNCCC1=NNC=C1 Z2686452658 [0,1,0,0,1,0|2,0,0]=4 837 B9R1.12 N#CCCC1=CC=CO1 Z1079179114 [0,1,0,0,1,0|1,0,1]=4 838 B9R1.12 NCCCC1=CC=NN1 Z2895332060 [0,1,0,0,1,0|2,0,0]=4 839 B9R1.12 NCCCC1=CNC=N1 Z2574933947 [0,1,0,0,1,0|2,0,0]=4 840 B9R1.12 NCCCC1=CNN=C1 Z2106603664 [0,1,0,0,1,0|2,0,0]=4 841 B9R1.12 NCCCC1=CON=C1 Z3022047352 [0,1,0,0,1,0|2,0,0]=4 842 B9R1.12 NCCCC1=NC=CN1 Z3244743443 [0,1,0,0,1,0|2,0,0]=4 843 B9R1.12 NCCCC1=NC=CO1 Z4966451613 [0,1,0,0,1,0|2,0,0]=4 844 B9R1.12 NCCCC1=NC=CS1 Z1263529635 [0,1,0,0,1,0|2,0,0]=4 845 B9R1.12 NCCCN1C=CC=C1 Z600497510 [0,1,0,0,1,0|1,0,0]=3 846 B9R1.12 NCCCN1C=CC=N1 Z271005716 [0,1,0,0,1,0|2,0,0]=4 847 B9R1.12 O=CCCC1=CSC=C1 Z993017658 [0,1,0,0,1,0|2,0,0]=4 848 B9R1.12 OCCCC1=COC=C1 Z1198265634 [0,1,0,0,1,0|2,0,0]=4 849 B9R1.12 OCCCC1=CSC=C1 Z993012564 [0,1,0,0,1,0|2,0,0]=4 850 B9R1.13 CC(N)CC1=CC=CO1 Z285143986 [0,1,0,0,1,0|1,0,0]=3 851 B9R1.13 CC(N)CC1=CC=CS1 Z1160899518 [0,1,0,0,1,0|1,0,0]=3 852 B9R1.13 CC(N)CC1=CNN=C1 Z5233405251 [0,1,0,0,1,0|2,0,0]=4 853 B9R1.13 CC(N)CC1=COC=C1 Z1098234443 [0,1,0,0,1,0|1,0,0]=3 854 B9R1.13 CC(N)CN1C=CC=N1 Z271011614 [0,1,0,0,1,0|2,0,0]=4 855 B9R1.13 CC(N)CN1C=CN=C1 Z271011862 [0,1,0,0,1,0|2,0,0]=4 856 B9R1.13 N=C(N)CC1=CC=CS1 Z1526503402 [0,1,0,0,1,0|1,0,1]=4 857 B9R1.13 NC(=O)CC1=CC=CN1 Z1203579730 [0,1,0,0,1,0|1,0,1]=4 858 B9R1.33 CC1=C(C=NO1)CCN Z2310699406 [0,1,0,0,1,0|2,0,0]=4 859 B9R1.33 CC1=C(N=CN1)CCN Z1682072469 [0,1,0,0,1,0|2,0,0]=4 860 B9R1.33 CC1=C(N=CO1)CCN Z4133751936 [0,1,0,0,1,0|2,0,0]=4 861 B9R1.33 CC1=C(SC=N1)CCN Z945840330 [0,1,0,0,1,0|2,0,0]=4 862 B9R1.33 CC1=NC=CN1CCN Z271005730 [0,1,0,0,1,0|2,0,0]=4 863 B9R1.33 CC1=NNC=C1CCN Z4991178728 [0,1,0,0,1,0|2,0,0]=4 864 B9R1.33 CN1C=CN=C1CCN Z2805865782 [0,1,0,0,1,0|2,0,0]=4 865 B9R1.33 CN1C=NC=C1CCN Z1198148027 [0,1,0,0,1,0|2,0,0]=4 866 B9R1.33 CN1N=CC=C1CCN Z1183446166 [0,1,0,0,1,0|2,0,0]=4 867 B9R1.33 NCCC1=C(SC=C1)Cl Z4606142914 [0,1,0,0,1,0|1,0,0]=3 868 B9R1.33 NCCC1=CNN=C1O Z4623367325 [0,1,0,0,1,0|2,0,0]=4 869 B9R1.33 NCCN1C=CSC1=O Z1123714633 [0,1,0,0,1,0|2,0,0]=4 870 B11R1.1 BrCCOC1=CC=C(C=C1)Br Z56887702 [0,2,0,0,0,0|1,0,0]=3 871 B11R1.1 C#CCNC1=CC=C(C=C1)C Z266486858 [0,2,0,0,0,0|1,0,1]=4 872 B11R1.1 C#CCNC1=CC=C(C=C1)Cl Z3210379676 [0,2,0,0,0,0|1,0,1]=4 873 B11R1.1 C#CCNC1=CC=C(C=C1)F Z3210380008 [0,2,0,0,0,0|1,0,1]=4 874 B11R1.1 C#CCOC1=CC=C(C=C1)Br Z54475590 [0,2,0,0,0,0|1,0,1]=4 875 B11R1.1 C#CCOC1=CC=C(C=C1)C Z54775509 [0,2,0,0,0,0|1,0,1]=4 876 B11R1.1 C#CCOC1=CC=C(C=C1)Cl Z54472184 [0,2,0,0,0,0|1,0,1]=4 877 B11R1.1 C#CCOC1=CC=C(C=C1)F Z54473259 [0,2,0,0,0,0|1,0,1]=4 878 B11R1.1 C#CCOC1=CC=C(C=C1)N Z730512948 [0,2,0,0,0,0|1,0,1]=4 879 B11R1.1 C=CCOC1=CC=C(C=C1)O Z381414818 [0,2,0,0,0,0|1,0,1]=4 880 B11R1.1 CC1=CC=C(C=C1)CCCN Z4639316723 [0,2,0,0,0,0|0,0,0]=2 881 B11R1.1 CC1=CC=C(C=C1)NCC#N Z56855172 [0,2,0,0,0,0|0,0,2]=4 882 B11R1.1 CC1=CC=C(C=C1)OCCBr Z56886357 [0,2,0,0,0,0|1,0,0]=3 883 B11R1.1 CC1=CC=C(C=C1)OCCN Z54747869 [0,2,0,0,0,0|0,0,0]=2 884 B11R1.1 CC1=CC=C(C=C1)SCC#N Z54591058 [0,2,0,0,0,0|0,0,2]=4 885 B11R1.1 CC1=CC=C(C=C1)SCCCl Z90122598 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.1 CC1=CC=C(C=C1)SCCO Z149178580 [0,2,0,0,0,0|1,0,0]=3 887 B11R1.1 CC1=CN=C(C=C1)NCCN Z1695797833 [0,2,0,0,0,0|1,0,0]=3 888 B11R1.1 CC1=NC=C(C=C1)CCC=O Z1233208116 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.1 CC1=NN=C(C=C1)NCCN Z1263529623 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.1 CCCCC1=CC=C(C=C1)N Z104475500 [0,2,0,0,0,0|1,0,0]=3 891 B11R1.1 CCCNC1=CC=C(C=C1)Cl Z1266933829 [0,2,0,0,0,0|1,0,0]=3 892 B11R1.1 CCCOC1=CC=C(C=C1)N Z239604724 [0,2,0,0,0,0|1,0,0]=3 893 B11R1.1 CCNCC1=CC=C(C=C1)F Z3244655509 [0,2,0,0,0,0|1,0,0]=3 894 B11R1.1 CCOCC1=CC=C(C=C1)Br Z823854370 [0,2,0,0,0,0|1,0,0]=3 895 B11R1.1 CCOCC1=CC=C(C=C1)N Z240084570 [0,2,0,0,0,0|1,0,0]=3 896 B11R1.1 CCSCC1=CC=C(C=C1)N Z332378208 [0,2,0,0,0,0|1,0,0]=3 897 B11R1.1 CNCCC1=CC=C(C=C1)Br Z385447024 [0,2,0,0,0,0|0,0,0]=2 898 B11R1.1 CNCCC1=CC=C(C=C1)C Z5115849578 [0,2,0,0,0,0|0,0,0]=2 899 B11R1.1 CNCCC1=CC=C(C=C1)Cl Z1623872266 [0,2,0,0,0,0|0,0,0]=2 900 B11R1.1 CNCCC1=CC=C(C=C1)F Z138454998 [0,2,0,0,0,0|0,0,0]=2 901 B11R1.1 CNCCC1=NC=C(C=N1)Br Z3023504208 [0,2,0,0,0,0|2,0,0]=4 902 B11R1.1 COCCC1=CC=C(C=C1)Br Z299596190 [0,2,0,0,0,0|1,0,0]=3 903 B11R1.1 COCCC1=CC=C(C=C1)Cl Z1470894103 [0,2,0,0,0,0|1,0,0]=3 904 B11R1.1 COCCC1=CC=C(C=C1)O Z104485614 [0,2,0,0,0,0|1,0,0]=3 905 B11R1.1 COCOC1=CC=C(C=C1)N Z1259226853 [0,2,0,0,0,0|2,0,0]=4 906 B11R1.1 CSCCC1=CC=C(C=C1)N Z732207426 [0,2,0,0,0,0|1,0,0]=3 907 B11R1.1 ClC1=CC=C(C=C1)OCCBr Z56926557 [0,2,0,0,0,0|1,0,0]=3 908 B11R1.1 ClCCSC1=CC=C(C=C1)Cl Z55993025 [0,2,0,0,0,0|1,0,0]=3 909 B11R1.1 FC1=CC=C(C=C1)CN=C=S Z57358375 [0,2,0,0,0,0|1,0,1]=4 910 B11R1.1 FCCOC1=CC=C(C=C1)Br Z1269166672 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.1 N#CCCC1=CC=C(C=C1)N Z4750298565 [0,2,0,0,0,0|0,0,1]=3 912 B11R1.1 N#CCNC1=CC=C(C=C1)Br Z266466556 [0,2,0,0,0,0|0,0,2]=4 913 B11R1.1 N#CCOC1=CC=C(C=C1)Cl Z54608574 [0,2,0,0,0,0|0,0,2]=4 914 B11R1.1 N#CCOC1=CC=C(C=C1)F Z53791434 [0,2,0,0,0,0|0,0,2]=4 915 B11R1.1 N#CCOC1=CC=C(C=C1)N Z57052858 [0,2,0,0,0,0|0,0,2]=4 916 B11R1.1 N#CCSC1=CC=C(C=C1)Br Z18744575 [0,2,0,0,0,0|0,0,2]=4 917 B11R1.1 N#CCSC1=CC=C(C=C1)Cl Z19728982 [0,2,0,0,0,0|0,0,2]=4 918 B11R1.1 N#CCSC1=CC=C(C=C1)F Z16034822 [0,2,0,0,0,0|0,0,2]=4 919 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br Z2235681463 [0,2,0,0,0,0|0,0,1]=3 920 B11R1.1 NC1=CC=C(C=C1)OCCF Z1262631146 [0,2,0,0,0,0|1,0,0]=3 921 B11R1.1 NC1=CC=C(C=C1)OCCO Z332379386 [0,2,0,0,0,0|1,0,0]=3 922 B11R1.1 NCC#CC1=CC=C(C=C1)I Z4775597113 [0,2,0,0,0,0|0,0,1]=3 923 B11R1.1 NCCCC1=CC=C(C=C1)Br Z3980240042 [0,2,0,0,0,0|0,0,0]=2 924 B11R1.1 NCCCC1=CC=C(C=C1)Cl Z992716848 [0,2,0,0,0,0|0,0,0]=2 925 B11R1.1 NCCCC1=CC=C(C=C1)F Z3244753845 [0,2,0,0,0,0|0,0,0]=2 926 B11R1.1 NCCCC1=CC=C(C=C1)N Z5453008768 [0,2,0,0,0,0|0,0,0]=2 927 B11R1.1 NCCCC1=CC=C(C=C1)O Z1270210797 [0,2,0,0,0,0|0,0,0]=2 928 B11R1.1 NCCNC1=CC=C(C=C1)O Z3386315806 [0,2,0,0,0,0|0,0,0]=2 929 B11R1.1 NCCOC1=CC=C(C=C1)Br Z1262237188 [0,2,0,0,0,0|0,0,0]=2 930 B11R1.1 NCCOC1=CC=C(C=C1)Cl Z85957193 [0,2,0,0,0,0|0,0,0]=2 931 B11R1.1 NCCOC1=CC=C(C=C1)F Z87000937 [0,2,0,0,0,0|0,0,0]=2 932 B11R1.1 NCCOC1=CC=C(C=C1)I Z381428104 [0,2,0,0,0,0|0,0,0]=2 933 B11R1.1 NCCOC1=NC=C(C=C1)Cl Z1421528823 [0,2,0,0,0,0|1,0,0]=3 934 B11R1.1 NCCSC1=CC=C(C=C1)Br Z262221984 [0,2,0,0,0,0|0,0,0]=2 935 B11R1.1 NCCSC1=CC=C(C=C1)Cl Z54751093 [0,2,0,0,0,0|0,0,0]=2 936 B11R1.1 NCCSC1=CC=C(C=C1)F Z1267773811 [0,2,0,0,0,0|0,0,0]=2 937 B11R1.1 O=CCCC1=CC=C(C=C1)Br Z993017756 [0,2,0,0,0,0|1,0,0]=3 938 B11R1.1 O=CCCC1=CC=C(C=C1)Cl Z993017742 [0,2,0,0,0,0|1,0,0]=3 939 B11R1.1 O=CCCC1=CC=C(C=C1)F Z993017748 [0,2,0,0,0,0|1,0,0]=3 940 B11R1.1 O=CCOC1=CC=C(C=C1)F Z854102568 [0,2,0,0,0,0|1,0,1]=4 941 B11R1.1 O=CCSC1=CC=C(C=C1)F Z854102782 [0,2,0,0,0,0|1,0,1]=4 942 B11R1.1 OC/C=C/C1=CC=C(C=C1)O Z2235811101 [0,2,0,0,0,0|1,0,1]=4 943 B11R1.1 OCC#CC1=CC=C(C=C1)Cl Z540350074 [0,2,0,0,0,0|1,0,1]=4 944 B11R1.1 OCCCC1=CC=C(C=C1)F Z992949550 [0,2,0,0,0,0|1,0,0]=3 945 B11R1.1 OCCNC1=CC=C(C=C1)Br Z335275406 [0,2,0,0,0,0|1,0,0]=3 946 B11R1.1 OCCNC1=NC=C(C=C1)I Z1269164771 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.1 OCCOC1=CC=C(C=C1)Br Z335092354 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.1 OCCOC1=CC=C(C=C1)O Z381414946 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.1 OCCOC1=NC=C(C=C1)Br Z808609020 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.1 OCCSC1=CC=C(C=C1)Br Z149190682 [0,2,0,0,0,0|1,0,0]=3 951 B11R1.1 OCCSC1=CC=C(C=C1)Cl Z149162370 [0,2,0,0,0,0|1,0,0]=3 952 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,2,0,0,0,0|1,0,1]=4 953 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [0,2,0,0,0,0|1,0,0]=3 954 B11R1.20 CC(C)CC1=NC=C(C=C1)Br Z1269179231 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl Z993967140 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.20 CC(C)NC1=CC=C(C=C1)F Z266481896 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.20 CC(C)OC1=CC=C(C=C1)Br Z53834735 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.20 CC(C)OC1=CC=C(C=C1)I Z54181200 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,2,0,0,0,0|0,0,0]=2 960 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [0,2,0,0,0,0|0,0,1]=3 961 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [0,2,0,0,0,0|1,0,1]=4 962 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [0,2,0,0,0,0|1,0,1]=4 963 B11R1.20 CC1=CC=C(C=C1)NC(=S)N Z57965505 [0,2,0,0,0,0|1,0,1]=4 964 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.20 CC1=CC=C(C=C1)OC(C)C Z53834229 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.20 FC(F)SC1=CC=C(C=C1)Cl Z55625938 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.20 FC1=CC=C(C=C1)OC(F)F Z55671914 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [0,2,0,0,0,0|0,0,1]=3 970 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [0,2,0,0,0,0|0,0,1]=3 971 B11R1.20 N=C(N)NC1=CC=C(C=C1)Br Z5099116935 [0,2,0,0,0,0|1,0,1]=4 972 B11R1.20 N=C(N)NC1=CC=C(C=C1)Cl Z2931635778 [0,2,0,0,0,0|1,0,1]=4 973 B11R1.20 N=C(N)NC1=CC=C(C=C1)N Z2471157136 [0,2,0,0,0,0|1,0,1]=4 974 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,2,0,0,0,0|0,0,1]=3 975 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,2,0,0,0,0|0,0,1]=3 976 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,2,0,0,0,0|0,0,1]=3 977 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,2,0,0,0,0|0,0,1]=3 978 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [0,2,0,0,0,0|1,0,1]=4 979 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [0,2,0,0,0,0|1,0,1]=4 980 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [0,2,0,0,0,0|1,0,1]=4 981 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [0,2,0,0,0,0|1,0,1]=4 982 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [0,2,0,0,0,0|1,0,1]=4 983 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [0,2,0,0,0,0|0,0,1]=3 984 B11R1.20 NC(=S)NC1=CC=C(C=C1)Cl Z56939186 [0,2,0,0,0,0|1,0,1]=4 985 B11R1.20 NC(=S)NC1=CC=C(C=C1)F Z57455239 [0,2,0,0,0,0|1,0,1]=4 986 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [0,2,0,0,0,0|1,0,1]=4 987 B11R1.20 NC1=CC=C(C=C1)OC(F)F Z56899041 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.20 NC1=CC=C(C=C1)SC(F)F Z335451374 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [0,2,0,0,0,0|1,0,1]=4 990 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [0,2,0,0,0,0|1,0,1]=4 991 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [0,2,0,0,0,0|1,0,1]=4 992 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [0,2,0,0,0,0|1,0,1]=4 993 B11R1.22 C#CC(N)C1=CC=C(C=C1)Br Z3378112680 [0,2,0,0,0,0|1,0,1]=4 994 B11R1.22 C=C(CO)C1=CC=C(C=C1)C Z1896562587 [0,2,0,0,0,0|1,0,1]=4 995 B11R1.22 CC(C#N)C1=CC=C(C=C1)Br Z1269233209 [0,2,0,0,0,0|0,0,2]=4 996 B11R1.22 CC(C#N)C1=CC=C(C=C1)Cl Z1198147665 [0,2,0,0,0,0|0,0,2]=4 997 B11R1.22 CC(C=O)C1=CC=C(C=C1)Br Z1269114153 [0,2,0,0,0,0|1,0,1]=4 998 B11R1.22 CC(C=O)C1=CC=C(C=C1)Cl Z1198334992 [0,2,0,0,0,0|1,0,1]=4 999 B11R1.22 CC(C=O)C1=CC=C(C=C1)F Z1255400140 [0,2,0,0,0,0|1,0,1]=4 1000 B11R1.22 CC(CN)C1=CC=C(C=C1)Br Z2906280360 [0,2,0,0,0,0|0,0,0]=2 1001 B11R1.22 CC(CN)C1=CC=C(C=C1)F Z415654954 [0,2,0,0,0,0|0,0,0]=2 1002 B11R1.22 CC(CO)C1=CC=C(C=C1)F Z1255440783 [0,2,0,0,0,0|1,0,0]=3 1003 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr Z104481640 [0,2,0,0,0,0|1,0,1]=4 1004 B11R1.22 CC1=CC=C(C=C1)C(=O)CCl Z56886309 [0,2,0,0,0,0|1,0,1]=4 1005 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [0,2,0,0,0,0|0,0,1]=3 1006 B11R1.22 CC1=CC=C(C=C1)C(=O)CO Z228585628 [0,2,0,0,0,0|1,0,1]=4 1007 B11R1.22 CC1=CC=C(C=C1)C(C)C#N Z415654732 [0,2,0,0,0,0|0,0,2]=4 1008 B11R1.22 CC1=CC=C(C=C1)C(C)C=O Z1198150045 [0,2,0,0,0,0|1,0,1]=4 1009 B11R1.22 CC1=CC=C(C=C1)C(C)CN Z415654970 [0,2,0,0,0,0|0,0,0]=2 1010 B11R1.22 CC1=CC=C(C=C1)C(N)CF Z2474474695 [0,2,0,0,0,0|1,0,0]=3 