0 B10R1.61 BrC1=C(C=CC=C1)B(O)O BP20361 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.61 BrC1=C(C=NC=C1)B(O)O BP20398 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.61 BrC1=C(C=NC=C1)B(O)O BP21804 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.61 BrC1=NC=CC=C1B(O)O BP20100 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.61 BrC=1C=NC=CC1B(O)O BP20399 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.61 CC1=C(C=CC=C1)B(O)O BP20264 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.61 CC1=C(C=NC=C1)B(O)O BP20572 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.61 CC1=NC=CC=C1B(O)O BP21080 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.61 ClC1=C(C=CC=C1)B(O)O BP20128 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.61 ClC1=NC=CC=C1B(O)O BP20119 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.61 ClC=1C=NC=CC1B(O)O BP20446 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.61 FC1=C(C=CC=C1)B(O)O BP20314 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.61 FC1=NC=CC=C1B(O)O BP20308 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.61 FC=1C=NC=CC1B(O)O BP20453 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.61 IC1=C(C=CC=C1)B(O)O BP21024 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.61 NC1=C(C=CC=C1)B(O)O BP21919 [0,0,0,0,0,0|2,0,1]=3 16 B10R1.61 O=C1NC=CC=C1B(O)O BP22576 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.61 OC1=C(C=CC=C1)B(O)O BP20524 [0,0,0,0,0,0|1,0,1]=2 18 B9R1.6 C1(=CC=CC=C1)B(O)O BP20145 [1,0,0,0,0,0|1,0,1]=3 19 B9R1.6 C[C@@H](c1ccncc1)O BP22558 [1,0,0,0,0,0|2,0,1]=4 20 B9R1.6 C[C@H](O)C1=CC=CC=C1 BP22543 [1,0,0,0,0,0|1,0,1]=3 21 B9R1.6 C[C@H](c1ccccc1)O BP22542 [1,0,0,0,0,0|1,0,1]=3 22 B9R1.6 C[C@H](c1ccncc1)O BP22557 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.6 N1=C(C=CC=C1)[C@@H](C)O BP22555 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.6 N1=C(C=CC=C1)[C@H](C)O BP22556 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.6 N1=CC(=CC=C1)B(O)O BP20136 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.6 N1=CC(=CC=C1)B(O)O BP21984 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.6 N1=CC=C(C=C1)B(O)O BP20148 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.53 BrCC1=C(C=CC=C1)B(O)O BP20034 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.53 C(#N)C1=C(C=CC=C1)B(O)O BP20400 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.53 C(=O)C1=C(C=CC=C1)B(O)O BP20311 [0,1,0,0,0,0|1,0,2]=4 31 B11R1.53 C(C)C1=C(C=CC=C1)B(O)O BP20284 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.53 COC1=C(C=CC=C1)B(O)O BP20161 [0,1,0,0,0,0|1,0,1]=3 33 B11R1.53 COC1=NC=CC=C1B(O)O BP20169 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.53 CSC1=C(C=CC=C1)B(O)O BP20266 [0,1,0,0,0,0|1,1,1]=4 35 B11R1.53 OCC1=C(C=CC=C1)B(O)O BP20277 [0,1,0,0,0,0|1,0,1]=3 36 B11R1.156 BrC1=C(C(=CC=C1)Br)B(O)O BP20887 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.156 BrC1=C(C(=CC=C1)Cl)B(O)O BP20873 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.156 BrC1=C(C(=CC=C1)F)B(O)O BP20351 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.156 CC1=C(C(=CC=C1)C)B(O)O BP20078 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.156 ClC1=C(C(=CC=C1)Cl)B(O)O BP20061 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.156 ClC1=C(C(=CC=C1)F)B(O)O BP20430 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.156 ClC1=CC=CC(=C1B(O)O)O BP20763 [0,1,0,0,0,0|1,0,1]=3 43 B11R1.156 FC1=C(C(=CC=C1)F)B(O)O BP20073 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.156 FC1=C(C(=CC=C1)F)C(C)=O BP22332 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.156 FC1=C(C(=CC=C1)I)B(O)O BP20861 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.156 FC1=C(C(=CC=C1)O)B(O)O BP22012 [0,1,0,0,0,0|1,0,1]=3 47 B11R1.159 B(c1cccc(c1C)Cl)(O)O BP20223 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.159 BrC1=C(C=CC=C1F)B(O)O BP21263 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.159 BrC1=C(C=CC=C1I)B(O)O BP21032 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.159 BrC=1C(=C(C=CC1)B(O)O)C BP21172 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.159 BrC=1C(=C(C=CC1)B(O)O)F BP20354 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.159 BrC=1C(=C(C=CC1)B(O)O)O BP22190 [0,1,0,0,0,0|1,0,1]=3 53 B11R1.159 CC1=C(C=CC=C1C)B(O)O BP20071 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.159 ClC1=C(C=CC=C1C)B(O)O BP22443 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.159 ClC1=C(C=CC=C1Cl)B(O)O BP20079 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.159 ClC1=C(C=CC=C1F)B(O)O BP21238 [0,1,0,0,0,0|2,0,1]=4 57 B11R1.159 ClC=1C(=C(C=CC1)B(O)O)F BP20410 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.159 ClC=1C(=C(C=CC1)B(O)O)O BP20720 [0,1,0,0,0,0|1,0,1]=3 59 B11R1.159 FC1=C(C(=O)O)C=CC=C1F BP22328 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.159 FC1=C(C=CC=C1C)B(O)O BP20519 [0,1,0,0,0,0|2,0,1]=4 61 B11R1.159 FC1=C(C=CC=C1F)B(O)O BP20080 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.159 FC1=C(C=CC=C1I)B(O)O BP20499 [0,1,0,0,0,0|2,0,1]=4 63 B11R1.159 FC1=C(C=CC=C1O)B(O)O BP20791 [0,1,0,0,0,0|2,0,1]=4 64 B11R1.159 FC=1C(=C(C=CC1)B(O)O)C BP20771 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.159 FC=1C(=C(C=CC1)B(O)O)O BP20718 [0,1,0,0,0,0|1,0,1]=3 66 B11R1.159 OC1=C(C=CC=C1C)B(O)O BP20719 [0,1,0,0,0,0|1,0,1]=3 67 B11R1.159 OC=1C(=C(C=CC1)B(O)O)C BP21796 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.166 B(c1ccc(cc1C)Br)(O)O