1011 B11R1.22 CC1=CC=C(C=C1)C(N)CO Z5087131901 [0,2,0,0,0,0|1,0,0]=3 1012 B11R1.22 CC1=CC=C(C=C1)C(O)CN Z336086536 [0,2,0,0,0,0|0,0,0]=2 1013 B11R1.22 CC1=CC=C(C=C1)[C@@H](O)CN Z1895741843 [0,2,0,0,0,0|0,0,0]=2 1014 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [0,2,0,0,0,0|1,0,1]=4 1015 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [0,2,0,0,0,0|1,0,1]=4 1016 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [0,2,0,0,0,0|1,0,1]=4 1017 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [0,2,0,0,0,0|1,0,1]=4 1018 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [0,2,0,0,0,0|1,0,1]=4 1019 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [0,2,0,0,0,0|1,0,1]=4 1020 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [0,2,0,0,0,0|1,0,0]=3 1021 B11R1.22 CCC(N)C1=CC=C(C=C1)Br Z90662172 [0,2,0,0,0,0|1,0,0]=3 1022 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [0,2,0,0,0,0|1,0,0]=3 1023 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl Z221421644 [0,2,0,0,0,0|1,0,0]=3 1024 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [0,2,0,0,0,0|1,0,0]=3 1025 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl Z228586168 [0,2,0,0,0,0|1,0,0]=3 1026 B11R1.22 CCC(O)C1=CC=C(C=C1)F Z228586174 [0,2,0,0,0,0|1,0,0]=3 1027 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [0,2,0,0,0,0|1,0,0]=3 1028 B11R1.22 CCC(O)C1=NC=C(C=C1)F Z1341678257 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.22 CCS(=O)C1=CC=C(C=C1)F Z1154828228 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)F Z1626921240 [0,2,0,0,0,0|1,0,0]=3 1031 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)F Z1625822291 [0,2,0,0,0,0|1,0,0]=3 1032 B11R1.22 CNC(C)C1=CC=C(C=C1)C Z239628686 [0,2,0,0,0,0|2,0,0]=4 1033 B11R1.22 CNC(C)C1=CC=C(C=C1)Cl Z159528172 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.22 CNC(C)C1=CC=C(C=C1)F Z166605480 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.22 CNC(C)C1=CC=C(C=C1)O Z316170374 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.22 N#CC(N)C1=CC=C(C=C1)Cl Z1262246247 [0,2,0,0,0,0|0,0,2]=4 1037 B11R1.22 N#CC(N)C1=CC=C(C=C1)F Z99599728 [0,2,0,0,0,0|0,0,2]=4 1038 B11R1.22 NC(CF)C1=CC=C(C=C1)Cl Z1510155807 [0,2,0,0,0,0|1,0,0]=3 1039 B11R1.22 NC(CO)C1=CC=C(C=C1)Br Z2188171600 [0,2,0,0,0,0|1,0,0]=3 1040 B11R1.22 NC(CO)C1=CC=C(C=C1)F Z1268152327 [0,2,0,0,0,0|1,0,0]=3 1041 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [0,2,0,0,0,0|0,0,1]=3 1042 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [0,2,0,0,0,0|0,0,1]=3 1043 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [0,2,0,0,0,0|0,0,1]=3 1044 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [0,2,0,0,0,0|0,0,1]=3 1045 B11R1.22 NCC(=O)C1=CN=C(C=C1)Cl Z2768165577 [0,2,0,0,0,0|1,0,1]=4 1046 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl Z295878600 [0,2,0,0,0,0|0,0,0]=2 1047 B11R1.22 NNC(=O)C1=CC=C(C=C1)Br Z56899079 [0,2,0,0,0,0|1,0,1]=4 1048 B11R1.22 NNC(=O)C1=CC=C(C=C1)F Z56862389 [0,2,0,0,0,0|1,0,1]=4 1049 B11R1.22 NNC(=O)C1=CC=C(C=C1)N Z57199627 [0,2,0,0,0,0|1,0,1]=4 1050 B11R1.22 NNC(=O)C1=CC=C(C=C1)O Z57036327 [0,2,0,0,0,0|1,0,1]=4 1051 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Br Z57708731 [0,2,0,0,0,0|1,0,1]=4 1052 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Cl Z104484576 [0,2,0,0,0,0|1,0,1]=4 1053 B11R1.22 O=C(CBr)C1=CC=C(C=C1)F Z104495742 [0,2,0,0,0,0|1,0,1]=4 1054 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Br Z56886257 [0,2,0,0,0,0|1,0,1]=4 1055 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Cl Z104477840 [0,2,0,0,0,0|1,0,1]=4 1056 B11R1.22 O=C(CCl)C1=CC=C(C=C1)F Z104478978 [0,2,0,0,0,0|1,0,1]=4 1057 B11R1.22 O=C(CCl)C1=CC=C(C=C1)I Z57046985 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O Z104378296 [0,2,0,0,0,0|1,0,1]=4 1059 B11R1.22 O=C(CO)C1=CC=C(C=C1)Cl Z906206720 [0,2,0,0,0,0|1,0,1]=4 1060 B11R1.81 CC1=C(C=CC(=C1)Br)CC#N Z1269226853 [0,2,0,0,0,0|0,0,2]=4 1061 B11R1.81 CC1=C(C=CC(=C1)Cl)CC#N Z1198263432 [0,2,0,0,0,0|0,0,2]=4 1062 B11R1.81 CC1=C(C=CC(=C1)F)CC#N Z1198164414 [0,2,0,0,0,0|0,0,2]=4 1063 B11R1.81 CC1=C(C=CC(=C1)F)CCN Z959351734 [0,2,0,0,0,0|0,0,0]=2 1064 B11R1.81 CC1=C(C=NC(=N1)S)CCN Z4919924970 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.81 CC1=CC(=C(C=C1)CC=O)C Z1020787114 [0,2,0,0,0,0|1,0,1]=4 1066 B11R1.81 CC1=CC(=C(C=C1)CCN)Br Z4658970056 [0,2,0,0,0,0|0,0,0]=2 1067 B11R1.81 CC1=CC(=C(C=C1)CCN)C Z285143724 [0,2,0,0,0,0|0,0,0]=2 1068 B11R1.81 CC1=CC(=C(C=C1)CCN)Cl Z5010254329 [0,2,0,0,0,0|0,0,0]=2 1069 B11R1.81 CC1=CC(=C(N=C1)CCO)C Z1504687585 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.81 CC1=CC(=O)N(C=N1)CCN Z3071314204 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.81 CCNC1=C(C=C(C=C1)C)C Z744754524 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.81 CCNC1=C(C=C(C=C1)C)N Z394649004 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.81 CCNC1=C(C=C(C=C1)Cl)Cl Z4201362307 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.81 CCNC1=C(C=C(C=C1)F)N Z359511462 [0,2,0,0,0,0|2,0,0]=4 1075 B11R1.81 CCOC1=C(C=C(C=C1)Br)N Z330803642 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.81 CCOC1=C(C=C(C=C1)Cl)N Z234894877 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.81 CCOC1=C(C=C(C=C1)F)Br Z55027547 [0,2,0,0,0,0|2,0,0]=4 1078 B11R1.81 CCOC1=C(C=C(C=C1)F)N Z332375936 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.81 CCOC1=C(C=C(C=C1)N)C Z385462628 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.81 CCOC1=C(C=C(C=C1)N)Cl Z239873338 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.81 CCOC1=C(C=C(C=C1)N)F Z362635048 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.81 CCSC1=C(C=C(C=C1)Cl)N Z319450478 [0,2,0,0,0,0|2,0,0]=4 1083 B11R1.81 CNCC1=C(C=C(C=C1)Br)Cl Z448247304 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.81 CNCC1=C(C=C(C=C1)C)Br Z5345778789 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.81 CNCC1=C(C=C(C=C1)C)C Z89283370 [0,2,0,0,0,0|2,0,0]=4 1086 B11R1.81 CNCC1=C(C=C(C=C1)C)Cl Z5465034350 [0,2,0,0,0,0|2,0,0]=4 1087 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Br Z5214955384 [0,2,0,0,0,0|2,0,0]=4 1088 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl Z56959746 [0,2,0,0,0,0|2,0,0]=4 1089 B11R1.81 CNCC1=C(C=C(C=C1)Cl)F Z385446922 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.81 CNCC1=C(C=C(C=C1)F)Br Z1836652109 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.81 CNCC1=C(C=C(C=C1)F)C Z4189742481 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.81 CNCC1=C(C=C(C=C1)F)Cl Z138105392 [0,2,0,0,0,0|2,0,0]=4 1093 B11R1.81 CNCC1=C(C=C(C=C1)F)F Z102767946 [0,2,0,0,0,0|2,0,0]=4 1094 B11R1.81 COCC1=C(C=C(C=C1)Br)F Z823854350 [0,2,0,0,0,0|2,0,0]=4 1095 B11R1.81 COCC1=C(C=C(C=C1)O)F Z1551937213 [0,2,0,0,0,0|2,0,0]=4 1096 B11R1.81 N#CCC1=C(C=C(C=C1)Br)Cl Z1269172560 [0,2,0,0,0,0|0,0,2]=4 1097 B11R1.81 N#CCC1=C(C=C(C=C1)Br)I Z1269139987 [0,2,0,0,0,0|0,0,2]=4 1098 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)Br Z1269120223 [0,2,0,0,0,0|0,0,2]=4 1099 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)Cl Z104477208 [0,2,0,0,0,0|0,0,2]=4 1100 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)F Z1201620925 [0,2,0,0,0,0|0,0,2]=4 1101 B11R1.81 N#CCC1=C(C=C(C=C1)F)Cl Z285184576 [0,2,0,0,0,0|0,0,2]=4 1102 B11R1.81 N#CCC1=C(C=C(C=C1)F)F Z963395642 [0,2,0,0,0,0|0,0,2]=4 1103 B11R1.81 NC1=CC(=C(C=C1)CCO)F Z1255436579 [0,2,0,0,0,0|1,0,0]=3 1104 B11R1.81 NCCC1=C(C=C(C=C1)Br)Cl Z4668045321 [0,2,0,0,0,0|0,0,0]=2 1105 B11R1.81 NCCC1=C(C=C(C=C1)Br)F Z405046450 [0,2,0,0,0,0|0,0,0]=2 1106 B11R1.81 NCCC1=C(C=C(C=C1)Cl)Br Z2941505410 [0,2,0,0,0,0|0,0,0]=2 1107 B11R1.81 NCCC1=C(C=C(C=C1)F)Cl Z1267881686 [0,2,0,0,0,0|0,0,0]=2 1108 B11R1.81 NCCC1=C(C=C(C=C1)F)F Z285143768 [0,2,0,0,0,0|0,0,0]=2 1109 B11R1.81 NCCC1=C(C=C(C=C1)O)O Z1166113553 [0,2,0,0,0,0|0,0,0]=2 1110 B11R1.81 NCCC1=C(C=C(C=N1)F)F Z3024735908 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.81 NCCN1C=CC(=O)NC1=O Z2830704503 [0,2,0,0,0,0|2,0,0]=4 1112 B11R1.81 NNCC1=C(C=C(C=C1)Cl)Cl Z367452298 [0,2,0,0,0,0|1,0,0]=3 1113 B11R1.81 NOCC1=C(C=C(C=C1)F)Br Z1318533831 [0,2,0,0,0,0|1,0,0]=3 1114 B11R1.81 O=CCC1=C(C=C(C=C1)Cl)Cl Z1183459048 [0,2,0,0,0,0|1,0,1]=4 1115 B11R1.81 O=CCC1=C(C=C(C=C1)F)Cl Z1183459114 [0,2,0,0,0,0|1,0,1]=4 1116 B11R1.81 O=CCC1=C(C=C(C=C1)F)F Z1020790242 [0,2,0,0,0,0|1,0,1]=4 1117 B11R1.81 OCCC1=C(C=C(C=C1)F)F Z1020790240 [0,2,0,0,0,0|1,0,0]=3 1118 B11R1.81 OCCC1=C(C=C(C=C1)O)O Z1513827466 [0,2,0,0,0,0|1,0,0]=3 1119 B11R1.83 C#CC1=CC=C(C=C1)CCN Z4634952920 [0,2,0,0,0,0|0,0,0]=2 1120 B11R1.83 C#CC1=CC=C(C=C1)OCC Z1080385490 [0,2,0,0,0,0|2,0,0]=4 1121 B11R1.83 C=CCC1=CC=C(C=C1)C=O Z1511744017 [0,2,0,0,0,0|1,0,1]=4 1122 B11R1.83 CCC1=CC=C(C=C1)CCN Z285143808 [0,2,0,0,0,0|0,0,0]=2 1123 B11R1.83 CCC1=CC=C(C=C1)CCO Z992949606 [0,2,0,0,0,0|1,0,0]=3 1124 B11R1.83 CCCC1=CC=C(C=C1)C=O Z147641436 [0,2,0,0,0,0|1,0,0]=3 1125 B11R1.83 CCNC1=CC=C(C=C1)C#N Z126933712 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.83 CCNC1=CC=C(C=C1)CC Z286410160 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.83 CCNC1=CC=C(C=C1)CN Z954985480 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.83 CCNC1=CC=C(C=C1)OC Z286371004 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.83 CCOC1=CC=C(C=C1)C#N Z53834532 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.83 CCOC1=CC=C(C=C1)C=O Z53833126 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.83 CCOC1=CC=C(C=C1)NC Z335255846 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.83 CCSC1=CC=C(C=C1)C#N Z332378580 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.83 CNCC1=CC=C(C=C1)C#N Z123857104 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.83 CNCC1=CC=C(C=C1)CO Z5435726703 [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.83 CNCC1=CC=C(C=C1)OC Z56928625 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.83 CNCC1=CC=C(C=C1)SC Z56960262 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.83 COC1=CC=C(C=C1)CC#N Z104476452 [0,2,0,0,0,0|0,0,2]=4 1138 B11R1.83 COC1=CC=C(C=C1)CC=O Z993017620 [0,2,0,0,0,0|1,0,1]=4 1139 B11R1.83 COC1=CC=C(C=C1)CCN Z104476454 [0,2,0,0,0,0|0,0,0]=2 1140 B11R1.83 COCC1=CC=C(C=C1)C#N Z295205408 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.83 COCC1=CC=C(C=C1)C=O Z1198331617 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.83 COCC1=CC=C(C=C1)CN Z240084734 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.83 COCC1=CC=C(C=C1)CO Z1255394253 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.83 CSC1=CC=C(C=C1)CC#N Z1114998149 [0,2,0,0,0,0|0,0,2]=4 1145 B11R1.83 CSC1=CC=C(C=C1)CC=O Z1198331627 [0,2,0,0,0,0|1,0,1]=4 1146 B11R1.83 CSC1=NC=C(C=N1)CCN Z1198277445 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.83 CSCC1=CC=C(C=C1)C#N Z432419878 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.83 CSCC1=CC=C(C=C1)C=O Z2216784275 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.83 CSCC1=CC=C(C=C1)SC Z599630492 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.83 N#CC1=CC=C(C=C1)CCN Z1741971794 [0,2,0,0,0,0|0,0,0]=2 1151 B11R1.83 N#CC1=CC=C(C=C1)CCO Z964982550 [0,2,0,0,0,0|1,0,0]=3 1152 B11R1.83 N#CCC1=CC=C(C=C1)C=O Z1255373857 [0,2,0,0,0,0|0,0,2]=4 1153 B11R1.83 NCCC1=CC=C(C=C1)CO Z3243654196 [0,2,0,0,0,0|0,0,0]=2 1154 B11R1.83 O=CC1=CC=C(C=C1)CCF Z1813165432 [0,2,0,0,0,0|1,0,0]=3 1155 B11R1.83 O=CC1=CC=C(C=C1)OCF Z4875012342 [0,2,0,0,0,0|2,0,0]=4 1156 B11R1.192 CC1=C(C=C(C=C1)CC#N)Br Z1269175660 [0,2,0,0,0,0|0,0,2]=4 1157 B11R1.192 CC1=C(C=C(C=C1)CC#N)Cl Z1198263502 [0,2,0,0,0,0|0,0,2]=4 1158 B11R1.192 CC1=C(C=C(C=C1)CC=O)C Z993017804 [0,2,0,0,0,0|1,0,1]=4 1159 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [0,2,0,0,0,0|0,0,0]=2 1160 B11R1.192 CC1=C(C=C(C=C1)CCN)Cl Z4330614334 [0,2,0,0,0,0|0,0,0]=2 1161 B11R1.192 CC1=C(C=CC(=C1)CC#N)Br Z1269136507 [0,2,0,0,0,0|0,0,2]=4 1162 B11R1.192 CC1=C(C=CC(=C1)CC#N)O Z1255368240 [0,2,0,0,0,0|0,0,2]=4 1163 B11R1.192 CC1=C(C=CC(=C1)CC=O)F Z1020779938 [0,2,0,0,0,0|1,0,1]=4 1164 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [0,2,0,0,0,0|0,0,0]=2 1165 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [0,2,0,0,0,0|0,0,0]=2 1166 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [0,2,0,0,0,0|0,0,0]=2 1167 B11R1.192 CCNC1=CC(=C(C=C1)C)C Z5214919889 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.192 CCNC1=CC(=C(C=C1)C)F Z2306658828 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.192 CCNC1=CC(=C(C=C1)F)C Z2756154226 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.192 CCNC1=CC(=C(C=C1)F)Cl Z286408112 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.192 CCNC1=CC(=C(C=C1)F)F Z334934070 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.192 CCOC1=CC(=C(C=C1)Br)F Z1185888453 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.192 CCOC1=CC(=C(C=C1)Cl)N Z1255357315 [0,2,0,0,0,0|2,0,0]=4 1174 B11R1.192 CCOC1=CC(=C(C=C1)N)F Z2327883785 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.192 CNCC1=CC(=C(C=C1)Br)Br Z6011701708 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.192 CNCC1=CC(=C(C=C1)Br)Cl Z5321384345 [0,2,0,0,0,0|2,0,0]=4 1177 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.192 CNCC1=CC(=C(C=C1)C)Cl Z5390415454 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.192 CNCC1=CC(=C(C=C1)C)F Z385447006 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.192 CNCC1=CC(=C(C=C1)Cl)Cl Z56963342 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.192 CNCC1=CC(=C(C=C1)F)F Z102767736 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.192 CSCC1=CC(=C(C=C1)Cl)N Z732207352 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.192 N#CCC1=CC(=C(C=C1)Br)Cl Z1269153504 [0,2,0,0,0,0|0,0,2]=4 1185 B11R1.192 N#CCC1=CC(=C(C=C1)Cl)Cl Z111875426 [0,2,0,0,0,0|0,0,2]=4 1186 B11R1.192 N#CCC1=CC(=C(C=C1)F)Br Z285131462 [0,2,0,0,0,0|0,0,2]=4 1187 B11R1.192 N#CCC1=CC(=C(C=C1)F)F Z1187714535 [0,2,0,0,0,0|0,0,2]=4 1188 B11R1.192 N#CCC1=CC(=C(C=C1)N)Cl Z1255382501 [0,2,0,0,0,0|0,0,2]=4 1189 B11R1.192 NCCC1=CC(=C(C=C1)Br)Cl Z5222342336 [0,2,0,0,0,0|0,0,0]=2 1190 B11R1.192 NCCC1=CC(=C(C=C1)Cl)Cl Z285143770 [0,2,0,0,0,0|0,0,0]=2 1191 B11R1.192 NCCC1=CC(=C(C=C1)Cl)F Z2681241887 [0,2,0,0,0,0|0,0,0]=2 1192 B11R1.192 NCCC1=CC(=C(C=C1)F)Br Z752370708 [0,2,0,0,0,0|0,0,0]=2 1193 B11R1.192 NCCC1=CC(=C(C=C1)F)Cl Z4607148848 [0,2,0,0,0,0|0,0,0]=2 1194 B11R1.192 NCCC1=CC(=C(C=C1)F)F Z1695670002 [0,2,0,0,0,0|0,0,0]=2 1195 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [0,2,0,0,0,0|0,0,0]=2 1196 B11R1.192 O=CCC1=CC(=C(C=C1)Br)F Z1269156049 [0,2,0,0,0,0|1,0,1]=4 1197 B11R1.192 O=CCC1=CC(=C(C=C1)F)F Z1020788676 [0,2,0,0,0,0|1,0,1]=4 1198 B11R1.192 OCCC1=CC(=C(C=C1)Br)F Z1450935429 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.192 OCCC1=CC(=C(C=C1)F)F Z1020788674 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.13 C=CCC1=CC=CC(=C1O)O Z56778453 [0,2,0,0,0,0|1,0,1]=4 1202 B11R1.13 CC1=C(C(=CC=C1)CC#N)F Z1255416252 [0,2,0,0,0,0|0,0,2]=4 1203 B11R1.13 CC1=C(C(=CC=C1)CCN)C Z4927171483 [0,2,0,0,0,0|0,0,0]=2 1204 B11R1.13 CCNC1=C(C(=CC=C1)C)C Z286511134 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.13 CCNC1=C(C(=CC=C1)C)F Z1599211198 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.13 CCNC1=C(C(=CC=C1)Cl)C Z286519066 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.13 CCNC1=C(C(=CC=C1)Cl)Cl Z1824511180 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.13 CCOC1=C(C(=CC=C1)F)Cl Z1726058748 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.13 CCSC1=C(C(=CC=C1)F)N Z451393782 [0,2,0,0,0,0|2,0,0]=4 1210 B11R1.13 CN1C(=O)C=CN=C1CCN Z3682241198 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.13 CNCC1=C(C(=CC=C1)Br)O Z4658970144 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.13 CNCC1=C(C(=CC=C1)Cl)F Z3013893037 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.13 CNCC1=C(C(=CC=C1)F)F Z4658970152 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.13 CSCC1=C(C(=CC=C1)N)C Z732207424 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.13 N#CCC1=C(C(=CC=C1)Br)Cl Z1269187155 [0,2,0,0,0,0|0,0,2]=4 1216 B11R1.13 N#CCC1=C(C(=CC=C1)Br)O Z1269134802 [0,2,0,0,0,0|0,0,2]=4 1217 B11R1.13 N#CCC1=C(C(=CC=C1)Cl)F Z1201621210 [0,2,0,0,0,0|0,0,2]=4 1218 B11R1.13 N#CCC1=CC=CC(=C1Cl)F Z1198263827 [0,2,0,0,0,0|0,0,2]=4 1219 B11R1.13 NCCC1=C(C(=CC=C1)Br)O Z1953500453 [0,2,0,0,0,0|0,0,0]=2 1220 B11R1.13 NCCC1=C(C(=CC=C1)Cl)Cl Z444350066 [0,2,0,0,0,0|0,0,0]=2 1221 B11R1.13 NCCC1=C(C(=CC=C1)Cl)F Z3301588304 [0,2,0,0,0,0|0,0,0]=2 1222 B11R1.13 NCCC1=C(C(=CC=C1)F)Cl Z4926042702 [0,2,0,0,0,0|0,0,0]=2 1223 B11R1.13 NCCC1=C(C(=CC=C1)F)F Z1267773780 [0,2,0,0,0,0|0,0,0]=2 1224 B11R1.13 O=CCC1=C(C(=CC=C1)Br)F Z1868320120 [0,2,0,0,0,0|1,0,1]=4 1225 B11R1.13 O=CCC1=CC=CC(=C1F)F Z1183458992 [0,2,0,0,0,0|1,0,1]=4 1226 B11R1.13 OCCC1=C(C(=CC=C1)F)F Z1183459328 [0,2,0,0,0,0|1,0,0]=3 1227 B11R1.17 C#CCNC1=C(C=CC=C1)F Z267213460 [0,2,0,0,0,0|1,0,1]=4 1228 B11R1.17 C#CCOC1=C(C=CC=C1)Cl Z54471915 [0,2,0,0,0,0|1,0,1]=4 1229 B11R1.17 C#CCOC1=C(C=CC=C1)F Z54554294 [0,2,0,0,0,0|1,0,1]=4 1230 B11R1.17 C#CCOC1=C(C=CC=C1)N Z730514548 [0,2,0,0,0,0|1,0,1]=4 1231 B11R1.17 C#CCOC1=C(C=CC=C1)O Z381415368 [0,2,0,0,0,0|1,0,1]=4 1232 B11R1.17 C=CCSC1=C(C=CC=C1)N Z89272864 [0,2,0,0,0,0|1,0,1]=4 1233 B11R1.17 CC1=C(C=CC=C1)CCCN Z424782962 [0,2,0,0,0,0|0,0,0]=2 1234 B11R1.17 CC1=C(C=CC=C1)CCCO Z979436644 [0,2,0,0,0,0|1,0,0]=3 1235 B11R1.17 CC1=C(C=CC=C1)OCC#N Z53791706 [0,2,0,0,0,0|0,0,2]=4 1236 B11R1.17 CC1=C(C=CC=C1)OCCN Z223656356 [0,2,0,0,0,0|0,0,0]=2 1237 B11R1.17 CC1=C(C=NC=C1)CCC=O Z1270653786 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.17 CC1=C(N=CC=C1)CCC#N Z1862003349 [0,2,0,0,0,0|1,0,1]=4 1239 B11R1.17 CC1=C(N=CC=C1)CCCN Z1198262715 [0,2,0,0,0,0|1,0,0]=3 1240 B11R1.17 CCCNC1=C(C=CC=C1)F Z334942896 [0,2,0,0,0,0|1,0,0]=3 1241 B11R1.17 CCCNC1=C(C=CC=C1)N Z94601320 [0,2,0,0,0,0|1,0,0]=3 1242 B11R1.17 CCCOC1=C(C=CC=C1)Br Z54722000 [0,2,0,0,0,0|1,0,0]=3 1243 B11R1.17 CCCOC1=C(C=CC=C1)N Z56968930 [0,2,0,0,0,0|1,0,0]=3 1244 B11R1.17 CCCOC1=C(C=CC=C1)O Z55993120 [0,2,0,0,0,0|1,0,0]=3 1245 B11R1.17 CCNCC1=C(C=CC=C1)Br Z1982494002 [0,2,0,0,0,0|1,0,0]=3 1246 B11R1.17 CCNCC1=C(C=CC=C1)C Z90513218 [0,2,0,0,0,0|1,0,0]=3 1247 B11R1.17 CCNCC1=C(C=CC=C1)Cl Z90513164 [0,2,0,0,0,0|1,0,0]=3 1248 B11R1.17 CCNCC1=C(C=CC=C1)F Z286282968 [0,2,0,0,0,0|1,0,0]=3 1249 B11R1.17 CCNCC1=C(C=CC=C1)N Z2351947311 [0,2,0,0,0,0|1,0,0]=3 1250 B11R1.17 CCOCC1=C(C=CC=C1)N Z285163822 [0,2,0,0,0,0|1,0,0]=3 1251 B11R1.17 CCSCC1=C(N=CC=C1)N Z991493204 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.17 CNCCC1=C(C=CC=C1)C Z2234185664 [0,2,0,0,0,0|0,0,0]=2 1253 B11R1.17 CNCCC1=C(C=CC=C1)Cl Z4935566656 [0,2,0,0,0,0|0,0,0]=2 1254 B11R1.17 CNCCC1=C(C=CC=C1)F Z163192604 [0,2,0,0,0,0|0,0,0]=2 1255 B11R1.17 CNCCC1=C(C=CC=C1)O Z1665033474 [0,2,0,0,0,0|0,0,0]=2 1256 B11R1.17 COCCC1=C(C=CC=C1)N Z992259832 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.17 COCCN1C=CC=CC1=O Z285935542 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.17 ClC1=C(C=CC=C1)OCCBr Z56886267 [0,2,0,0,0,0|1,0,0]=3 1259 B11R1.17 N#CCCC1=C(C=CC=C1)Br Z815260584 [0,2,0,0,0,0|0,0,1]=3 1260 B11R1.17 N#CCCN1C=CC=CC1=O Z91643979 [0,2,0,0,0,0|1,0,1]=4 1261 B11R1.17 N#CCOC1=C(C=CC=C1)Br Z54684411 [0,2,0,0,0,0|0,0,2]=4 1262 B11R1.17 N#CCSC1=C(C=CC=C1)Br Z149386606 [0,2,0,0,0,0|0,0,2]=4 1263 B11R1.17 N#CCSC1=C(C=CC=C1)Cl Z18459623 [0,2,0,0,0,0|0,0,2]=4 1264 B11R1.17 N#CCSC1=C(C=CC=C1)F Z18098612 [0,2,0,0,0,0|0,0,2]=4 1265 B11R1.17 NC1=C(C=CC=C1)CCCO Z1198265858 [0,2,0,0,0,0|1,0,0]=3 1266 B11R1.17 NC1=C(C=CC=C1)NCCO Z55928991 [0,2,0,0,0,0|1,0,0]=3 1267 B11R1.17 NC1=C(C=CC=C1)OCCO Z3445703033 [0,2,0,0,0,0|1,0,0]=3 1268 B11R1.17 NCCCC1=C(C=CC=C1)Cl Z1695729033 [0,2,0,0,0,0|0,0,0]=2 1269 B11R1.17 NCCCC1=C(C=CC=C1)F Z424783030 [0,2,0,0,0,0|0,0,0]=2 1270 B11R1.17 NCCCN1C=CC=CC1=O Z271005712 [0,2,0,0,0,0|1,0,0]=3 1271 B11R1.17 NCCCN1C=CC=NC1=O Z1956828657 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.17 NCCNC1=C(C=CC=C1)N Z991530054 [0,2,0,0,0,0|0,0,0]=2 1273 B11R1.17 NCCNC1=C(C=CC=N1)Br Z808603224 [0,2,0,0,0,0|1,0,0]=3 1274 B11R1.17 NCCOC1=C(C=CC=C1)Br Z803145324 [0,2,0,0,0,0|0,0,0]=2 1275 B11R1.17 NCCOC1=C(C=CC=C1)Cl Z54747867 [0,2,0,0,0,0|0,0,0]=2 1276 B11R1.17 NCCOC1=C(C=CC=C1)F Z1272739857 [0,2,0,0,0,0|0,0,0]=2 1277 B11R1.17 NCCOC1=C(C=CC=C1)O Z3217405430 [0,2,0,0,0,0|0,0,0]=2 1278 B11R1.17 NCCOC1=C(C=CC=N1)Cl Z1421528240 [0,2,0,0,0,0|1,0,0]=3 1279 B11R1.17 NCCSC1=C(C=CC=C1)F Z57971449 [0,2,0,0,0,0|0,0,0]=2 1280 B11R1.17 NNCCC1=C(C=CC=C1)F Z285144176 [0,2,0,0,0,0|0,0,0]=2 1281 B11R1.17 O=C1C=CC=CN1CCCO Z425794816 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.17 O=CCCC1=C(C=CC=C1)F Z993017602 [0,2,0,0,0,0|1,0,0]=3 1283 B11R1.17 OCCCC1=C(C=CC=C1)Br Z992949552 [0,2,0,0,0,0|1,0,0]=3 1284 B11R1.17 OCCOC1=C(C=CC=C1)Br Z149303034 [0,2,0,0,0,0|1,0,0]=3 1285 B11R1.17 OCCOC1=C(C=CC=C1)F Z425795714 [0,2,0,0,0,0|1,0,0]=3 1286 B11R1.17 OCCOC1=C(C=CC=C1)O Z56755902 [0,2,0,0,0,0|1,0,0]=3 1287 B11R1.17 OCCSC1=C(C=CC=C1)Br Z149386602 [0,2,0,0,0,0|1,0,0]=3 1288 B11R1.17 OCCSC1=C(C=CC=C1)Cl Z149174540 [0,2,0,0,0,0|1,0,0]=3 1289 B11R1.17 OCCSC1=C(C=CC=N1)F Z997724398 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.41 C=CCC1=C(C=CC=C1)C=O Z1511741429 [0,2,0,0,0,0|1,0,1]=4 1291 B11R1.41 CCC1=C(C=CC=C1)CC#N Z1198263420 [0,2,0,0,0,0|0,0,2]=4 1292 B11R1.41 CCC1=C(C=CC=C1)CNC Z5510186140 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.41 CCCC1=C(C=CC=C1)CN Z3241253417 [0,2,0,0,0,0|1,0,0]=3 1294 B11R1.41 CCNC1=C(C=CC=C1)C=O Z1203746444 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.41 CCOC1=C(C=CC=C1)C#N Z51119298 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.41 CCOC1=C(C=CC=C1)C=O Z53833343 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.41 CCOC1=C(C=CC=C1)CCl Z56347085 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.41 CCOC1=C(C=CC=C1)CN Z57102477 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.41 CCOC1=C(C=CC=C1)NC Z1526503386 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.41 CNCC1=C(C=CC=C1)OC Z56944118 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.41 COC1=C(C=CC=C1)CC=O Z3224150690 [0,2,0,0,0,0|1,0,1]=4 1302 B11R1.41 COC1=C(C=CC=C1)CCN Z104493472 [0,2,0,0,0,0|0,0,0]=2 1303 B11R1.41 COC1=C(C=CC=N1)CCO Z1504674309 [0,2,0,0,0,0|2,0,0]=4 1304 B11R1.41 COC1=C(C=NC=C1)CCN Z2752229904 [0,2,0,0,0,0|1,0,0]=3 1305 B11R1.41 COCC1=C(C=CC=C1)C#N Z295205402 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.41 COCC1=C(C=CC=C1)C=O Z1266890219 [0,2,0,0,0,0|2,0,0]=4 1307 B11R1.41 COCC1=C(C=CC=C1)CN Z240084736 [0,2,0,0,0,0|2,0,0]=4 1308 B11R1.41 N#CC1=C(C=CC=C1)CCN Z1198235631 [0,2,0,0,0,0|0,0,0]=2 1309 B11R1.41 N#CCC1=C(C=CC=C1)C#N Z104478592 [0,2,0,0,0,0|0,0,2]=4 1310 B11R1.41 O=CC1=C(C=CC=C1)CCCl Z420006804 [0,2,0,0,0,0|1,0,0]=3 1311 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [0,2,0,0,0,0|1,0,1]=4 1312 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [0,2,0,0,0,0|1,0,1]=4 1313 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [0,2,0,0,0,0|1,0,1]=4 1314 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.86 CC(C)CC1=C(C=CC=C1)N Z1171158156 [0,2,0,0,0,0|1,0,0]=3 1316 B11R1.86 CC(C)NC1=C(C=CC=C1)Br Z334939134 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.86 CC(C)NC1=C(C=CC=C1)I Z362774390 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.86 CC(C)OC1=C(C=CC=C1)Br Z54690481 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.86 CC(C)OC1=C(C=CC=C1)Cl Z53833775 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.86 CC(C)OC1=C(C=CC=C1)N Z239604736 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.86 CC(C)SC1=C(C=CC=C1)N Z316174692 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [0,2,0,0,0,0|0,0,0]=2 1323 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [0,2,0,0,0,0|0,0,0]=2 1324 