BP21464 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.166 B(c1ccc(cc1C)O)(O)O BP20600 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.166 B(c1ccc(cc1O)F)(O)O BP20394 [0,1,0,0,0,0|1,0,1]=3 71 B11R1.166 BrC1=C(C=CC(=C1)Cl)B(O)O BP21482 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.166 BrC1=C(C=CC(=C1)F)B(O)O BP21278 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.166 BrC1=CC(=C(C=C1)B(O)O)Cl BP21041 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.166 BrC1=CC(=C(C=C1)B(O)O)F BP20356 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.166 BrC1=CC(=C(C=C1)B(O)O)O BP21327 [0,1,0,0,0,0|1,0,1]=3 76 B11R1.166 CC1=C(C=CC(=C1)C)B(O)O BP20070 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.166 ClC1=C(C(=O)O)C=CC(=N1)Cl BP22409 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.166 ClC1=C(C=CC(=C1)C)B(O)O BP20127 [0,1,0,0,0,0|2,0,1]=4 79 B11R1.166 ClC1=C(C=CC(=C1)Cl)B(O)O BP20082 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.166 ClC1=C(C=CC(=C1)F)B(O)O BP20007 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.166 ClC1=C(C=CC(=C1)O)B(O)O BP20794 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.166 ClC1=CC(=C(C=C1)B(O)O)C BP20105 [0,1,0,0,0,0|2,0,1]=4 83 B11R1.166 ClC1=CC(=C(C=C1)B(O)O)F BP20104 [0,1,0,0,0,0|2,0,1]=4 84 B11R1.166 FC1=C(C(=O)[O-])C=CC(=C1)F BP22329 [0,1,0,0,0,0|1,0,1]=3 85 B11R1.166 FC1=C(C=CC(=C1)C)B(O)O BP20260 [0,1,0,0,0,0|2,0,1]=4 86 B11R1.166 FC1=C(C=CC(=C1)F)B(O)O BP20083 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.166 FC1=C(C=CC(=C1)O)B(O)O BP21300 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.166 FC1=CC(=C(C=C1)B(O)O)C BP20243 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.166 FC1=NC(=CC=C1C(=O)O)F BP22411 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.166 OC1=C(C=CC(=C1)C)B(O)O BP21712 [0,1,0,0,0,0|1,0,1]=3 91 B11R1.167 B(c1cc(ccc1F)C)(O)O BP20508 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.167 BrC1=C(C=C(C=C1)Br)B(O)O BP20866 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.167 BrC1=C(C=C(C=C1)C)B(O)O BP21633 [0,1,0,0,0,0|2,0,1]=4 94 B11R1.167 BrC1=C(C=C(C=C1)Cl)B(O)O BP22456 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.167 BrC1=C(C=C(C=C1)F)B(O)O BP20872 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.167 BrC=1C=CC(=C(C(=O)O)C1)Cl BP22072 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.167 BrC=1C=CC(=C(C1)B(O)O)C BP21265 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.167 BrC=1C=CC(=C(C1)B(O)O)F BP20350 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.167 BrC=1C=CC(=C(C1)B(O)O)O BP20716 [0,1,0,0,0,0|1,0,1]=3 100 B11R1.167 CC1=C(C=C(C=C1)C)B(O)O BP20060 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.167 ClC1=C(C=C(C=C1)C)B(O)O