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [0,2,0,0,0,0|0,0,1]=3 1325 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [0,2,0,0,0,0|0,0,1]=3 1326 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [0,2,0,0,0,0|1,0,1]=4 1327 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [0,2,0,0,0,0|0,0,0]=2 1328 B11R1.86 CC1=C(C=CC=C1)NC(=S)N Z199467218 [0,2,0,0,0,0|1,0,1]=4 1329 B11R1.86 CC1=C(C=CC=C1)NC(C)C Z267168760 [0,2,0,0,0,0|2,0,0]=4 1330 B11R1.86 CC1=C(C=CN=C1)CC(C)N Z4926043046 [0,2,0,0,0,0|1,0,0]=3 1331 B11R1.86 CN(C)CC1=C(C=CC=C1)Cl Z54750062 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.86 CN(C)CC1=C(C=CC=C1)N Z285162890 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [0,2,0,0,0,0|2,0,0]=4 1334 B11R1.86 FC(F)OC1=C(C=CC=C1)Br Z295440616 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [0,2,0,0,0,0|0,0,1]=3 1336 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [0,2,0,0,0,0|0,0,1]=3 1337 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [0,2,0,0,0,0|0,0,1]=3 1338 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [0,2,0,0,0,0|0,0,1]=3 1339 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [0,2,0,0,0,0|0,0,1]=3 1340 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [0,2,0,0,0,0|0,0,1]=3 1341 B11R1.86 NC(=O)NC1=C(C=CC=C1)Br Z247615996 [0,2,0,0,0,0|1,0,1]=4 1342 B11R1.86 NC(=O)NC1=C(C=CC=C1)Cl Z56754680 [0,2,0,0,0,0|1,0,1]=4 1343 B11R1.86 NC(=O)NC1=C(C=CC=C1)F Z57028527 [0,2,0,0,0,0|1,0,1]=4 1344 B11R1.86 NC(=S)NC1=C(C=CC=C1)F Z199467164 [0,2,0,0,0,0|1,0,1]=4 1345 B11R1.86 NC1=C(C=CC=C1)OC(F)F Z2517097718 [0,2,0,0,0,0|2,0,0]=4 1346 B11R1.86 NC1=C(C=CC=C1)SC(F)F Z85956866 [0,2,0,0,0,0|2,0,0]=4 1347 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [0,2,0,0,0,0|1,0,1]=4 1348 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [0,2,0,0,0,0|1,0,1]=4 1349 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [0,2,0,0,0,0|1,0,1]=4 1350 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [0,2,0,0,0,0|1,0,1]=4 1351 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [0,2,0,0,0,0|1,0,1]=4 1352 B11R1.86 O=[N+]([O-])CC1=C(C=CC=C1)F Z2182028452 [0,2,0,0,0,0|2,0,0]=4 1353 B11R1.86 OB(O)CC1=C(C=CC=C1)Cl Z1147227737 [0,2,0,0,0,0|2,0,0]=4 1354 B11R1.86 OC1=C(C=CC=C1)OC(F)F Z381415218 [0,2,0,0,0,0|2,0,0]=4 1355 B11R1.86 OC1=C(C=CC=C1)SC(F)F Z905204310 [0,2,0,0,0,0|2,0,0]=4 1356 B11R1.182 CC1=C(C=C(C=C1)Br)CC#N Z1269111419 [0,2,0,0,0,0|0,0,2]=4 1357 B11R1.182 CC1=C(C=C(C=C1)F)CCN Z4751180899 [0,2,0,0,0,0|0,0,0]=2 1358 B11R1.182 CC1=CC(=C(C=C1)C)CC#N Z820092518 [0,2,0,0,0,0|0,0,2]=4 1359 B11R1.182 CC1=CC(=C(C=C1)C)CC=O Z993017798 [0,2,0,0,0,0|1,0,1]=4 1360 B11R1.182 CC1=CC(=C(C=C1)F)CC#N Z1198173739 [0,2,0,0,0,0|0,0,2]=4 1361 B11R1.182 CCNC1=C(C=CC(=C1)Br)N Z1259174161 [0,2,0,0,0,0|2,0,0]=4 1362 B11R1.182 CCNC1=C(C=CC(=C1)C)C Z752370990 [0,2,0,0,0,0|2,0,0]=4 1363 B11R1.182 CCNC1=C(C=CC(=C1)C)F Z362623226 [0,2,0,0,0,0|2,0,0]=4 1364 B11R1.182 CCNC1=C(C=CC(=C1)Cl)N Z3248177417 [0,2,0,0,0,0|2,0,0]=4 1365 B11R1.182 CCNC1=C(C=CC(=C1)F)N Z979730344 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.182 CCOC1=C(C=CC(=C1)Br)Cl Z428710892 [0,2,0,0,0,0|2,0,0]=4 1367 B11R1.182 CCOC1=C(C=CC(=C1)Br)N Z1259175664 [0,2,0,0,0,0|2,0,0]=4 1368 B11R1.182 CCOC1=C(C=CC(=C1)C)N Z295458012 [0,2,0,0,0,0|2,0,0]=4 1369 B11R1.182 CCOC1=C(C=CC(=C1)Cl)N Z972871026 [0,2,0,0,0,0|2,0,0]=4 1370 B11R1.182 CCOC1=C(C=CC(=C1)F)N Z240869730 [0,2,0,0,0,0|2,0,0]=4 1371 B11R1.182 CCOC1=C(C=CC(=C1)O)N Z1837073495 [0,2,0,0,0,0|2,0,0]=4 1372 B11R1.182 CCSC1=C(C=CC(=C1)Br)N Z1259175915 [0,2,0,0,0,0|2,0,0]=4 1373 B11R1.182 CNCC1=C(C=CC(=C1)Br)F Z1262250889 [0,2,0,0,0,0|2,0,0]=4 1374 B11R1.182 CNCC1=C(C=CC(=C1)C)C Z4243490762 [0,2,0,0,0,0|2,0,0]=4 1375 B11R1.182 CNCC1=C(C=CC(=C1)Cl)Br Z4670285096 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.182 CNCC1=C(C=CC(=C1)Cl)C Z4925996401 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.182 CNCC1=C(C=CC(=C1)Cl)Cl Z5390405610 [0,2,0,0,0,0|2,0,0]=4 1378 B11R1.182 CNCC1=C(C=CC(=C1)Cl)F Z4658970150 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.182 CNCC1=C(C=CC(=C1)F)Br Z1875111390 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.182 CNCC1=C(C=CC(=C1)F)C Z1878107281 [0,2,0,0,0,0|2,0,0]=4 1381 B11R1.182 COCC1=C(C=CC(=C1)F)N Z2472857186 [0,2,0,0,0,0|2,0,0]=4 1382 B11R1.182 COCC1=C(C=CC(=C1)N)Cl Z394691692 [0,2,0,0,0,0|2,0,0]=4 1383 B11R1.182 COCC1=C(C=CC(=C1)O)N Z1262683212 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.182 N#CCC1=C(C=CC(=C1)Br)Br Z1269147323 [0,2,0,0,0,0|0,0,2]=4 1385 B11R1.182 N#CCC1=C(C=CC(=C1)Br)F Z285225830 [0,2,0,0,0,0|0,0,2]=4 1386 B11R1.182 N#CCC1=C(C=CC(=C1)Cl)Cl Z1182702336 [0,2,0,0,0,0|0,0,2]=4 1387 B11R1.182 N#CCC1=C(C=CC(=C1)Cl)N Z1255505578 [0,2,0,0,0,0|0,0,2]=4 1388 B11R1.182 NC1=CN(C(=O)C=C1)CCO Z335092314 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.182 NCCC1=C(C=CC(=C1)Br)F Z285143732 [0,2,0,0,0,0|0,0,0]=2 1390 B11R1.182 NCCC1=C(C=CC(=C1)Cl)Br Z1474026680 [0,2,0,0,0,0|0,0,0]=2 1391 B11R1.182 NCCC1=C(C=CC(=C1)Cl)Cl Z1268152320 [0,2,0,0,0,0|0,0,0]=2 1392 B11R1.182 NCCC1=C(C=CC(=C1)F)Br Z3681530426 [0,2,0,0,0,0|0,0,0]=2 1393 B11R1.182 NCCC1=C(C=CC(=C1)F)Cl Z4668068102 [0,2,0,0,0,0|0,0,0]=2 1394 B11R1.182 NCCC1=C(C=CC(=C1)F)F Z415635654 [0,2,0,0,0,0|0,0,0]=2 1395 B11R1.182 NCCC1=C(C=CC(=C1)O)Br Z3376089277 [0,2,0,0,0,0|0,0,0]=2 1396 B11R1.182 NCCN1C=C(C=CC1=O)Br Z2235330324 [0,2,0,0,0,0|1,0,0]=3 1397 B11R1.182 O=C1C=CC(=CN1CCO)Br Z1623872303 [0,2,0,0,0,0|2,0,0]=4 1398 B11R1.182 OCCC1=C(C=CC(=C1)Br)O Z1269218042 [0,2,0,0,0,0|1,0,0]=3 1399 B11R1.222 CC(C=O)C1=C(C=CC=C1)Br Z1269159201 [0,2,0,0,0,0|1,0,1]=4 1400 B11R1.222 CC(C=O)C1=C(C=CC=C1)Cl Z1222424635 [0,2,0,0,0,0|1,0,1]=4 1401 B11R1.222 CC(C=O)C1=C(C=CC=C1)F Z1222424647 [0,2,0,0,0,0|1,0,1]=4 1402 B11R1.222 CC1=C(C=CC=C1)C(=O)CN Z1741966378 [0,2,0,0,0,0|0,0,1]=3 1403 B11R1.222 CC1=C(C=CC=C1)C(=O)NN Z56347320 [0,2,0,0,0,0|1,0,1]=4 1404 B11R1.222 CC1=C(C=CC=C1)C(C)C#N Z415654748 [0,2,0,0,0,0|0,0,2]=4 1405 B11R1.222 CC1=C(C=CC=C1)C(C)C=O Z1222424657 [0,2,0,0,0,0|1,0,1]=4 1406 B11R1.222 CC1=C(C=CC=C1)C(N)C#N Z4658101942 [0,2,0,0,0,0|0,0,2]=4 1407 B11R1.222 CC1=C(C=CC=C1)C(N)CF Z3092528504 [0,2,0,0,0,0|1,0,0]=3 1408 B11R1.222 CC1=C(C=CC=C1)C(N)CO Z385458414 [0,2,0,0,0,0|1,0,0]=3 1409 B11R1.222 CC1=C(C=CC=C1)C(O)CN Z336086534 [0,2,0,0,0,0|0,0,0]=2 1410 B11R1.222 CCC(=O)C1=C(C=CC=C1)Br Z851790216 [0,2,0,0,0,0|1,0,1]=4 1411 B11R1.222 CCC(=O)C1=C(C=CC=C1)N Z1201617664 [0,2,0,0,0,0|1,0,1]=4 1412 B11R1.222 CCC(N)C1=C(C=CC=C1)Br Z851790482 [0,2,0,0,0,0|1,0,0]=3 1413 B11R1.222 CCC(N)C1=C(C=CC=C1)O Z1266854970 [0,2,0,0,0,0|1,0,0]=3 1414 B11R1.222 CCN(C)C1=C(C=CC=C1)N Z409023630 [0,2,0,0,0,0|2,0,0]=4 1415 B11R1.222 CCS(=O)C1=C(C=CC=C1)N Z808592520 [0,2,0,0,0,0|2,0,0]=4 1416 B11R1.222 CNC(C)C1=C(C=CC=C1)Br Z1497158706 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.222 CNC(C)C1=C(C=CC=C1)C Z159528196 [0,2,0,0,0,0|2,0,0]=4 1418 B11R1.222 CNC(C)C1=C(C=CC=C1)Cl Z138106016 [0,2,0,0,0,0|2,0,0]=4 1419 B11R1.222 CNC(C)C1=C(C=CC=C1)O Z316170358 [0,2,0,0,0,0|2,0,0]=4 1420 B11R1.222 N#CC(N)C1=C(C=CC=C1)Br Z2526438961 [0,2,0,0,0,0|0,0,2]=4 1421 B11R1.222 N#CC(N)C1=C(C=CC=C1)Cl Z993967186 [0,2,0,0,0,0|0,0,2]=4 1422 B11R1.222 N#CC(N)C1=C(C=CC=C1)F Z1263602437 [0,2,0,0,0,0|0,0,2]=4 1423 B11R1.222 NC(CF)C1=C(C=CC=C1)Br Z4444282330 [0,2,0,0,0,0|1,0,0]=3 1424 B11R1.222 NC(CO)C1=C(C=CC=C1)F Z1268152413 [0,2,0,0,0,0|1,0,0]=3 1425 B11R1.222 NC(CO)C1=C(C=CC=C1)I Z2941400807 [0,2,0,0,0,0|1,0,0]=3 1426 B11R1.222 NCC(=O)C1=C(C=CC=C1)Br Z1262691661 [0,2,0,0,0,0|0,0,1]=3 1427 B11R1.222 NCC(=O)C1=C(C=CC=C1)Cl Z1695906936 [0,2,0,0,0,0|0,0,1]=3 1428 B11R1.222 NCC(=O)C1=C(C=CC=C1)F Z1741977084 [0,2,0,0,0,0|0,0,1]=3 1429 B11R1.222 NCC(=O)C1=C(C=CC=N1)Cl Z2732088843 [0,2,0,0,0,0|1,0,1]=4 1430 B11R1.222 NCC(=O)C1=C(N=CC=C1)Cl Z2738925579 [0,2,0,0,0,0|1,0,1]=4 1431 B11R1.222 NCC(O)C1=C(C=CC=C1)Cl Z1255523275 [0,2,0,0,0,0|0,0,0]=2 1432 B11R1.222 NNC(=O)C1=C(C=CC=C1)Br Z56899129 [0,2,0,0,0,0|1,0,1]=4 1433 B11R1.222 NNC(=O)C1=C(C=CC=C1)Cl Z57248585 [0,2,0,0,0,0|1,0,1]=4 1434 B11R1.222 NNC(=O)C1=C(C=CC=C1)F Z56896291 [0,2,0,0,0,0|1,0,1]=4 1435 B11R1.222 NNC(=O)C1=C(C=CC=C1)N Z104472510 [0,2,0,0,0,0|1,0,1]=4 1436 B11R1.222 NNC(=O)C1=C(C=CC=C1)O Z57241860 [0,2,0,0,0,0|1,0,1]=4 1437 B11R1.222 O=C(CBr)C1=C(C=CC=C1)F Z94602027 [0,2,0,0,0,0|1,0,1]=4 1438 B11R1.222 O=C(CCl)C1=C(C=CC=C1)F Z854066970 [0,2,0,0,0,0|1,0,1]=4 1439 B11R1.222 O=C(CO)C1=C(C=CC=C1)Cl Z906206760 [0,2,0,0,0,0|1,0,1]=4 1440 B11R1.605 CC1=C(C(=CC=C1)Cl)CC#N Z1255383050 [0,2,0,0,0,0|0,0,2]=4 1441 B11R1.605 CC1=CC=CC(=C1CCO)C Z1198264906 [0,2,0,0,0,0|1,0,0]=3 1442 B11R1.605 CCOC1=C(C=CC=C1N)Cl Z803145532 [0,2,0,0,0,0|2,0,0]=4 1443 B11R1.605 CNCC1=C(C=CC=C1C)C Z2932033934 [0,2,0,0,0,0|2,0,0]=4 1444 B11R1.605 CNCC1=C(C=CC=C1Cl)Cl Z57327142 [0,2,0,0,0,0|2,0,0]=4 1445 B11R1.605 CNCC1=C(C=CC=C1F)Cl Z56957511 [0,2,0,0,0,0|2,0,0]=4 1446 B11R1.605 COCC1=C(C=CC=C1N)Br Z394690378 [0,2,0,0,0,0|2,0,0]=4 1447 B11R1.605 COCC1=C(C=CC=C1N)Cl Z1416200943 [0,2,0,0,0,0|2,0,0]=4 1448 B11R1.605 FC1=C(C(=CC=C1)Cl)CCCl Z397587568 [0,2,0,0,0,0|1,0,0]=3 1449 B11R1.605 N#CCC1=C(C=CC=C1Cl)Cl Z56911945 [0,2,0,0,0,0|0,0,2]=4 1450 B11R1.605 N#CCC1=C(C=CC=C1Cl)F Z57040512 [0,2,0,0,0,0|0,0,2]=4 1451 B11R1.605 N#CCC1=C(C=CC=C1F)F Z1203161886 [0,2,0,0,0,0|0,0,2]=4 1452 B11R1.605 NCCC1=C(C=CC=C1F)Br Z4870683590 [0,2,0,0,0,0|0,0,0]=2 1453 B11R1.605 NCCC1=C(C=CC=C1F)Cl Z1431002711 [0,2,0,0,0,0|0,0,0]=2 1454 B11R1.605 NCCC1=C(C=NC=C1Br)Br Z3400352529 [0,2,0,0,0,0|1,0,0]=3 1455 B11R1.605 NCCC1=C(C=NC=C1Cl)Cl Z2311328567 [0,2,0,0,0,0|1,0,0]=3 1456 B11R1.605 NCCC1=C(C=NC=C1F)F Z1198178875 [0,2,0,0,0,0|1,0,0]=3 1457 B11R1.605 OCCC1=C(C=CC=C1Cl)Cl Z1183459248 [0,2,0,0,0,0|1,0,0]=3 1458 B11R1.23 C#CC(N)C1=CC(=CC=C1)Br Z4120296552 [0,2,0,0,0,0|1,0,1]=4 1459 B11R1.23 CC(C#N)C1=CC(=CC=C1)F Z415654674 [0,2,0,0,0,0|0,0,2]=4 1460 B11R1.23 CC(C=O)C1=CC(=CC=C1)Br Z1269224544 [0,2,0,0,0,0|1,0,1]=4 1461 B11R1.23 CC(C=O)C1=CC(=CC=C1)Cl Z1222424632 [0,2,0,0,0,0|1,0,1]=4 1462 B11R1.23 CC(C=O)C1=CC(=CC=C1)F Z1222424642 [0,2,0,0,0,0|1,0,1]=4 1463 B11R1.23 CC(CN)C1=CC(=CC=C1)Br Z5094147873 [0,2,0,0,0,0|0,0,0]=2 1464 B11R1.23 CC(CN)C1=CC(=CC=C1)F Z415654914 [0,2,0,0,0,0|0,0,0]=2 1465 B11R1.23 CC(CN)C1=CC=CC(=O)N1 Z4656721256 [0,2,0,0,0,0|1,0,0]=3 1466 B11R1.23 CC(CO)C1=CC(=CC=C1)Br Z1269177166 [0,2,0,0,0,0|1,0,0]=3 1467 B11R1.23 CC(CO)C1=CC(=CC=C1)Cl Z1222424631 [0,2,0,0,0,0|1,0,0]=3 1468 B11R1.23 CC1=CC(=CC=C1)C(=O)CN Z3026469451 [0,2,0,0,0,0|0,0,1]=3 1469 B11R1.23 CC1=CC(=CC=C1)C(O)CN Z336086464 [0,2,0,0,0,0|0,0,0]=2 1470 B11R1.23 CC1=CC=CC(=C1)C(C)C=O Z1222424653 [0,2,0,0,0,0|1,0,1]=4 1471 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br Z104486266 [0,2,0,0,0,0|1,0,1]=4 1472 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl Z104477758 [0,2,0,0,0,0|1,0,1]=4 1473 B11R1.23 CCC(=O)C1=CC(=CC=C1)N Z1203578334 [0,2,0,0,0,0|1,0,1]=4 1474 B11R1.23 CCC(N)C1=CC(=CC=C1)Cl Z239627026 [0,2,0,0,0,0|1,0,0]=3 1475 B11R1.23 CCC(N)C1=CC(=CC=C1)O Z4164634595 [0,2,0,0,0,0|1,0,0]=3 1476 B11R1.23 CCC(N)C1=NC(=CC=C1)C Z4457910024 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.23 CCC(O)C1=CC(=CC=C1)Br Z228586280 [0,2,0,0,0,0|1,0,0]=3 1478 B11R1.23 CCC(O)C1=CC(=CC=C1)Cl Z335245132 [0,2,0,0,0,0|1,0,0]=3 1479 B11R1.23 CCC(O)C1=CC(=CC=C1)N Z1262626036 [0,2,0,0,0,0|1,0,0]=3 1480 B11R1.23 CNC(C)C1=CC(=CC=C1)Cl Z159528162 [0,2,0,0,0,0|2,0,0]=4 1481 B11R1.23 CNC(C)C1=CC(=CC=C1)O Z1266854844 [0,2,0,0,0,0|2,0,0]=4 1482 B11R1.23 COC(C)C1=CC(=CC=C1)N Z801781454 [0,2,0,0,0,0|2,0,0]=4 1483 B11R1.23 CSC(C)C1=CC(=CC=C1)N Z801781922 [0,2,0,0,0,0|2,0,0]=4 1484 B11R1.23 N#CC(N)C1=CC(=CC=C1)Cl Z398556966 [0,2,0,0,0,0|0,0,2]=4 1485 B11R1.23 NC(CF)C1=CC(=CC=C1)Br Z3210128314 [0,2,0,0,0,0|1,0,0]=3 1486 B11R1.23 NC(CF)C1=CC(=CC=C1)Cl Z3445798142 [0,2,0,0,0,0|1,0,0]=3 1487 B11R1.23 NC(CF)C1=CC(=CC=C1)F Z3681214901 [0,2,0,0,0,0|1,0,0]=3 1488 B11R1.23 NC(CO)C1=CC(=CC=C1)Br Z1438483917 [0,2,0,0,0,0|1,0,0]=3 1489 B11R1.23 NC(CO)C1=CC(=CC=C1)Cl Z1695784092 [0,2,0,0,0,0|1,0,0]=3 1490 B11R1.23 NC(CO)C1=CC(=CC=C1)F Z1268152384 [0,2,0,0,0,0|1,0,0]=3 1491 B11R1.23 NC(CO)C1=CC(=CC=C1)I Z3605387233 [0,2,0,0,0,0|1,0,0]=3 1492 B11R1.23 NC(CO)C1=CC(=CC=C1)O Z3247611804 [0,2,0,0,0,0|1,0,0]=3 1493 B11R1.23 NC1=CC(=CC=C1)C(O)CO Z970072128 [0,2,0,0,0,0|1,0,0]=3 1494 B11R1.23 NCC(=O)C1=CC(=CC=C1)Br Z275368900 [0,2,0,0,0,0|0,0,1]=3 1495 B11R1.23 NCC(=O)C1=CC(=CC=C1)Cl Z1741966377 [0,2,0,0,0,0|0,0,1]=3 1496 B11R1.23 NCC(=O)C1=CC(=CC=C1)F Z3025863838 [0,2,0,0,0,0|0,0,1]=3 1497 B11R1.23 NCC(=O)C1=CC(=CN=C1)Br Z2696739932 [0,2,0,0,0,0|1,0,1]=4 1498 B11R1.23 NCC(O)C1=CC(=CC=C1)Cl Z330910384 [0,2,0,0,0,0|0,0,0]=2 1499 B11R1.23 NCC(O)C1=CC(=CC=C1)O Z3041501762 [0,2,0,0,0,0|0,0,0]=2 1500 B11R1.23 NNC(=O)C1=CC(=CC=C1)Cl Z56899158 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.23 NNC(=O)C1=CC(=CC=C1)N Z56922179 [0,2,0,0,0,0|1,0,1]=4 1502 B11R1.23 NNC(=O)C1=CC(=CC=C1)O Z56930730 [0,2,0,0,0,0|1,0,1]=4 1503 B11R1.23 O=C(CBr)C1=CC=CC(=C1)Cl Z104482040 [0,2,0,0,0,0|1,0,1]=4 1504 B11R1.23 O=C(CBr)C1=CC=CC(=C1)F Z111411220 [0,2,0,0,0,0|1,0,1]=4 1505 B11R1.24 BrCCOC1=CC(=CC=C1)Br Z56886268 [0,2,0,0,0,0|1,0,0]=3 1506 B11R1.24 C#CCNC1=CC=CC(=C1)F Z3210379881 [0,2,0,0,0,0|1,0,1]=4 1507 B11R1.24 C#CCOC1=CC=CC(=C1)Br Z54473729 [0,2,0,0,0,0|1,0,1]=4 1508 B11R1.24 C#CCOC1=CC=CC(=C1)C Z54472997 [0,2,0,0,0,0|1,0,1]=4 1509 B11R1.24 C#CCOC1=CC=CC(=C1)Cl Z54474446 [0,2,0,0,0,0|1,0,1]=4 1510 B11R1.24 C#CCOC1=CC=CC(=C1)F Z54472195 [0,2,0,0,0,0|1,0,1]=4 1511 B11R1.24 C#CCOC1=CC=CC(=C1)N Z730509748 [0,2,0,0,0,0|1,0,1]=4 1512 B11R1.24 C#CCOC1=CC=CC(=C1)O Z381415784 [0,2,0,0,0,0|1,0,1]=4 1513 B11R1.24 C=CCCC1=CC=CC(=C1)Br Z1269162615 [0,2,0,0,0,0|1,0,0]=3 1514 B11R1.24 C=CCOC1=CC=CC(=C1)N Z274779170 [0,2,0,0,0,0|1,0,1]=4 1515 B11R1.24 CC1=CC(=CC=C1)CCCN Z4993130622 [0,2,0,0,0,0|0,0,0]=2 1516 B11R1.24 CC1=CC(=CC=C1)CCCO Z979436642 [0,2,0,0,0,0|1,0,0]=3 1517 B11R1.24 CC1=CC(=CC=C1)OCCBr Z56886266 [0,2,0,0,0,0|1,0,0]=3 1518 B11R1.24 CC1=CC(=CC=C1)OCCN Z85926240 [0,2,0,0,0,0|0,0,0]=2 1519 B11R1.24 CC1=CC(=CN=C1)CCC=O Z1492427371 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.24 CC1=CC(=CN=C1)CCCO Z1216820424 [0,2,0,0,0,0|2,0,0]=4 1521 B11R1.24 CC1=CC(=NC=C1)NCCO Z1250080924 [0,2,0,0,0,0|2,0,0]=4 1522 B11R1.24 CC1=NC(=CC=C1)CCCO Z104479712 [0,2,0,0,0,0|2,0,0]=4 1523 B11R1.24 CC1=NC(=CC=C1)NCCN Z1267773738 [0,2,0,0,0,0|1,0,0]=3 1524 B11R1.24 CCCOC1=CC(=CC=C1)Br Z54848718 [0,2,0,0,0,0|1,0,0]=3 1525 B11R1.24 CCCOC1=CC(=CC=C1)N Z239604770 [0,2,0,0,0,0|1,0,0]=3 1526 B11R1.24 CCCOC1=CC(=CC=C1)O Z381415572 [0,2,0,0,0,0|1,0,0]=3 1527 B11R1.24 CCNCC1=CC(=CC=C1)Br Z1138763375 [0,2,0,0,0,0|1,0,0]=3 1528 B11R1.24 CCNCC1=CC(=CC=C1)C Z90513252 [0,2,0,0,0,0|1,0,0]=3 1529 B11R1.24 CCNCC1=CC(=CC=C1)Cl Z90513201 [0,2,0,0,0,0|1,0,0]=3 1530 B11R1.24 CCNCC1=CC(=CC=C1)F Z85935746 [0,2,0,0,0,0|1,0,0]=3 1531 B11R1.24 CCNCC1=CC(=CN=C1)Br Z3244742192 [0,2,0,0,0,0|2,0,0]=4 1532 B11R1.24 CCNCC1=NC(=CC=C1)C Z385447500 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.24 CCOCC1=CC(=CC=C1)N Z285163820 [0,2,0,0,0,0|1,0,0]=3 1534 B11R1.24 CCSCC1=CC(=CC=C1)N Z332378038 [0,2,0,0,0,0|1,0,0]=3 1535 B11R1.24 CNCCC1=CC(=CC=C1)Br Z2168282744 [0,2,0,0,0,0|0,0,0]=2 1536 B11R1.24 CNCCC1=CC(=CC=C1)O Z4924737523 [0,2,0,0,0,0|0,0,0]=2 1537 B11R1.24 CNCCC1=NC(=CC=N1)O Z3023572741 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.24 COCCC1=CC(=CC=C1)O Z1513911027 [0,2,0,0,0,0|1,0,0]=3 1539 B11R1.24 COCCC1=CC(=NC=C1)N Z1333211037 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.24 N#CCNC1=CC=CC(=C1)Cl Z266494142 [0,2,0,0,0,0|0,0,2]=4 1541 B11R1.24 N#CCNC1=CC=CC(=C1)F Z266497222 [0,2,0,0,0,0|0,0,2]=4 1542 B11R1.24 N#CCOC1=CC=CC(=C1)N Z285182504 [0,2,0,0,0,0|0,0,2]=4 1543 B11R1.24 N#CCOC1=CC=CC(=C1)O Z381415714 [0,2,0,0,0,0|0,0,2]=4 1544 B11R1.24 N#CCSC1=CC=CC(=C1)Br Z1020820468 [0,2,0,0,0,0|0,0,2]=4 1545 B11R1.24 NC1=CC(=CC=C1)CCCO Z1198265859 [0,2,0,0,0,0|1,0,0]=3 1546 B11R1.24 NC1=CC(=CC=C1)OCCF Z1262657442 [0,2,0,0,0,0|1,0,0]=3 1547 B11R1.24 NCC#CC1=CC(=CC=C1)F Z2004547701 [0,2,0,0,0,0|0,0,1]=3 1548 B11R1.24 NCCCC1=CC(=CC=C1)Br Z1266823414 [0,2,0,0,0,0|0,0,0]=2 1549 B11R1.24 NCCCC1=CC(=CC=C1)Cl Z1262246154 [0,2,0,0,0,0|0,0,0]=2 1550 B11R1.24 NCCCC1=CC(=CC=C1)F Z424782946 [0,2,0,0,0,0|0,0,0]=2 1551 B11R1.24 NCCCC1=CC(=CC=C1)O Z1895582955 [0,2,0,0,0,0|0,0,0]=2 1552 B11R1.24 NCCCC1=CC(=CN=C1)F Z4446765955 [0,2,0,0,0,0|1,0,0]=3 1553 B11R1.24 NCCOC1=CC(=CC=C1)Br Z744843646 [0,2,0,0,0,0|0,0,0]=2 1554 B11R1.24 NCCOC1=CC(=CC=C1)Cl Z425484860 [0,2,0,0,0,0|0,0,0]=2 1555 B11R1.24 NCCOC1=CC(=CC=C1)F Z381785786 [0,2,0,0,0,0|0,0,0]=2 1556 B11R1.24 O=CCCC1=CC=CC(=C1)Cl Z993017744 [0,2,0,0,0,0|1,0,0]=3 1557 B11R1.24 O=CCCC1=CC=CC(=C1)F Z993017622 [0,2,0,0,0,0|1,0,0]=3 1558 B11R1.24 O=CCCC1=CN=CC(=C1)F Z1233207916 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.24 OCCNC1=CC(=CC=C1)F Z335274246 [0,2,0,0,0,0|1,0,0]=3 1560 B11R1.24 OCCOC1=CC(=CC=C1)Br Z335092356 [0,2,0,0,0,0|1,0,0]=3 1561 B11R1.24 OCCOC1=CC(=CC=C1)Cl Z149166432 [0,2,0,0,0,0|1,0,0]=3 1562 B11R1.24 OCCOC1=CC(=CN=C1)Br Z1206893175 [0,2,0,0,0,0|2,0,0]=4 1563 B11R1.34 CC1=CC(=CC(=C1)CC#N)C Z274447884 [0,2,0,0,0,0|0,0,2]=4 1564 B11R1.34 CC1=CC(=CC(=C1)CC=O)C Z993017712 [0,2,0,0,0,0|1,0,1]=4 1565 B11R1.34 CC1=NC(=CC(=C1)CCN)O Z4705455739 [0,2,0,0,0,0|1,0,0]=3 1566 B11R1.34 CC1=NC(=CC(=N1)O)CCN Z5085493722 [0,2,0,0,0,0|2,0,0]=4 1567 B11R1.34 CCCC1=CC(=CC(=C1)O)O Z367653796 [0,2,0,0,0,0|1,0,0]=3 1568 B11R1.34 CCNC1=CC(=CC(=C1)C)C Z744729060 [0,2,0,0,0,0|2,0,0]=4 1569 B11R1.34 CCOC1=CC(=CC(=C1)N)Br Z4655392517 [0,2,0,0,0,0|2,0,0]=4 1570 B11R1.34 CNCC1=CC(=CC(=C1)Cl)Cl Z385447076 [0,2,0,0,0,0|2,0,0]=4 1571 B11R1.34 CNCC1=CC(=CC(=C1)F)Cl Z5510277945 [0,2,0,0,0,0|2,0,0]=4 1572 B11R1.34 N#CCC1=CC(=CC(=C1)F)Br Z1269131322 [0,2,0,0,0,0|0,0,2]=4 1573 B11R1.34 N#CCC1=CC(=CC(=C1)F)F Z820119882 [0,2,0,0,0,0|0,0,2]=4 1574 B11R1.34 N#CCC1=CC(=CC(=C1)O)Br Z1269231080 [0,2,0,0,0,0|0,0,2]=4 1575 B11R1.34 NCCC1=CC(=CC(=C1)Cl)Br Z2792040945 [0,2,0,0,0,0|0,0,0]=2 1576 B11R1.34 NCCC1=CC(=CC(=C1)Cl)Cl Z452428348 [0,2,0,0,0,0|0,0,0]=2 1577 B11R1.34 NCCC1=CC(=CC(=C1)F)Br Z4607596589 [0,2,0,0,0,0|0,0,0]=2 1578 B11R1.34 NCCC1=CC(=CC(=C1)F)F Z905065808 [0,2,0,0,0,0|0,0,0]=2 1579 B11R1.34 NCCC1=CC(=CC(=C1)O)F Z2902196615 [0,2,0,0,0,0|0,0,0]=2 1580 B11R1.34 NCCC1=NC(=NC(=C1)O)N Z5385150450 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.34 NCCC1=NC(=NC(=C1)O)S Z5262227277 [0,2,0,0,0,0|2,0,0]=4 1582 B11R1.34 O=CCC1=CC(=CC(=C1)Cl)Br Z2938772766 [0,2,0,0,0,0|1,0,1]=4 1583 B11R1.34 O=CCC1=CC(=CC(=C1)Cl)Cl Z1198160278 [0,2,0,0,0,0|1,0,1]=4 1584 B11R1.34 OCCC1=CC(=CC(=C1)Br)Br Z1269184216 [0,2,0,0,0,0|1,0,0]=3 1585 B11R1.34 OCCC1=CC(=CC(=C1)Cl)Cl Z1201623278 [0,2,0,0,0,0|1,0,0]=3 1586 B11R1.34 OCCC1=CC(=CC(=C1)O)Cl Z2237647506 [0,2,0,0,0,0|1,0,0]=3 1587 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [0,2,0,0,0,0|1,0,1]=4 1588 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [0,2,0,0,0,0|1,0,1]=4 1589 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [0,2,0,0,0,0|1,0,1]=4 1590 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [0,2,0,0,0,0|1,0,0]=3 1591 B11R1.157 CC(C)CC1=CC(=NC=C1)N Z1197889925 [0,2,0,0,0,0|2,0,0]=4 1592 B11R1.157 CC(C)NC1=CC(=CC=C1)Br Z266469772 [0,2,0,0,0,0|2,0,0]=4 1593 B11R1.157 CC(C)NC1=CC(=CC=C1)F Z266497380 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.157 CC(C)OC1=CC(=CC=C1)Br Z53833977 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.157 CC(C)OC1=CC(=CC=C1)N Z239604760 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [0,2,0,0,0,0|0,0,0]=2 1599 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [0,2,0,0,0,0|0,0,0]=2 1600 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [0,2,0,0,0,0|0,0,0]=2 1601 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [0,2,0,0,0,0|1,0,0]=3 1602 B11R1.157 CC1=CC(=CC=C1)NC(=N)N Z979503154 [0,2,0,0,0,0|1,0,1]=4 1603 B11R1.157 CC1=CC(=CC=C1)NC(=S)N Z56921365 [0,2,0,0,0,0|1,0,1]=4 1604 B11R1.157 CN(C)CC1=CC(=CC=C1)N Z285162888 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [0,2,0,0,0,0|0,0,1]=3 1607 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [0,2,0,0,0,0|0,0,1]=3 1608 B11R1.157 N=C(N)NC1=CC(=CC=C1)Cl Z979503082 [0,2,0,0,0,0|1,0,1]=4 1609 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [0,2,0,0,0,0|0,0,1]=3 1610 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [0,2,0,0,0,0|0,0,1]=3 1611 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [0,2,0,0,0,0|0,0,1]=3 1612 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [0,2,0,0,0,0|1,0,1]=4 1613 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [0,2,0,0,0,0|1,0,1]=4 1614 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [0,2,0,0,0,0|1,0,1]=4 1615 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [0,2,0,0,0,0|1,0,1]=4 1616 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [0,2,0,0,0,0|1,0,1]=4 1617 B11R1.157 NC(=S)NC1=CC(=CC=C1)Br Z111871258 [0,2,0,0,0,0|1,0,1]=4 1618 B11R1.157 NC(=S)NC1=CC(=CC=C1)Cl Z199466968 [0,2,0,0,0,0|1,0,1]=4 1619 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [0,2,0,0,0,0|1,0,1]=4 1620 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [0,2,0,0,0,0|1,0,1]=4 1621 B11R1.157 NC1=CC(=CC=C1)CC(F)F Z4075414750 [0,2,0,0,0,0|1,0,0]=3 1622 B11R1.157 NC1=CC(=CC=C1)OC(F)F Z119989016 [0,2,0,0,0,0|2,0,0]=4 1623 B11R1.157 NC1=CC(=CC=C1)SC(F)F Z1020693248 [0,2,0,0,0,0|2,0,0]=4 1624 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [0,2,0,0,0,0|1,0,1]=4 1625 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [0,2,0,0,0,0|1,0,1]=4 1626 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [0,2,0,0,0,0|1,0,1]=4 1627 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [0,2,0,0,0,0|1,0,1]=4 1628 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [0,2,0,0,0,0|1,0,1]=4 1629 B11R1.157 O=[N+]([O-])CC1=CC(=CC=C1)F Z2181775549 [0,2,0,0,0,0|2,0,0]=4 1630 B11R1.189 C#CC1=CC=CC(=C1)NCC Z334875120 [0,2,0,0,0,0|2,0,0]=4 1631 B11R1.189 C=CCC1=CC(=CC=C1)C=O Z1255375343 [0,2,0,0,0,0|1,0,1]=4 1632 B11R1.189 CCC1=CC(=CC=C1)CNC Z6010478687 [0,2,0,0,0,0|2,0,0]=4 1633 B11R1.189 CCCC1=CC(=CC=C1)C=O Z1216844686 [0,2,0,0,0,0|1,0,0]=3 1634 B11R1.189 CCNC1=CC(=CC=C1)CC Z5510285279 [0,2,0,0,0,0|2,0,0]=4 1635 B11R1.189 CCNC1=CC(=CC=C1)CO Z234896397 [0,2,0,0,0,0|2,0,0]=4 1636 B11R1.189 CCNC1=CC(=CC=C1)OC Z286367386 [0,2,0,0,0,0|2,0,0]=4 1637 B11R1.189 CCOC1=CC(=CC=C1)C#N Z54464104 [0,2,0,0,0,0|2,0,0]=4 1638 B11R1.189 CCOC1=CC(=CC=C1)C=O Z53836051 [0,2,0,0,0,0|2,0,0]=4 1639 B11R1.189 CCOC1=CC(=CC=C1)CN Z239604652 [0,2,0,0,0,0|2,0,0]=4 1640 B11R1.189 CCSC1=CC(=CC=C1)C#N Z1362472509 [0,2,0,0,0,0|2,0,0]=4 1641 B11R1.189 CCSC1=CC(=CC=C1)C=O Z1274324472 [0,2,0,0,0,0|2,0,0]=4 1642 B11R1.189 CNCC1=CC(=CC=C1)C#N Z138108940 [0,2,0,0,0,0|2,0,0]=4 1643 B11R1.189 CNCC1=CC(=CC=C1)OC Z56939284 [0,2,0,0,0,0|2,0,0]=4 1644 B11R1.189 COC1=CC(=CC=C1)CC#N Z285184582 [0,2,0,0,0,0|0,0,2]=4 1645 B11R1.189 COC1=CC(=CC=C1)CCN Z285143778 [0,2,0,0,0,0|0,0,0]=2 1646 B11R1.189 COC1=NC(=CC=C1)CCN Z1139189688 [0,2,0,0,0,0|1,0,0]=3 1647 B11R1.189 COC1=NC(=NC=C1)CCN Z3678332979 [0,2,0,0,0,0|2,0,0]=4 1648 B11R1.189 COC1=NC=CC(=C1)CCN Z2298160753 [0,2,0,0,0,0|1,0,0]=3 1649 B11R1.189 COCC1=CC(=CC=C1)C#N Z295205410 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.189 COCC1=CC(=CC=C1)C=O Z1262327697 [0,2,0,0,0,0|2,0,0]=4 1651 B11R1.189 COCC1=CC(=CC=C1)CN Z240084738 [0,2,0,0,0,0|2,0,0]=4 1652 B11R1.189 COCC1=CC(=CC=C1)CO Z1266889515 [0,2,0,0,0,0|2,0,0]=4 1653 B11R1.189 CSC1=CC(=CC=C1)CCN Z4873760169 [0,2,0,0,0,0|0,0,0]=2 1654 B11R1.189 CSCC1=CC(=CC=C1)C#N Z599630632 [0,2,0,0,0,0|2,0,0]=4 1655 B11R1.189 CSCC1=CC(=CC=C1)CN Z732208422 [0,2,0,0,0,0|2,0,0]=4 1656 B11R1.189 N#CC1=CC=CC(=C1)CCN Z1983080032 [0,2,0,0,0,0|0,0,0]=2 1657 B11R1.189 N#CC1=CC=CC(=N1)CCN Z5211343009 [0,2,0,0,0,0|1,0,0]=3 1658 B11R1.189 N#CCC1=CC(=CC=C1)C#N Z285131398 [0,2,0,0,0,0|0,0,2]=4 1659 B11R1.189 NCCC1=CC(=CC=C1)CO Z4741652081 [0,2,0,0,0,0|0,0,0]=2 1660 B11R1.189 O=CC1=CC=CC(=C1)OCF Z1511895109 [0,2,0,0,0,0|2,0,0]=4 1661 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 Z339435272 [0,2,0,0,0,0|0,0,2]=4 1662 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 Z1079442604 [0,2,0,0,0,0|1,0,1]=4 1663 B11R1.7 CC(C)(CN)C1=CC=CC=C1 Z291234238 [0,2,0,0,0,0|0,0,0]=2 1664 B11R1.7 CC(C)(CN)C1=CN=CC=C1 Z1255424681 [0,2,0,0,0,0|1,0,0]=3 1665 B11R1.7 CC(C)(CO)C1=CC=CC=C1 Z397587218 [0,2,0,0,0,0|1,0,0]=3 1666 B11R1.7 CC(C)(CO)C1=NC=CC=C1 Z1216821531 [0,2,0,0,0,0|2,0,0]=4 1667 B11R1.7 CC(F)(C#N)C1=CC=CC=C1 Z1695669743 [0,2,0,0,0,0|0,0,2]=4 1668 B11R1.7 CC(F)(CN)C1=CC=CC=C1 Z2768234774 [0,2,0,0,0,0|0,0,0]=2 1669 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Z734150992 [0,2,0,0,0,0|1,0,0]=3 1670 B11R1.7 CC(O)(CN)C1=CC=CC=C1 Z979721628 [0,2,0,0,0,0|0,0,0]=2 1671 B11R1.7 CCC(C)(N)C1=CC=CC=C1 Z449373366 [0,2,0,0,0,0|1,0,0]=3 1672 B11R1.7 CCC(C)(O)C1=CC=CC=C1 Z449373348 [0,2,0,0,0,0|1,0,0]=3 1673 B11R1.7 CNC(C)(C)C1=CC=CC=C1 Z991114970 [0,2,0,0,0,0|2,0,0]=4 1674 B11R1.7 N#CC(F)(F)C1=CC=CC=C1 Z228584458 [0,2,0,0,0,0|0,0,2]=4 1675 B11R1.7 NCC(F)(F)C1=CC=CC=C1 Z2168499583 [0,2,0,0,0,0|0,0,0]=2 1676 B11R1.7 NCC(F)(F)C1=NC=CC=C1 Z1198184449 [0,2,0,0,0,0|1,0,0]=3 1677 B11R1.7 O=S(=O)(CCl)C1=CC=CC=C1 Z203881850 [0,2,0,0,0,0|2,0,0]=4 1678 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [0,2,0,0,0,0|1,0,0]=3 1679 B11R1.12 CCC(CC)C1=CC=NC=C1 Z104493650 [0,2,0,0,0,0|2,0,0]=4 1680 B11R1.12 CCC(CN)C1=CC=CC=C1 Z85956799 [0,2,0,0,0,0|0,0,0]=2 1681 B11R1.12 CCC(CO)C1=CC=CC=C1 Z397587442 [0,2,0,0,0,0|1,0,0]=3 1682 B11R1.12 CCC(NC)C1=CC=NC=C1 Z513800486 [0,2,0,0,0,0|2,0,0]=4 1683 B11R1.12 CCN(C#N)C1=CC=CC=C1 Z1374910132 [0,2,0,0,0,0|2,0,0]=4 1684 B11R1.12 CCN(CC)C1=CC=CC=C1 Z57770738 [0,2,0,0,0,0|2,0,0]=4 1685 B11R1.12 CNC(CO)C1=CC=CC=C1 Z734147276 [0,2,0,0,0,0|1,0,0]=3 1686 B11R1.12 COC(CN)C1=CC=CC=C1 Z285139084 [0,2,0,0,0,0|0,0,0]=2 1687 B11R1.12 N#CC(C=O)C1=CC=CC=C1 Z57912400 [0,2,0,0,0,0|0,0,2]=4 1688 B11R1.12 NCC(CO)C1=CC=CC=C1 Z1198168251 [0,2,0,0,0,0|0,0,0]=2 1689 B11R1.12 OCC(CO)C1=CC=CC=C1 Z1255395467 [0,2,0,0,0,0|1,0,0]=3 1690 B11R1.16 C#CCC(O)C1=CC=CC=C1 Z932373338 [0,2,0,0,0,0|1,0,0]=3 1691 B11R1.16 C#CCN(C)C1=CC=CC=C1 Z103708484 [0,2,0,0,0,0|1,0,1]=4 1692 B11R1.16 C=CCC(N)C1=CC=NC=C1 Z1268152401 [0,2,0,0,0,0|2,0,0]=4 1693 B11R1.16 CC(CC#N)C1=CC=CC=C1 Z1251357056 [0,2,0,0,0,0|0,0,1]=3 1694 B11R1.16 CC(CC=O)C1=CC=CC=C1 Z57921394 [0,2,0,0,0,0|1,0,0]=3 1695 B11R1.16 CC(N=C=S)C1=CC=CC=C1 Z57358351 [0,2,0,0,0,0|1,0,1]=4 1696 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [0,2,0,0,0,0|1,0,0]=3 1697 B11R1.16 CCCC(=O)C1=CN=CC=C1 Z513733856 [0,2,0,0,0,0|2,0,0]=4 1698 B11R1.16 CCCC(=O)C1=NC=CC=C1 Z513733774 [0,2,0,0,0,0|2,0,0]=4 1699 B11R1.16 CCCC(N)C1=NC=CC=C1 Z513795928 [0,2,0,0,0,0|2,0,0]=4 1700 B11R1.16 CCCC(O)C1=CC=CC=C1 Z335244704 [0,2,0,0,0,0|1,0,0]=3 1701 B11R1.16 CCNC(C)C1=CC=NC=C1 Z1695709422 [0,2,0,0,0,0|2,0,0]=4 1702 B11R1.16 CCNC(C)C1=CN=CC=C1 Z163548568 [0,2,0,0,0,0|2,0,0]=4 1703 B11R1.16 CCOC(=O)C1=CC=CC=C1 Z53835169 [0,2,0,0,0,0|1,0,1]=4 1704 B11R1.16 CN(CCN)C1=CC=CC=C1 Z154669318 [0,2,0,0,0,0|0,0,0]=2 1705 B11R1.16 CN(CCN)C1=NC=CC=C1 Z3026268353 [0,2,0,0,0,0|1,0,0]=3 1706 B11R1.16 CN(CCO)C1=CC=CC=C1 Z138702688 [0,2,0,0,0,0|1,0,0]=3 1707 B11R1.16 CN(CCO)C1=NC=CC=C1 Z54633859 [0,2,0,0,0,0|2,0,0]=4 1708 B11R1.16 CNCC(C)C1=CC=CC=C1 Z57797325 [0,2,0,0,0,0|0,0,0]=2 1709 B11R1.16 COCC(N)C1=CC=CC=C1 Z271013088 [0,2,0,0,0,0|1,0,0]=3 1710 B11R1.16 CSCC(=O)C1=CC=CC=C1 Z732208586 [0,2,0,0,0,0|1,0,1]=4 1711 B11R1.16 CSCC(N)C1=CC=CC=C1 Z995116260 [0,2,0,0,0,0|1,0,0]=3 1712 B11R1.16 N#CCC(=O)C1=CC=CC=C1 Z56899088 [0,2,0,0,0,0|0,0,2]=4 1713 B11R1.16 N#CCC(N)C1=CC=CC=C1 Z1415893991 [0,2,0,0,0,0|0,0,1]=3 1714 B11R1.16 NC(CCO)C1=CC=CC=C1 Z382816560 [0,2,0,0,0,0|1,0,0]=3 1715 B11R1.16 NCCC(O)C1=CC=CC=C1 Z1020673398 [0,2,0,0,0,0|0,0,0]=2 1716 B11R1.16 NCCS(=O)C1=CC=CC=C1 Z1266854955 [0,2,0,0,0,0|0,0,0]=2 1717 B11R1.16 O=C(CCCl)C1=CC=CC=C1 Z1065610596 [0,2,0,0,0,0|1,0,0]=3 1718 B11R1.16 O=C(NCO)C1=CC=CC=C1 Z56799838 [0,2,0,0,0,0|1,0,1]=4 1719 B11R1.16 O=S(CCCl)C1=CC=CC=C1 Z421771494 [0,2,0,0,0,0|1,0,0]=3 1720 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 Z1255427232 [0,2,0,0,0,0|1,0,0]=3 1721 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 Z1255356297 [0,2,0,0,0,0|1,0,0]=3 1722 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [0,2,0,0,0,0|1,0,1]=4 1723 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [0,2,0,0,0,0|1,0,1]=4 1724 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [0,2,0,0,0,0|0,0,1]=3 1725 B11R1.36 CC(C)C(N)C1=CC=NC=C1 Z513796098 [0,2,0,0,0,0|2,0,0]=4 1726 B11R1.36 CC(C)C(N)C1=NC=CC=C1 Z513795924 [0,2,0,0,0,0|2,0,0]=4 1727 B11R1.36 CC(C)C(O)C1=NC=CC=C1 Z513749462 [0,2,0,0,0,0|2,0,0]=4 1728 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 Z199509008 [0,2,0,0,0,0|1,0,1]=4 1729 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [0,2,0,0,0,0|0,0,0]=2 1730 B11R1.36 CC(N)C(O)C1=CC=NC=C1 Z1263602353 [0,2,0,0,0,0|1,0,0]=3 1731 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [0,2,0,0,0,0|1,0,0]=3 1732 B11R1.36 CN(C(=N)N)C1=CC=CC=C1 Z1269638527 [0,2,0,0,0,0|1,0,1]=4 1733 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [0,2,0,0,0,0|0,0,1]=3 1734 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [0,2,0,0,0,0|0,0,1]=3 1735 B11R1.36 NC(=O)C(N)C1=NC=CC=C1 Z1251358507 [0,2,0,0,0,0|1,0,1]=4 1736 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 Z147647142 [0,2,0,0,0,0|1,0,1]=4 1737 B11R1.36 NC(C1=CC=CC=C1)C(F)F Z2211231766 [0,2,0,0,0,0|1,0,0]=3 1738 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 Z278101784 [0,2,0,0,0,0|1,0,1]=4 1739 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 Z957336528 [0,2,0,0,0,0|1,0,1]=4 1740 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 Z104495824 [0,2,0,0,0,0|1,0,1]=4 1741 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 Z1203161992 [0,2,0,0,0,0|1,0,1]=4 1742 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [0,2,0,0,0,0|1,0,1]=4 1743 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 Z808230894 [0,2,0,0,0,0|1,0,1]=4 1744 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [0,2,0,0,0,0|1,0,1]=4 1745 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [0,2,0,0,0,0|1,0,1]=4 1746 B11R1.28 BrCCCOC1=CC=CC=C1 Z90122132 [0,2,0,0,0,0|1,0,0]=3 1747 B11R1.28 C#CCCOC1=CC=CC=C1 Z1143222703 [0,2,0,0,0,0|1,0,0]=3 1748 B11R1.28 C#CCNCC1=CC=CC=C1 Z2082999436 [0,2,0,0,0,0|1,0,0]=3 1749 B11R1.28 C#CCNCC1=CN=CC=C1 Z90560634 [0,2,0,0,0,0|2,0,0]=4 1750 B11R1.28 C=CCNCC1=CC=CC=C1 Z86135577 [0,2,0,0,0,0|1,0,0]=3 1751 B11R1.28 CCCCCC1=CC=CC=C1 Z199507042 [0,2,0,0,0,0|1,0,0]=3 1752 B11R1.28 CCCCNC1=CC=NC=C1 Z359299136 [0,2,0,0,0,0|2,0,0]=4 1753 B11R1.28 CCCNCC1=CC=CC=C1 Z56946091 [0,2,0,0,0,0|1,0,0]=3 1754 B11R1.28 CCCNCC1=CC=NC=C1 Z3247723488 [0,2,0,0,0,0|2,0,0]=4 1755 B11R1.28 CCCNCC1=CN=CC=C1 Z3247723489 [0,2,0,0,0,0|2,0,0]=4 1756 B11R1.28 CCCNCC1=NC=CC=C1 Z4401052052 [0,2,0,0,0,0|2,0,0]=4 1757 B11R1.28 CCNCCC1=CC=CC=C1 Z444350074 [0,2,0,0,0,0|0,0,0]=2 1758 B11R1.28 CCNCCC1=NC=CC=C1 Z138534138 [0,2,0,0,0,0|1,0,0]=3 1759 B11R1.28 CCOCCC1=CC=CC=C1 Z1198150519 [0,2,0,0,0,0|1,0,0]=3 1760 B11R1.28 CNCCCC1=CC=CC=C1 Z102767020 [0,2,0,0,0,0|0,0,0]=2 1761 B11R1.28 CNCCNC1=NC=CC=C1 Z3033960688 [0,2,0,0,0,0|1,0,0]=3 1762 B11R1.28 CNCCOC1=CC=CC=C1 Z56945505 [0,2,0,0,0,0|0,0,0]=2 1763 B11R1.28 COCCNC1=CC=CC=C1 Z266463556 [0,2,0,0,0,0|1,0,0]=3 1764 B11R1.28 COCCNC1=CC=NC=C1 Z359297138 [0,2,0,0,0,0|2,0,0]=4 1765 B11R1.28 ClCCCOC1=CC=CC=C1 Z275020186 [0,2,0,0,0,0|1,0,0]=3 1766 B11R1.28 ClCCNCC1=CC=CC=C1 Z57158447 [0,2,0,0,0,0|1,0,0]=3 1767 B11R1.28 N#CCCNC1=CC=CC=C1 Z56915949 [0,2,0,0,0,0|0,0,1]=3 1768 B11R1.28 N#CCCOC1=CC=CC=C1 Z54337114 [0,2,0,0,0,0|0,0,1]=3 1769 B11R1.28 N#CCNCC1=CC=CC=C1 Z266079624 [0,2,0,0,0,0|0,0,1]=3 1770 B11R1.28 N#CCNCC1=NC=CC=C1 Z111725574 [0,2,0,0,0,0|1,0,1]=4 1771 B11R1.28 N#CCOCC1=CC=CC=C1 Z295205356 [0,2,0,0,0,0|0,0,1]=3 1772 B11R1.28 N#CCSCC1=CC=CC=C1 Z54337756 [0,2,0,0,0,0|0,0,1]=3 1773 B11R1.28 NCCCCC1=CC=CC=C1 Z2574929438 [0,2,0,0,0,0|0,0,0]=2 1774 B11R1.28 NCCCCC1=CC=NC=C1 Z3234944907 [0,2,0,0,0,0|1,0,0]=3 1775 B11R1.28 NCCCNC1=CC=CC=C1 Z756919512 [0,2,0,0,0,0|0,0,0]=2 1776 B11R1.28 NCCCNC1=CC=NC=C1 Z317257864 [0,2,0,0,0,0|1,0,0]=3 1777 B11R1.28 NCCCNC1=NC=CC=C1 Z234895141 [0,2,0,0,0,0|1,0,0]=3 1778 B11R1.28 NCCCNC1=NC=CC=N1 Z444311056 [0,2,0,0,0,0|2,0,0]=4 1779 B11R1.28 NCCCOC1=CC=CC=C1 Z234895129 [0,2,0,0,0,0|0,0,0]=2 1780 B11R1.28 NCCCOC1=CC=NC=C1 Z976694292 [0,2,0,0,0,0|1,0,0]=3 1781 B11R1.28 NCCCOC1=NC=CC=N1 Z2467687631 [0,2,0,0,0,0|2,0,0]=4 1782 B11R1.28 NCCCSC1=CC=CC=C1 Z262222134 [0,2,0,0,0,0|0,0,0]=2 1783 B11R1.28 NCCCSC1=NC=CC=C1 Z2028214397 [0,2,0,0,0,0|1,0,0]=3 1784 B11R1.28 NCCNCC1=NC=CC=C1 Z600492946 [0,2,0,0,0,0|1,0,0]=3 1785 B11R1.28 NCCOCC1=CC=CC=C1 Z271005946 [0,2,0,0,0,0|0,0,0]=2 1786 B11R1.28 O=CCCCC1=CC=CC=C1 Z993017616 [0,2,0,0,0,0|1,0,0]=3 1787 B11R1.28 O=CCOCC1=CC=CC=C1 Z906195396 [0,2,0,0,0,0|1,0,0]=3 1788 B11R1.28 O=CCSCC1=CC=CC=C1 Z854102762 [0,2,0,0,0,0|1,0,0]=3 1789 B11R1.28 OCCCNC1=CC=CC=C1 Z104584292 [0,2,0,0,0,0|1,0,0]=3 1790 B11R1.28 OCCCNC1=CC=NC=C1 Z359301948 [0,2,0,0,0,0|2,0,0]=4 1791 B11R1.28 OCCCNC1=NC=CC=C1 Z31220937 [0,2,0,0,0,0|2,0,0]=4 1792 B11R1.28 OCCCSC1=CC=CC=C1 Z104650330 [0,2,0,0,0,0|1,0,0]=3 1793 B11R1.28 OCCNCC1=CN=CC=C1 Z90504502 [0,2,0,0,0,0|2,0,0]=4 1794 B11R1.28 OCCOCC1=CC=CC=C1 Z854223062 [0,2,0,0,0,0|1,0,0]=3 1795 B11R1.28 S=C=NCCC1=CC=CC=C1 Z56924472 [0,2,0,0,0,0|0,0,1]=3 1796 B11R1.40 C#CC(=O)CC1=CC=CC=C1 Z1266856334 [0,2,0,0,0,0|1,0,1]=4 1797 B11R1.40 C#CC(N)CC1=CC=CC=C1 Z4167757719 [0,2,0,0,0,0|0,0,0]=2 1798 B11R1.40 CC(C#N)OC1=CC=CC=C1 Z54191740 [0,2,0,0,0,0|0,0,2]=4 1799 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [0,2,0,0,0,0|1,0,0]=3 1800 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [0,2,0,0,0,0|0,0,0]=2 1801 B11R1.40 CC(CN)NC1=CC=CC=C1 Z1198235985 [0,2,0,0,0,0|0,0,0]=2 1802 B11R1.40 CC(CN)OC1=CC=CC=C1 Z1245635737 [0,2,0,0,0,0|0,0,0]=2 1803 B11R1.40 CC(CN)SC1=CC=CC=C1 Z844632804 [0,2,0,0,0,0|0,0,0]=2 1804 B11R1.40 CCC(=O)CC1=CN=CC=C1 Z992407884 [0,2,0,0,0,0|2,0,0]=4 1805 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [0,2,0,0,0,0|0,0,0]=2 1806 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [0,2,0,0,0,0|1,0,0]=3 1807 B11R1.40 CCC(O)CC1=CC=NC=C1 Z992409862 [0,2,0,0,0,0|2,0,0]=4 1808 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [0,2,0,0,0,0|1,0,0]=3 1809 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [0,2,0,0,0,0|1,0,0]=3 1810 B11R1.40 CN(C#N)CC1=CC=CC=C1 Z1255506511 [0,2,0,0,0,0|0,0,2]=4 1811 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [0,2,0,0,0,0|1,0,1]=4 1812 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [0,2,0,0,0,0|1,0,1]=4 1813 B11R1.40 CNC(=S)NC1=CC=CC=C1 Z45796176 [0,2,0,0,0,0|1,0,1]=4 1814 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [0,2,0,0,0,0|1,0,1]=4 1815 B11R1.40 N/C(=N\O)/CC1=NC=CC=C1 Z285132826 [0,2,0,0,0,0|1,0,1]=4 1816 B11R1.40 N=C(NN)NC1=CC=CC=C1 Z2768171754 [0,2,0,0,0,0|1,0,1]=4 1817 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [0,2,0,0,0,0|0,0,0]=2 1818 B11R1.40 NC(CO)CC1=CC=NC=C1 Z1824511267 [0,2,0,0,0,0|1,0,0]=3 1819 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [0,2,0,0,0,0|0,0,0]=2 1820 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [0,2,0,0,0,0|0,0,1]=3 1821 B11R1.40 NCC(=O)NC1=CC=NC=C1 Z1459449301 [0,2,0,0,0,0|1,0,1]=4 1822 B11R1.40 NCC(=O)NC1=NC=CC=C1 Z1459449767 [0,2,0,0,0,0|1,0,1]=4 1823 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [0,2,0,0,0,0|0,0,0]=2 1824 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [0,2,0,0,0,0|0,0,0]=2 1825 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [0,2,0,0,0,0|0,0,0]=2 1826 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [0,2,0,0,0,0|0,0,1]=3 