BP20113 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.167 ClC1=C(C=C(C=C1)Cl)B(O)O BP20057 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.167 ClC1=C(C=C(C=C1)F)B(O)O BP20009 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.167 ClC=1C=CC(=C(C1)B(O)O)C BP20110 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.167 ClC=1C=CC(=C(C1)B(O)O)F BP20417 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.167 ClC=1C=CC(=C(C1)B(O)O)O BP20717 [0,1,0,0,0,0|1,0,1]=3 107 B11R1.167 FC1=C(C(=O)O)C=C(C=C1)F BP22330 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.167 FC1=C(C(=O)[O-])C=C(C=C1)F BP22331 [0,1,0,0,0,0|1,0,1]=3 109 B11R1.167 FC1=C(C=C(C=C1)F)B(O)O BP20058 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.167 FC1=C(C=C(C=C1)I)B(O)O BP20500 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.167 FC1=C(C=C(C=C1)O)B(O)O BP20802 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.167 FC=1C=CC(=C(C1)B(O)O)C BP20259 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.167 FC=1C=CC(=C(C1)B(O)O)O BP20498 [0,1,0,0,0,0|1,0,1]=3 114 B11R1.167 NC=1C=CC(=C(C1)B(O)O)F BP20327 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.167 OC1=C(C=C(C=C1)C)B(O)O BP20712 [0,1,0,0,0,0|1,0,1]=3 116 B11R1.167 OC=1C=CC(=C(C1)B(O)O)C BP20778 [0,1,0,0,0,0|2,0,1]=4 117 B11R2.1 B1(COc2c1cccc2)O BP20599 [0,0,0,1,0,0|2,0,0]=3 118 B8R1.5 BrC1=C(C=CC=C1)I BP22372 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.13 BrC1=CC=C(C=C1)B(O)O BP20201 [1,1,0,0,0,0|1,0,1]=4 120 B10R1.13 BrC1=CC=C(C=C1)[C@@H](C)O BP22550 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.13 BrC1=CC=C(C=C1)[C@H](C)O BP22551 [1,1,0,0,0,0|1,0,1]=4 122 B10R1.13 CC1=CC=C(C=C1)B(O)O BP20156 [1,1,0,0,0,0|1,0,1]=4 123 B10R1.13 CC1=CC=C(C=C1)[S@](=O)N BP22045 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.13 ClC1=CC=C(C=C1)B(O)O BP20108 [1,1,0,0,0,0|1,0,1]=4 125 B10R1.13 FC1=CC=C(C=C1)B(O)O BP20242 [1,1,0,0,0,0|1,0,1]=4 126 B10R1.13 FC1=NC=C(C(=O)O)C=C1 BP22084 [1,1,0,0,0,0|1,0,0]=3 127 B10R1.13 FC1=NC=C(C=C1)C(=O)Cl BP22078 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.13 IC1=CC=C(C=C1)B(O)O BP20532 [1,1,0,0,0,0|1,0,1]=4 129 B10R1.13 NC1=CC=C(C=C1)B(O)O BP20325 [1,1,0,0,0,0|1,0,1]=4 130 B10R1.13 NC1=CC=C(C=C1)B(O)O BP20326 [1,1,0,0,0,0|1,0,1]=4 131 B10R1.13 OC1=CC=C(C=C1)B(O)O BP20255 [1,1,0,0,0,0|1,0,1]=4 132 B10R1.13 OC=1C=CC(=NC1)C(=O)O BP22442 [1,1,0,0,0,0|1,0,0]=3 133 B10R1.13 SC1=CC=C(C=C1)B(O)O BP21861 [1,1,0,0,0,0|1,0,1]=4 134 B10R1.113 BrC=1C=C(C(=O)O)C=CC1 BP22394 [1,1,0,0,0,0|0,0,0]=2 135 B10R1.113 BrC=1C=C(C=CC1)B(O)O BP20197 [1,1,0,0,0,0|1,0,1]=4 136 B10R1.113 CC=1C=C(C=CC1)B(O)O BP20159 [1,1,0,0,0,0|1,0,1]=4 137 B10R1.113 ClC=1C=C(C=CC1)B(O)O BP20133 [1,1,0,0,0,0|1,0,1]=4 138 B10R1.113 