1827 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 Z90123523 [0,2,0,0,0,0|1,0,1]=4 1828 B11R1.40 NNC(=O)NC1=CC=CC=C1 Z56855648 [0,2,0,0,0,0|1,0,1]=4 1829 B11R1.40 NNC(=S)NC1=CC=CC=C1 Z56836896 [0,2,0,0,0,0|1,0,1]=4 1830 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [0,2,0,0,0,0|0,0,0]=2 1831 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [0,2,0,0,0,0|0,0,0]=2 1832 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [0,2,0,0,0,0|1,0,0]=3 1833 B11R1.40 O=C(CCl)NC1=CC=CC=C1 Z56889119 [0,2,0,0,0,0|1,0,1]=4 1834 B11R1.40 O=C(CO)NC1=CC=CC=C1 Z228585444 [0,2,0,0,0,0|1,0,1]=4 1835 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [0,2,0,0,0,0|1,0,1]=4 1836 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [0,2,0,0,0,0|1,0,1]=4 1837 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [0,2,0,0,0,0|1,0,1]=4 1838 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [0,2,0,0,0,0|1,0,0]=3 1839 B11R1.91 CC(C)COC1=CN=CC=C1 Z1606818727 [0,2,0,0,0,0|2,0,0]=4 1840 B11R1.91 CC(C)NCC1=CN=CC=C1 Z90502194 [0,2,0,0,0,0|2,0,0]=4 1841 B11R1.91 CC(C)NCC1=NC=CC=C1 Z90502192 [0,2,0,0,0,0|2,0,0]=4 1842 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [0,2,0,0,0,0|0,0,0]=2 1843 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [0,2,0,0,0,0|0,0,0]=2 1844 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [0,2,0,0,0,0|1,0,0]=3 1845 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [0,2,0,0,0,0|0,0,0]=2 1846 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [0,2,0,0,0,0|0,0,0]=2 1847 B11R1.91 FC(F)SCC1=CC=CC=C1 Z55626056 [0,2,0,0,0,0|1,0,0]=3 1848 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [0,2,0,0,0,0|0,0,0]=2 1849 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [0,2,0,0,0,0|0,0,1]=3 1850 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [0,2,0,0,0,0|0,0,1]=3 1851 B11R1.91 N=C(N)NCC1=CC=NC=C1 Z2723680409 [0,2,0,0,0,0|1,0,1]=4 1852 B11R1.91 N=C(N)NCC1=NC=CC=C1 Z911465258 [0,2,0,0,0,0|1,0,1]=4 1853 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [0,2,0,0,0,0|0,0,1]=3 1854 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [0,2,0,0,0,0|0,0,0]=2 1855 B11R1.91 NC(=O)CCC1=CC=NC=C1 Z1095213378 [0,2,0,0,0,0|1,0,0]=3 1856 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [0,2,0,0,0,0|0,0,1]=3 1857 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [0,2,0,0,0,0|0,0,1]=3 1858 B11R1.91 NC(=O)COC1=CN=CC=C1 Z336080090 [0,2,0,0,0,0|1,0,1]=4 1859 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [0,2,0,0,0,0|0,0,1]=3 1860 B11R1.91 NC(=O)CSC1=CC=NC=C1 Z33546963 [0,2,0,0,0,0|1,0,1]=4 1861 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [0,2,0,0,0,0|0,0,1]=3 1862 B11R1.91 NC(=O)NCC1=CC=NC=C1 Z198194796 [0,2,0,0,0,0|1,0,1]=4 1863 B11R1.91 NC(=O)NCC1=CN=CC=C1 Z57664442 [0,2,0,0,0,0|1,0,1]=4 1864 B11R1.91 NC(=O)NCC1=NC=CC=C1 Z198194794 [0,2,0,0,0,0|1,0,1]=4 1865 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [0,2,0,0,0,0|0,0,1]=3 1866 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [0,2,0,0,0,0|0,0,0]=2 1867 B11R1.91 NC(=S)COC1=CC=CC=C1 Z108595128 [0,2,0,0,0,0|0,0,1]=3 1868 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [0,2,0,0,0,0|0,0,1]=3 1869 B11R1.91 NC(=S)NNC1=CC=CC=C1 Z104483868 [0,2,0,0,0,0|1,0,1]=4 1870 B11R1.91 O=C(O)CCC1=CC=CC=C1 Z57127332 [0,2,0,0,0,0|1,0,0]=3 1871 B11R1.91 O=C(O)CCC1=CC=NC=C1 Z317037982 [0,2,0,0,0,0|2,0,0]=4 1872 B11R1.91 O=C(O)CCC1=CN=CC=C1 Z89264892 [0,2,0,0,0,0|2,0,0]=4 1873 B11R1.91 O=C(O)CCC1=NC=CC=C1 Z317037998 [0,2,0,0,0,0|2,0,0]=4 1874 B11R1.91 O=C(O)CNC1=CC=CC=C1 Z104496210 [0,2,0,0,0,0|1,0,1]=4 1875 B11R1.91 O=C(O)COC1=CC=CC=C1 Z57182011 [0,2,0,0,0,0|1,0,1]=4 1876 B11R1.91 O=C(O)CSC1=CC=CC=C1 Z104484982 [0,2,0,0,0,0|1,0,1]=4 1877 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 Z995234780 [0,2,0,0,0,0|0,0,1]=3 1878 B11R1.91 O=[N+]([O-])CSC1=CC=CC=C1 Z1255375331 [0,2,0,0,0,0|1,0,1]=4 1879 B11R1.91 OB(O)CCC1=CC=CC=C1 Z1147227790 [0,2,0,0,0,0|1,0,0]=3 1880 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 Z89268868 [0,2,0,0,0,0|1,0,0]=3 1881 B11R1.509 NS(=O)(=O)CC1=CN=CC=C1 Z385450900 [0,2,0,0,0,0|2,0,0]=4 1882 B11R1.509 NS(=O)(=O)CC1=NC=CC=C1 Z385450902 [0,2,0,0,0,0|2,0,0]=4 1883 B11R1.509 NS(=O)(=O)NC1=CC=CC=C1 Z1425690842 [0,2,0,0,0,0|2,0,0]=4 1884 B11R1.509 NS(=O)(=O)OC1=CC=CC=C1 Z1255360895 [0,2,0,0,0,0|2,0,0]=4 1885 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 Z190630174 [0,2,0,0,0,0|2,0,0]=4 1886 B11R1.509 O=S(=O)([O-])CC1=CC=CC=C1 Z3206129658 [0,2,0,0,0,0|2,0,0]=4 1887 B9R2.2 C1=CC(=CS1)C2CO2 Z954550900 [0,0,0,1,1,0|2,0,0]=4 1888 B9R2.3 C1=NN2CCNC2=C1 Z1203731545 [0,0,0,1,1,0|2,0,0]=4 1889 B11R2.34 BrC1=CC=C(C=C1)C2CO2 Z278165164 [0,1,0,1,0,0|1,0,0]=3 1890 B11R2.34 BrC1=CC=C(C=C1)[C@@H]2CO2 Z1198177141 [0,1,0,1,0,0|1,0,0]=3 1891 B11R2.34 BrC1=CC=C(C=C1)[C@H]2CO2 Z1198177142 [0,1,0,1,0,0|1,0,0]=3 1892 B11R2.34 BrC1=CN=C(C=C1)C2CC2 Z2943484009 [0,1,0,1,0,0|2,0,0]=4 1893 B11R2.34 CC1=CC=C(C=C1)C2CO2 Z278165170 [0,1,0,1,0,0|1,0,0]=3 1894 B11R2.34 CC1=NC=C(C=C1)C2CO2 Z1504684436 [0,1,0,1,0,0|2,0,0]=4 1895 B11R2.34 ClC1=CC=C(C=C1)C2CO2 Z274971352 [0,1,0,1,0,0|1,0,0]=3 1896 B11R2.34 ClC1=CC=C(C=C1)[C@@H]2CO2 Z1255450845 [0,1,0,1,0,0|1,0,0]=3 1897 B11R2.34 ClC1=CC=C(C=C1)[C@H]2CO2 Z1198173162 [0,1,0,1,0,0|1,0,0]=3 1898 B11R2.34 FC1=CC=C(C=C1)C2CO2 Z238878272 [0,1,0,1,0,0|1,0,0]=3 1899 B11R2.34 FC1=CC=C(C=C1)[C@@H]2CO2 Z1255365381 [0,1,0,1,0,0|1,0,0]=3 1900 B11R2.34 FC1=CC=C(C=C1)[C@H]2CO2 Z1255356921 [0,1,0,1,0,0|1,0,0]=3 1901 B11R2.34 FC1=CN=C(C=C1)C2CO2 Z1575327880 [0,1,0,1,0,0|2,0,0]=4 1902 B11R2.36 BrC1=CC2=C(C=C1)CC=C2 Z1255379634 [0,1,0,1,0,0|1,0,1]=4 1903 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Z359513410 [0,1,0,1,0,0|1,0,0]=3 1904 B11R2.36 BrC1=CC2=C(C=C1)CCN2 Z1267773746 [0,1,0,1,0,0|0,0,0]=2 1905 B11R2.36 BrC1=CC2=C(C=C1)CCO2 Z1198181832 [0,1,0,1,0,0|1,0,0]=3 1906 B11R2.36 BrC1=CC2=C(C=C1)CNC2 Z1694636353 [0,1,0,1,0,0|2,0,0]=4 1907 B11R2.36 BrC1=CC2=C(C=C1)COC2 Z1079162022 [0,1,0,1,0,0|2,0,0]=4 1908 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 Z104489174 [0,1,0,1,0,0|0,0,2]=4 1909 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 Z382822766 [0,1,0,1,0,0|1,0,1]=4 1910 B11R2.36 BrC1=CC2=C(C=C1)NN=C2 Z57192026 [0,1,0,1,0,0|1,0,1]=4 1911 B11R2.36 BrC1=CC2=C(C=C1)NN=N2 Z1198153729 [0,1,0,1,0,0|2,0,0]=4 1912 B11R2.36 BrC1=CC2=C(C=C1)OCC2 Z299596228 [0,1,0,1,0,0|1,0,0]=3 1913 B11R2.36 BrC1=CC2=C(C=C1)OCO2 Z1269199980 [0,1,0,1,0,0|2,0,0]=4 1914 B11R2.36 BrC1=CC2=C(C=CN2)C=C1 Z752239748 [0,1,0,1,0,0|0,0,2]=4 1915 B11R2.36 BrC1=CC2=C(CCC2)N=C1 Z1198182024 [0,1,0,1,0,0|2,0,0]=4 1916 B11R2.36 BrC1=CC2=C(N=C1)NCC2 Z1198169618 [0,1,0,1,0,0|1,0,0]=3 1917 B11R2.36 BrC1=CC2=C(N=C1)OCC2 Z1269230252 [0,1,0,1,0,0|2,0,0]=4 1918 B11R2.36 CC1=CC2=C(C=C1)CCN2 Z1269638555 [0,1,0,1,0,0|0,0,0]=2 1919 B11R2.36 CC1=CC2=C(C=C1)CNC2 Z2238336530 [0,1,0,1,0,0|2,0,0]=4 1920 B11R2.36 CC1=CC2=C(C=C1)N=CN2 Z3234957798 [0,1,0,1,0,0|1,0,1]=4 1921 B11R2.36 CC1=CC2=C(C=C1)NC=C2 Z979311300 [0,1,0,1,0,0|0,0,2]=4 1922 B11R2.36 CC1=CC2=C(C=C1)NCC2 Z235539062 [0,1,0,1,0,0|0,0,0]=2 1923 B11R2.36 CC1=CC2=C(C=C1)NN=C2 Z276614446 [0,1,0,1,0,0|1,0,1]=4 1924 B11R2.36 CC1=CC2=C(C=C1)OCO2 Z1255364672 [0,1,0,1,0,0|2,0,0]=4 1925 B11R2.36 CC1=CC2=C(C=CN2)C=C1 Z384970524 [0,1,0,1,0,0|0,0,2]=4 1926 B11R2.36 CC1=NC=C2CCNC2=C1 Z2651710943 [0,1,0,1,0,0|1,0,0]=3 1927 B11R2.36 ClC1=CC2=C(C=C1)CCC2 Z1198234594 [0,1,0,1,0,0|1,0,0]=3 1928 B11R2.36 ClC1=CC2=C(C=C1)CCN2 Z926915320 [0,1,0,1,0,0|0,0,0]=2 1929 B11R2.36 ClC1=CC2=C(C=C1)CNC2 Z1198319382 [0,1,0,1,0,0|2,0,0]=4 1930 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 Z1095352660 [0,1,0,1,0,0|0,0,2]=4 1931 B11R2.36 ClC1=CC2=C(C=C1)NCC2 Z235537274 [0,1,0,1,0,0|0,0,0]=2 1932 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 Z382723678 [0,1,0,1,0,0|0,0,2]=4 1933 B11R2.36 FC1=CC2=C(C=C1)CCN2 Z440803576 [0,1,0,1,0,0|0,0,0]=2 1934 B11R2.36 FC1=CC2=C(C=C1)CNC2 Z1094758928 [0,1,0,1,0,0|2,0,0]=4 1935 B11R2.36 FC1=CC2=C(C=C1)NC=C2 Z1160902020 [0,1,0,1,0,0|0,0,2]=4 1936 B11R2.36 FC1=CC2=C(C=C1)NN=N2 Z1198154825 [0,1,0,1,0,0|2,0,0]=4 1937 B11R2.36 FC1=CC2=C(C=CN2)C=C1 Z382723676 [0,1,0,1,0,0|0,0,2]=4 1938 B11R2.36 FC1=CC2=C(CCN2)N=C1 Z5452930143 [0,1,0,1,0,0|1,0,0]=3 1939 B11R2.36 FC1=CC2=C(N=C1)NCC2 Z2757597421 [0,1,0,1,0,0|1,0,0]=3 1940 B11R2.36 FC1=CC2=C(N=C1)OCC2 Z2732449946 [0,1,0,1,0,0|2,0,0]=4 1941 B11R2.36 IC1=CC2=C(C=C1)CCC2 Z381540774 [0,1,0,1,0,0|1,0,0]=3 1942 B11R2.36 IC1=CC2=C(C=C1)N=CN2 Z2757552913 [0,1,0,1,0,0|1,0,1]=4 1943 B11R2.36 IC1=CC2=C(C=C1)OCO2 Z381540748 [0,1,0,1,0,0|2,0,0]=4 1944 B11R2.36 NC1=CC2=C(C=C1)C=NN2 Z104500558 [0,1,0,1,0,0|1,0,1]=4 1945 B11R2.36 NC1=CC2=C(C=C1)CCO2 Z1203579091 [0,1,0,1,0,0|1,0,0]=3 1946 B11R2.36 NC1=CC2=C(C=C1)CCS2 Z1198181342 [0,1,0,1,0,0|1,0,0]=3 1947 B11R2.36 NC1=CC2=C(C=C1)CNC2 Z1192340875 [0,1,0,1,0,0|2,0,0]=4 1948 B11R2.36 NC1=CC2=C(C=C1)COC2 Z995041906 [0,1,0,1,0,0|2,0,0]=4 1949 B11R2.36 NC1=CC2=C(C=C1)NC=C2 Z271138340 [0,1,0,1,0,0|0,0,2]=4 1950 B11R2.36 NC1=CC2=C(C=C1)NC=N2 Z1741960823 [0,1,0,1,0,0|1,0,1]=4 1951 B11R2.36 NC1=CC2=C(C=C1)NN=C2 Z319217146 [0,1,0,1,0,0|1,0,1]=4 1952 B11R2.36 NC1=CC2=C(C=CN2)C=C1 Z752239752 [0,1,0,1,0,0|0,0,2]=4 1953 B11R2.36 NC1=NC2=C(C=C1)CCC2 Z1198183883 [0,1,0,1,0,0|2,0,0]=4 1954 B11R2.36 NC1=NC2=C(C=C1)OCC2 Z1203582734 [0,1,0,1,0,0|2,0,0]=4 1955 B11R2.36 O=C1C=C2CCCC2=CN1 Z1255494860 [0,1,0,1,0,0|2,0,0]=4 1956 B11R2.36 O=C1C=CC2=C(N1)CCC2 Z234895263 [0,1,0,1,0,0|2,0,0]=4 1957 B11R2.36 OC1=CC2=C(C=C1)C=NN2 Z1198147845 [0,1,0,1,0,0|1,0,1]=4 1958 B11R2.36 OC1=CC2=C(C=C1)CCN2 Z3241260546 [0,1,0,1,0,0|0,0,0]=2 1959 B11R2.36 OC1=CC2=C(C=C1)CNC2 Z2489383861 [0,1,0,1,0,0|2,0,0]=4 1960 B11R2.36 OC1=CC2=C(C=C1)NC=C2 Z1203162319 [0,1,0,1,0,0|0,0,2]=4 1961 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [0,1,0,1,0,0|1,0,1]=4 1962 B11R2.36 OC1=CC2=C(C=C1)NN=C2 Z1209763128 [0,1,0,1,0,0|1,0,1]=4 1963 B11R2.36 OC1=CC2=C(C=C1)OCC2 Z1198182902 [0,1,0,1,0,0|1,0,0]=3 1964 B11R2.36 OC1=CC2=C(C=C1)OCO2 Z104473678 [0,1,0,1,0,0|2,0,0]=4 1965 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [0,1,0,1,0,0|0,0,2]=4 1966 B11R2.36 OC1=CC2=C(CCC2)N=C1 Z1255498919 [0,1,0,1,0,0|2,0,0]=4 1967 B11R2.36 OC1=CC2=C(N=C1)NCC2 Z2310677431 [0,1,0,1,0,0|1,0,0]=3 1968 B11R2.36 OC1=NC2=C(C=C1)CCN2 Z5351512817 [0,1,0,1,0,0|1,0,0]=3 1969 B11R2.36 SC1=CC2=C(C=C1)OCC2 Z361891428 [0,1,0,1,0,0|1,0,0]=3 1970 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [0,1,0,1,0,0|1,0,1]=4 1971 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [0,1,0,1,0,0|0,0,0]=2 1972 B11R2.10 CC1CC2=C(N1)C=CN=C2 Z1203822742 [0,1,0,1,0,0|1,0,0]=3 1973 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [0,1,0,1,0,0|1,0,0]=3 1974 B11R2.10 ClC1=NC2=C(N1)C=CC=C2 Z276129254 [0,1,0,1,0,0|1,0,1]=4 1975 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [0,1,0,1,0,0|0,0,1]=3 1976 B11R2.10 NC1=NC2=C(N1)C=CC=C2 Z104378302 [0,1,0,1,0,0|1,0,1]=4 1977 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [0,1,0,1,0,0|1,0,1]=4 1978 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [0,1,0,1,0,0|1,0,1]=4 1979 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [0,1,0,1,0,0|0,0,0]=2 1980 B11R2.10 NC1CC2=C(C1)C=NC=C2 Z2238944796 [0,1,0,1,0,0|1,0,0]=3 1981 B11R2.10 NC1CC2=C(C1)N=CC=C2 Z3069017080 [0,1,0,1,0,0|1,0,0]=3 1982 B11R2.10 NC1CC2=C(C1)N=CC=N2 Z4953585301 [0,1,0,1,0,0|2,0,0]=4 1983 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [0,1,0,1,0,0|1,0,1]=4 1984 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [0,1,0,1,0,0|0,0,1]=3 1985 B11R2.10 O=C1CC2=C(N1)C=CC=N2 Z1198159859 [0,1,0,1,0,0|1,0,1]=4 1986 B11R2.10 O=C1NC2=C(N1)C=CC=C2 Z56924489 [0,1,0,1,0,0|1,0,1]=4 1987 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [0,1,0,1,0,0|1,0,1]=4 1988 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [0,1,0,1,0,0|1,0,1]=4 1989 B11R2.10 SC1=NC2=C(N1)C=CC=C2 Z203045044 [0,1,0,1,0,0|1,0,1]=4 1990 B11R2.20 C1=CC2=C(C=C1)CCC=C2 Z237493310 [0,1,0,1,0,0|1,0,0]=3 1991 B11R2.20 C1=CC2=C(C=C1)CNCC2 Z57834231 [0,1,0,1,0,0|0,0,0]=2 1992 B11R2.20 C1=CC2=C(C=C1)COCC2 Z756090080 [0,1,0,1,0,0|1,0,0]=3 1993 B11R2.20 C1=CC2=C(C=C1)CONC2 Z2096086829 [0,1,0,1,0,0|1,0,0]=3 1994 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [0,1,0,1,0,0|1,0,0]=3 1995 B11R2.20 C1=CC2=C(C=C1)OCCN2 Z228584850 [0,1,0,1,0,0|0,0,0]=2 1996 B11R2.20 C1=CC2=C(C=C1)SCCN2 Z56943460 [0,1,0,1,0,0|0,0,0]=2 1997 B11R2.20 C1=CC2=C(C=N1)CCCC2 Z104492180 [0,1,0,1,0,0|2,0,0]=4 1998 B11R2.20 C1=CC2=C(C=N1)CCNC2 Z3243651255 [0,1,0,1,0,0|1,0,0]=3 1999 B11R2.20 C1=CC2=C(C=N1)CNCC2 Z3058791291 [0,1,0,1,0,0|1,0,0]=3 2000 B11R2.20 C1=CC2=C(C=N1)COCC2 Z4394915129 [0,1,0,1,0,0|2,0,0]=4 2001 B11R2.20 C1=CC2=C(C=N1)NCCC2 Z3243651200 [0,1,0,1,0,0|1,0,0]=3 2002 B11R2.20 C1=CC2=C(C=N1)NCCN2 Z1203732990 [0,1,0,1,0,0|1,0,0]=3 2003 B11R2.20 C1=CC2=C(C=N1)NCCO2 Z2217033032 [0,1,0,1,0,0|1,0,0]=3 2004 B11R2.20 C1=CC2=C(CCCC2)N=C1 Z1201617100 [0,1,0,1,0,0|2,0,0]=4 2005 B11R2.20 C1=CC2=C(CCCN2)N=C1 Z212053854 [0,1,0,1,0,0|1,0,0]=3 2006 B11R2.20 C1=CC2=C(CCNC2)N=C1 Z2142036515 [0,1,0,1,0,0|1,0,0]=3 2007 B11R2.20 C1=CC2=C(CCNC2)N=N1 Z3487941028 [0,1,0,1,0,0|2,0,0]=4 2008 B11R2.20 C1=CC2=C(CCSC2)N=C1 Z3492694447 [0,1,0,1,0,0|2,0,0]=4 2009 B11R2.20 C1=CC2=C(N=C1)NCCC2 Z1198176448 [0,1,0,1,0,0|1,0,0]=3 2010 B11R2.20 C1=CC2=C(N=C1)NCCN2 Z1198175971 [0,1,0,1,0,0|1,0,0]=3 2011 B11R2.20 C1=CC2=C(N=C1)OCCN2 Z1201624799 [0,1,0,1,0,0|1,0,0]=3 2012 B11R2.20 C1=NC2=C(CNCC2)N=C1 Z5626910804 [0,1,0,1,0,0|2,0,0]=4 2013 B11R2.20 C1=NC=NC2=C1CCNC2 Z2724335023 [0,1,0,1,0,0|2,0,0]=4 2014 B11R2.20 C1=NC=NC2=C1NCCN2 Z3358604084 [0,1,0,1,0,0|2,0,0]=4 2015 B11R2.55 BrC1=C(C=CC=C1)C2CO2 Z278165218 [0,1,0,1,0,0|1,0,0]=3 2016 B11R2.55 CC1=C(C=CC=C1)C2CO2 Z278165272 [0,1,0,1,0,0|1,0,0]=3 2017 B11R2.55 ClC1=C(C=CC=C1)C2CO2 Z278165192 [0,1,0,1,0,0|1,0,0]=3 2018 B11R2.55 ClC1=C(C=CC=C1)[C@@H]2CO2 Z1575341712 [0,1,0,1,0,0|1,0,0]=3 2019 B11R2.55 ClC1=C(C=CC=C1)[C@H]2CO2 Z1575341825 [0,1,0,1,0,0|1,0,0]=3 2020 B11R2.55 FC1=C(C=CC=C1)C2CO2 Z278165212 [0,1,0,1,0,0|1,0,0]=3 2021 B11R2.55 FC1=C(C=CC=C1)[C@@H]2CO2 Z1575341650 [0,1,0,1,0,0|1,0,0]=3 2022 B11R2.55 NC1=C(C=CC=C1)C2CC2 Z336079888 [0,1,0,1,0,0|1,0,0]=3 2023 B11R2.55 NC1=C(C=CC=N1)C2CC2 Z4496948738 [0,1,0,1,0,0|2,0,0]=4 2024 B11R2.55 NC1=C(C=CN=C1)C2CC2 Z3681316846 [0,1,0,1,0,0|2,0,0]=4 2025 B11R2.55 NC1=C(C=NC=C1)C2CC2 Z4521980438 [0,1,0,1,0,0|2,0,0]=4 2026 B11R2.55 NC1=C(N=CC=C1)C2CC2 Z1521319401 [0,1,0,1,0,0|2,0,0]=4 2027 B11R2.106 BrC1=C2C=CNC2=CC=C1 Z1255488032 [0,1,0,1,0,0|0,0,2]=4 2028 B11R2.106 BrC1=C2C=NNC2=CC=C1 Z952016260 [0,1,0,1,0,0|1,0,1]=4 2029 B11R2.106 BrC1=C2CCNC2=CC=C1 Z1198172382 [0,1,0,1,0,0|0,0,0]=2 2030 B11R2.106 BrC1=C2CNCC2=CC=C1 Z1715153806 [0,1,0,1,0,0|2,0,0]=4 2031 B11R2.106 BrC1=C2COCC2=CC=C1 Z1504682798 [0,1,0,1,0,0|2,0,0]=4 2032 B11R2.106 BrC1=C2N=CNC2=CC=C1 Z1198223652 [0,1,0,1,0,0|1,0,1]=4 2033 B11R2.106 BrC1=C2NCCC2=CC=C1 Z2739025449 [0,1,0,1,0,0|0,0,0]=2 2034 B11R2.106 BrC1=C2NCCC2=CN=C1 Z4898391975 [0,1,0,1,0,0|1,0,0]=3 2035 B11R2.106 BrC1=C2NN=NC2=CC=C1 Z1198320503 [0,1,0,1,0,0|2,0,0]=4 2036 B11R2.106 BrC1=C2OCCC2=CC=C1 Z1198219525 [0,1,0,1,0,0|1,0,0]=3 2037 B11R2.106 BrC1=C2OCOC2=CC=C1 Z1269207841 [0,1,0,1,0,0|2,0,0]=4 2038 B11R2.106 CC1=C2C=CNC2=CC=C1 Z384970526 [0,1,0,1,0,0|0,0,2]=4 2039 B11R2.106 CC1=C2C=NNC2=CC=C1 Z1198166368 [0,1,0,1,0,0|1,0,1]=4 2040 B11R2.106 CC1=C2CCNC2=CC=C1 Z916962812 [0,1,0,1,0,0|0,0,0]=2 2041 B11R2.106 CC1=C2CCNC2=NC=C1 Z1203731311 [0,1,0,1,0,0|1,0,0]=3 2042 B11R2.106 CC1=C2CNCC2=CC=C1 Z3244819771 [0,1,0,1,0,0|2,0,0]=4 2043 B11R2.106 CC1=C2N=NNC2=CC=C1 Z1198147968 [0,1,0,1,0,0|2,0,0]=4 2044 B11R2.106 CC1=C2NC=CC2=CC=C1 Z1171217428 [0,1,0,1,0,0|0,0,2]=4 2045 B11R2.106 CC1=C2NCCC2=CC=C1 Z1331055683 [0,1,0,1,0,0|0,0,0]=2 2046 B11R2.106 ClC1=C2C=CNC2=CC=C1 Z1203162552 [0,1,0,1,0,0|0,0,2]=4 2047 B11R2.106 ClC1=C2C=NNC2=CC=C1 Z1116312852 [0,1,0,1,0,0|1,0,1]=4 2048 B11R2.106 ClC1=C2CCNC2=CC=C1 Z1407007539 [0,1,0,1,0,0|0,0,0]=2 2049 B11R2.106 ClC1=C2CNCC2=CC=C1 Z1198176551 [0,1,0,1,0,0|2,0,0]=4 2050 B11R2.106 ClC1=C2N=CNC2=CC=C1 Z2787257831 [0,1,0,1,0,0|1,0,1]=4 2051 B11R2.106 ClC1=C2N=NNC2=CC=C1 Z3227153221 [0,1,0,1,0,0|2,0,0]=4 2052 B11R2.106 ClC1=C2NCCC2=CC=C1 Z235537094 [0,1,0,1,0,0|0,0,0]=2 2053 B11R2.106 FC1=C2C=CNC2=CC=C1 Z1203161966 [0,1,0,1,0,0|0,0,2]=4 2054 B11R2.106 FC1=C2C=NNC2=CC=C1 Z1198172357 [0,1,0,1,0,0|1,0,1]=4 2055 B11R2.106 FC1=C2CCNC2=CC=C1 Z1688198379 [0,1,0,1,0,0|0,0,0]=2 2056 B11R2.106 FC1=C2N=CNC2=CC=C1 Z1203731926 [0,1,0,1,0,0|1,0,1]=4 2057 B11R2.106 FC1=C2NCCC2=CC=C1 Z235538802 [0,1,0,1,0,0|0,0,0]=2 2058 B11R2.106 IC1=C2CCOC2=NC=C1 Z3247248061 [0,1,0,1,0,0|2,0,0]=4 2059 B11R2.106 IC1=C2N=CNC2=CC=C1 Z4765819468 [0,1,0,1,0,0|1,0,1]=4 2060 B11R2.106 IC1=C2OCOC2=CC=C1 Z1269158268 [0,1,0,1,0,0|2,0,0]=4 2061 B11R2.106 NC1=C2C=CNC2=CC=C1 Z970344664 [0,1,0,1,0,0|0,0,2]=4 2062 B11R2.106 NC1=C2C=NNC2=CC=C1 Z381673574 [0,1,0,1,0,0|1,0,1]=4 2063 B11R2.106 NC1=C2CCCC2=CN=C1 Z3073119330 [0,1,0,1,0,0|2,0,0]=4 2064 B11R2.106 NC1=C2CCOC2=CC=C1 Z1198169532 [0,1,0,1,0,0|1,0,0]=3 2065 B11R2.106 NC1=C2CCOC2=CC=N1 Z2732447796 [0,1,0,1,0,0|2,0,0]=4 2066 B11R2.106 NC1=C2CCOC2=NC=C1 Z1862023680 [0,1,0,1,0,0|2,0,0]=4 2067 B11R2.106 NC1=C2CNCC2=CC=C1 Z3234889976 [0,1,0,1,0,0|2,0,0]=4 2068 B11R2.106 NC1=C2N=CNC2=CC=C1 Z1259162108 [0,1,0,1,0,0|1,0,1]=4 2069 B11R2.106 NC1=C2N=NNC2=CC=C1 Z1198155806 [0,1,0,1,0,0|2,0,0]=4 2070 B11R2.106 NC1=C2NC=CC2=CC=C1 Z1201621605 [0,1,0,1,0,0|0,0,2]=4 2071 B11R2.106 NC1=C2NCCC2=CC=C1 Z1203580163 [0,1,0,1,0,0|0,0,0]=2 2072 B11R2.106 NC1=C2NN=CC2=CC=C1 Z235348069 [0,1,0,1,0,0|1,0,1]=4 2073 B11R2.106 O=C1C=CC=C2N1CCC2 Z1258980489 [0,1,0,1,0,0|2,0,0]=4 2074 B11R2.106 OC1=C2C=CNC2=CC=C1 Z1203730747 [0,1,0,1,0,0|0,0,2]=4 2075 B11R2.106 OC1=C2C=NNC2=CC=C1 Z596251856 [0,1,0,1,0,0|1,0,1]=4 2076 B11R2.106 OC1=C2CCCC2=CC=C1 Z1198149277 [0,1,0,1,0,0|1,0,0]=3 2077 B11R2.106 OC1=C2CCNC2=CC=C1 Z1715153863 [0,1,0,1,0,0|0,0,0]=2 2078 B11R2.106 OC1=C2CCNC2=CC=N1 Z3033557931 [0,1,0,1,0,0|1,0,0]=3 2079 B11R2.106 OC1=C2CCOC2=CC=C1 Z1198181637 [0,1,0,1,0,0|1,0,0]=3 2080 B11R2.106 OC1=C2CNCC2=CC=C1 Z1198279842 [0,1,0,1,0,0|2,0,0]=4 2081 B11R2.106 OC1=C2N=CNC2=CC=C1 Z1198155823 [0,1,0,1,0,0|1,0,1]=4 2082 B11R2.106 OC1=C2NN=NC2=CC=C1 Z1198168465 [0,1,0,1,0,0|2,0,0]=4 2083 B11R2.106 OC1=C2OCCC2=CC=C1 Z1486027488 [0,1,0,1,0,0|1,0,0]=3 2084 B11R2.106 OC1=C2OCOC2=CC=C1 Z409065236 [0,1,0,1,0,0|2,0,0]=4 2085 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [0,1,0,1,0,0|0,0,0]=2 2086 B11R2.35 BrC1=CC(=CC=C1)C2CO2 Z278165168 [0,1,0,1,0,0|1,0,0]=3 2087 B11R2.35 BrC1=CC(=CC=C1)[C@@H]2CO2 Z1575341746 [0,1,0,1,0,0|1,0,0]=3 2088 B11R2.35 BrC1=CC(=CC=C1)[C@H]2CO2 Z1575341859 [0,1,0,1,0,0|1,0,0]=3 2089 B11R2.35 CC1=CC(=CC=C1)C2CO2 Z802853588 [0,1,0,1,0,0|1,0,0]=3 2090 B11R2.35 ClC1=CC(=CC=C1)C2CO2 Z278165232 [0,1,0,1,0,0|1,0,0]=3 2091 B11R2.35 ClC1=CC(=CC=C1)[C@@H]2CO2 Z1255457905 [0,1,0,1,0,0|1,0,0]=3 2092 B11R2.35 ClC1=CC(=NC=C1)C2CC2 Z4714470389 [0,1,0,1,0,0|2,0,0]=4 2093 B11R2.35 ClC1=NC(=CC=C1)C2CO2 Z3271515213 [0,1,0,1,0,0|2,0,0]=4 2094 B11R2.35 FC1=CC(=CC=C1)C2CO2 Z283685748 [0,1,0,1,0,0|1,0,0]=3 2095 B11R2.35 NC1=CC(=CC=C1)C2CC2 Z992239700 [0,1,0,1,0,0|1,0,0]=3 2096 B11R2.35 NC1=CC(=CN=C1)C2CC2 Z4513216590 [0,1,0,1,0,0|2,0,0]=4 2097 B11R2.35 NC1=NC=CC(=C1)C2CC2 Z1255428514 [0,1,0,1,0,0|2,0,0]=4 2098 B11R2.35 O=C1C=COC(=C1)C2CC2 Z4461966095 [0,1,0,1,0,0|2,0,0]=4 2099 B11R2.35 OC1=CC(=CC=C1)C2CC2 Z1198170922 [0,1,0,1,0,0|1,0,0]=3 2100 B11R2.35 OC1=CC(=NC=C1)C2CC2 Z1255493056 [0,1,0,1,0,0|2,0,0]=4 2101 B11R2.1 BrC1=NNC2=C1C=CC=C2 Z56791616 [0,1,0,1,0,0|1,0,1]=4 2102 B11R2.1 CC1=CNC2=C1C=CC=C2 Z415653134 [0,1,0,1,0,0|0,0,2]=4 2103 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [0,1,0,1,0,0|0,0,0]=2 2104 B11R2.1 CC1CNC2=C1C=CN=C2 Z3400245703 [0,1,0,1,0,0|1,0,0]=3 2105 B11R2.1 CC1CNC2=C1N=CC=C2 Z3464420345 [0,1,0,1,0,0|1,0,0]=3 2106 B11R2.1 CC1NCC2=C1C=CC=C2 Z1203731964 [0,1,0,1,0,0|1,0,0]=3 2107 B11R2.1 CN1C=NC2=C1C=CC=C2 Z53833303 [0,1,0,1,0,0|1,0,1]=4 2108 B11R2.1 ClC1=CNC2=C1C=CC=C2 Z1020823312 [0,1,0,1,0,0|0,0,2]=4 2109 B11R2.1 NC1=C2C=CC=CC2=NS1 Z1198161072 [0,1,0,1,0,0|1,0,1]=4 2110 B11R2.1 NC1=NNC2=C1C=CC=C2 Z56820416 [0,1,0,1,0,0|1,0,1]=4 2111 B11R2.1 NC1=NOC2=C1C=CC=C2 Z218760918 [0,1,0,1,0,0|1,0,1]=4 2112 B11R2.1 NC1=NSC2=C1C=CC=C2 Z56774438 [0,1,0,1,0,0|1,0,1]=4 2113 B11R2.1 NC1CCC2=C1C=CC=C2 Z168884748 [0,1,0,1,0,0|0,0,0]=2 2114 B11R2.1 NC1CSC2=C1C=CC=C2 Z431544668 [0,1,0,1,0,0|0,0,0]=2 2115 B11R2.1 NN1C=NC2=C1C=CC=C2 Z99599676 [0,1,0,1,0,0|1,0,1]=4 2116 B11R2.1 NN1N=NC2=C1C=CC=C2 Z56788890 [0,1,0,1,0,0|2,0,0]=4 2117 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 Z1741972748 [0,1,0,1,0,0|0,0,0]=2 2118 B11R2.1 O=C1CCC2=C1C=CC=C2 Z104495974 [0,1,0,1,0,0|1,0,0]=3 2119 B11R2.1 O=C1CCC2=C1C=NC=C2 Z1198181243 [0,1,0,1,0,0|2,0,0]=4 2120 B11R2.1 O=C1COC2=C1C=CC=C2 Z57101103 [0,1,0,1,0,0|1,0,1]=4 2121 B11R2.1 O=C1CSC2=C1C=CC=C2 Z1117911699 [0,1,0,1,0,0|1,0,1]=4 2122 B11R2.1 O=C1NCC2=C1C=CC=C2 Z362519344 [0,1,0,1,0,0|1,0,1]=4 2123 B11R2.1 O=C1NNC2=C1C=CC=C2 Z586248764 [0,1,0,1,0,0|1,0,1]=4 2124 B11R2.1 O=C1OCC2=C1C=CC=C2 Z211309000 [0,1,0,1,0,0|1,0,1]=4 2125 B11R2.1 O=C1SNC2=C1C=CC=C2 Z992282928 [0,1,0,1,0,0|1,0,1]=4 2126 B11R2.1 OB1OCC2=C1C=CC=C2 Z1255356609 [0,1,0,1,0,0|2,0,0]=4 2127 B11R2.1 OC1COC2=C1C=CC=C2 Z1267884639 [0,1,0,1,0,0|1,0,0]=3 2128 B11R2.1 ON1N=NC2=C1C=CC=C2 Z56900935 [0,1,0,1,0,0|2,0,0]=4 2129 B11R2.1 O[C@@H]1CSC2=C1C=CC=C2 Z1438326029 [0,1,0,1,0,0|1,0,0]=3 2130 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [0,1,0,1,0,0|0,0,0]=2 2131 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [0,1,0,1,0,0|0,0,0]=2 2132 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [0,1,0,1,0,0|0,0,0]=2 2133 B11R2.40 CC1(CO1)C2=CC=CC=C2 Z813010616 [0,1,0,1,0,0|1,0,0]=3 2134 B11R2.40 NC1(CC1)C2=CC=CC=C2 Z1262398449 [0,1,0,1,0,0|1,0,0]=3 2135 B11R2.40 NC1(CC1)C2=CC=NC=C2 Z3244521572 [0,1,0,1,0,0|2,0,0]=4 2136 B11R2.40 NC1(CC1)C2=CN=CC=C2 Z3241265434 [0,1,0,1,0,0|2,0,0]=4 2137 B11R2.40 NC1(CC1)C2=NC=CC=C2 Z995042286 [0,1,0,1,0,0|2,0,0]=4 2138 B11R2.239 C1=CC(=NC=N1)C2CNC2 Z3244818217 [0,1,0,1,0,0|2,0,0]=4 2139 B11R2.239 C1=CC=C(C=C1)C2CCN2 Z359510120 [0,1,0,1,0,0|0,0,0]=2 2140 B11R2.238 C1=CC(=CN=C1)NC2CC2 Z1203747527 [0,1,0,1,0,0|2,0,0]=4 2141 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [0,1,0,1,0,0|1,0,0]=3 2142 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [0,1,0,1,0,0|1,0,0]=3 2143 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [0,1,0,1,0,0|1,0,0]=3 2144 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [0,1,0,1,0,0|1,0,0]=3 2145 B7R1.1 CCC1=CC=CO1 Z640169748 [1,0,0,0,1,0|1,0,0]=3 2146 B7R1.1 CCC1=CNC=N1 Z1203731354 [1,0,0,0,1,0|2,0,0]=4 2147 B7R1.1 CCC1=CNN=C1 Z1139192482 [1,0,0,0,1,0|2,0,0]=4 2148 B7R1.1 CCC1=NC=CN1 Z803154382 [1,0,0,0,1,0|2,0,0]=4 2149 B7R1.1 CCC1=NNC=C1 Z1238571110 [1,0,0,0,1,0|2,0,0]=4 2150 B7R1.1 CCN1C=CC=N1 Z600618624 [1,0,0,0,1,0|2,0,0]=4 2151 B7R1.1 CCN1C=CN=C1 Z286789018 [1,0,0,0,1,0|2,0,0]=4 2152 B7R1.1 NCC1=CC=CN1 Z976631692 [1,0,0,0,1,0|1,0,0]=3 2153 B7R1.1 NCC1=CC=CS1 Z104485908 [1,0,0,0,1,0|1,0,0]=3 2154 B7R1.1 NCC1=CC=NO1 Z1964347782 [1,0,0,0,1,0|2,0,0]=4 2155 B7R1.1 NCC1=CC=NS1 Z2310716170 [1,0,0,0,1,0|2,0,0]=4 2156 B7R1.1 NCC1=CN=CN1 Z1250100778 [1,0,0,0,1,0|2,0,0]=4 2157 B7R1.1 NCC1=CNC=C1 Z1203586194 [1,0,0,0,1,0|1,0,0]=3 2158 B7R1.1 NCC1=CNN=C1 Z1198394221 [1,0,0,0,1,0|2,0,0]=4 2159 B7R1.1 NCC1=COC=C1 Z406680098 [1,0,0,0,1,0|1,0,0]=3 2160 B7R1.1 NCC1=CSN=C1 Z2310727787 [1,0,0,0,1,0|2,0,0]=4 2161 B7R1.1 NCC1=NC=CN1 Z1962341939 [1,0,0,0,1,0|2,0,0]=4 2162 B7R1.1 NCC1=NC=CO1 Z4774639311 [1,0,0,0,1,0|2,0,0]=4 2163 B7R1.1 NCC1=NC=CS1 Z1198107502 [1,0,0,0,1,0|2,0,0]=4 2164 B7R1.1 NCC1=NOC=C1 Z802903300 [1,0,0,0,1,0|2,0,0]=4 2165 B7R1.1 OCC1=CC=CO1 Z104472794 [1,0,0,0,1,0|2,0,0]=4 2166 B7R1.1 OCC1=CC=CS1 Z104478586 [1,0,0,0,1,0|2,0,0]=4 2167 B7R1.1 OCC1=COC=C1 Z397587426 [1,0,0,0,1,0|2,0,0]=4