FC=1C=C(C=CC1)B(O)O BP20298 [1,1,0,0,0,0|1,0,1]=4 139 B10R1.113 IC=1C=C(C=CC1)B(O)O BP20530 [1,1,0,0,0,0|1,0,1]=4 140 B10R1.113 NC=1C=C(C=CC1)B(O)O BP20023 [1,1,0,0,0,0|1,0,1]=4 141 B10R1.113 NC=1C=C(C=CC1)B(O)O BP20024 [1,1,0,0,0,0|1,0,1]=4 142 B10R1.113 NC=1C=C(C=CC1)B(O)O BP20027 [1,1,0,0,0,0|1,0,1]=4 143 B10R1.113 NC=1C=C(C=CC1)B(O)O BP21863 [1,1,0,0,0,0|1,0,1]=4 144 B10R1.113 OC=1C=C(C=CC1)B(O)O BP20269 [1,1,0,0,0,0|1,0,1]=4 145 B10R1.113 SC=1C=C(C=CC1)B(O)O BP22147 [1,1,0,0,0,0|1,0,1]=4 146 B10R1.2 BrC1=C(C=O)C=CC=C1O BP22091 [1,1,0,0,0,0|1,0,0]=3 147 B10R1.245 BrC1=C(C=O)C(=CC=C1)F BP22404 [1,1,0,0,0,0|1,0,0]=3 148 B12R1.46 BrC=1C=CC(=C(C1)B(O)O)OC BP20353 [0,2,0,0,0,0|1,0,1]=4 149 B12R1.46 COC1=C(C=C(C=C1)C)B(O)O BP20556 [0,2,0,0,0,0|1,0,1]=4 150 B12R1.46 ClC=1C=CC(=C(C1)B(O)O)OC BP20109 [0,2,0,0,0,0|1,0,1]=4 151 B12R1.46 FC=1C=CC(=C(C1)B(O)O)CO BP20944 [0,2,0,0,0,0|1,0,1]=4 152 B12R1.46 FC=1C=CC(=C(C1)B(O)O)OC BP20299 [0,2,0,0,0,0|1,0,1]=4 153 B12R1.46 OC=1C=CC(=C(C1)B(O)O)OC BP20786 [0,2,0,0,0,0|1,0,1]=4 154 B12R1.57 B(c1ccc(cc1OC)Br)(O)O BP20946 [0,2,0,0,0,0|1,0,1]=4 155 B12R1.57 COC1=C(C=CC(=C1)C)B(O)O BP21212 [0,2,0,0,0,0|1,0,1]=4 156 B12R1.57 ClC1=CC(=C(C=C1)B(O)O)OC BP20409 [0,2,0,0,0,0|1,0,1]=4 157 B12R1.57 FC1=CC(=C(C=C1)B(O)O)CO BP22200 [0,2,0,0,0,0|1,0,1]=4 158 B12R1.57 FC1=CC(=C(C=C1)B(O)O)OC BP20507 [0,2,0,0,0,0|1,0,1]=4 159 B12R1.57 OCC1=C(C=CC(=C1)C)B(O)O BP20842 [0,2,0,0,0,0|1,0,1]=4 160 B12R1.87 BrC=1C(=C(C=CC1)B(O)O)OC BP21721 [0,2,0,0,0,0|1,0,1]=4 161 B12R1.87 ClC=1C(=C(C=CC1)B(O)O)CO BP21019 [0,2,0,0,0,0|1,0,1]=4 162 B12R1.87 FC=1C(=C(C=CC1)B(O)O)CO BP21007 [0,2,0,0,0,0|1,0,1]=4 163 B12R1.87 FC=1C(=C(C=CC1)B(O)O)OC BP20505 [0,2,0,0,0,0|1,0,1]=4 164 B12R1.87 OC=1C(=C(C=CC1)B(O)O)OC BP21819 [0,2,0,0,0,0|1,0,1]=4 165 B12R1.261 C(=O)(O)C1=C(C=CC=C1)B(O)O BP20125 [0,2,0,0,0,0|0,0,0]=2 166 B12R1.261 C(C)(=O)C1=C(C=CC=C1)B(O)O BP20019 [0,2,0,0,0,0|1,0,0]=3 167 B12R1.261 NC(=O)C1=C(C=CC=C1)B(O)O BP20018 [0,2,0,0,0,0|1,0,0]=3 168 B12R1.261 [N+](=O)([O-])C1=C(C=CC=C1)B(O)O BP22140 [0,2,0,0,0,0|1,0,1]=4 169 B12R1.283 C(C)OC1=C(C=CC=C1)B(O)O BP20289 [0,2,0,0,0,0|1,0,1]=4 170 B12R1.283 COCC1=C(C=CC=C1)B(O)O BP20561 [0,2,0,0,0,0|1,0,1]=4 171 B12R1.437 FC1=C(C(=CC=C1)OC)B(O)O BP20237 [0,2,0,0,0,0|1,0,1]=4 172 B12R1.511 FC=1C(=C(C=C(C1)F)B(O)O)O BP20701 [0,2,0,0,0,0|1,0,1]=4 173 B12R1.893 FC1=C(C(=O)O)C=CC(=C1F)F BP22338 [0,2,0,0,0,0|1,0,0]=3 174 B12R1.893 FC1=C(C(=O)[O-])C=CC(=C1F)F BP22339 [0,2,0,0,0,0|1,0,1]=4 175 B12R1.232 FC1=C(C(=O)O)C=C(C(=C1)F)F BP22340 [0,2,0,0,0,0|1,0,0]=3 176 B10R2.6 C1(=CC=CC=C1)[C@@H]2OC2 BP22549 [1,0,0,1,0,0|1,0,1]=4 177 B10R2.6 C1[C@@H](C2=CC=CC=C2)O1 BP22548 [1,0,0,1,0,0|1,0,1]=4 178 B10R2.7 O1BOC2=C1C=CC=C2 BP22511 [1,0,0,1,0,0|2,0,0]=4