0 B7R1.1 c1cc([nH]c1)C=O AS06197 [1,0,0,0,0,0|1,0,2]=4 1 B9R1.1 CCc1ccc(cc1)Br AS03254 [0,0,0,0,0,1|3,0,0]=4 2 B9R1.1 CCc1ccc(cc1)F AS04424 [0,0,0,0,0,1|3,0,0]=4 3 B9R1.1 CCc1ccc(cc1)I AS02159 [0,0,0,0,0,1|3,0,0]=4 4 B9R1.1 Cc1ccc(cc1)C#N AS03761 [0,0,0,0,0,1|2,0,1]=4 5 B9R1.1 Cc1ccc(cc1)C=O AS02824 [0,0,0,0,0,1|1,0,2]=4 6 B9R1.1 Cc1ccc(cc1)CCl AS00637 [0,0,0,0,0,1|2,0,0]=3 7 B9R1.1 Cc1ccc(cc1)SC AS04302 [0,0,0,0,0,1|3,0,0]=4 8 B9R1.1 Cc1ccc(nc1)C#N AS04709 [0,0,0,0,0,1|2,0,1]=4 9 B9R1.1 c1cc(ccc1CBr)Br AS02044 [0,0,0,0,0,1|3,0,0]=4 10 B9R1.1 c1cc(ccc1CBr)Cl AS02046 [0,0,0,0,0,1|3,0,0]=4 11 B9R1.1 c1cc(ccc1CBr)F AS00664 [0,0,0,0,0,1|3,0,0]=4 12 B9R1.1 c1cc(ccc1CBr)I AS00645 [0,0,0,0,0,1|3,0,0]=4 13 B9R1.1 c1cc(ccc1CCl)Br AS00646 [0,0,0,0,0,1|3,0,0]=4 14 B9R1.1 c1cc(ccc1CCl)F AS00660 [0,0,0,0,0,1|3,0,0]=4 15 B9R1.1 c1cc(ccc1CCl)F AS02054 [0,0,0,0,0,1|3,0,0]=4 16 B9R1.1 c1cc(ccc1CN)Br AS02268 [0,0,0,0,0,1|3,0,0]=4 17 B9R1.1 c1cc(ccc1CN)Br AS03103 [0,0,0,0,0,1|3,0,0]=4 18 B9R1.1 c1cc(ccc1CN)Br AS06970 [0,0,0,0,0,1|3,0,0]=4 19 B9R1.1 c1cc(ccc1CN)Cl AS00379 [0,0,0,0,0,1|3,0,0]=4 20 B9R1.1 c1cc(ccc1CN)Cl AS02689 [0,0,0,0,0,1|3,0,0]=4 21 B9R1.1 c1cc(ccc1CN)F AS00834 [0,0,0,0,0,1|3,0,0]=4 22 B9R1.1 c1cc(ccc1CN)F AS01938 [0,0,0,0,0,1|3,0,0]=4 23 B9R1.1 c1cc(ccc1CN)I AS02223 [0,0,0,0,0,1|3,0,0]=4 24 B9R1.1 c1cc(ccc1CN)I AS02301 [0,0,0,0,0,1|3,0,0]=4 25 B9R1.1 c1cc(ccc1CO)Br AS03954 [0,0,0,0,0,1|2,0,0]=3 26 B9R1.1 c1cc(ccc1CO)Cl AS03965 [0,0,0,0,0,1|2,0,0]=3 27 B9R1.1 c1cc(ccc1CO)F AS03978 [0,0,0,0,0,1|2,0,0]=3 28 B9R1.1 c1cc(ccc1CO)I AS00604 [0,0,0,0,0,1|2,0,0]=3 29 B9R1.1 c1cc(ccc1CO)I AS03987 [0,0,0,0,0,1|2,0,0]=3 30 B9R1.1 c1cc(ccc1CO)N AS00548 [0,0,0,0,0,1|2,0,0]=3 31 B9R1.1 c1cc(ccc1CO)O AS00576 [0,0,0,0,0,1|2,0,0]=3 32 B9R1.2 CCc1cccc(c1)Br AS03253 [0,0,0,0,0,1|3,0,0]=4 33 B9R1.2 CCc1cccc(c1)N AS00465 [0,0,0,0,0,1|3,0,0]=4 34 B9R1.2 CCc1cccc(c1)O AS04468 [0,0,0,0,0,1|3,0,0]=4 35 B9R1.2 Cc1cccc(c1)C#N AS02590 [0,0,0,0,0,1|2,0,1]=4 36 B9R1.2 Cc1cccc(c1)C=O AS02785 [0,0,0,0,0,1|1,0,2]=4 37 B9R1.2 Cc1cccc(c1)CCl AS00628 [0,0,0,0,0,1|2,0,0]=3 38 B9R1.2 Cc1cccc(c1)CF AS05991 [0,0,0,0,0,1|2,0,0]=3 39 B9R1.2 Cc1cccc(c1)CN AS00385 [0,0,0,0,0,1|2,0,0]=3 40 B9R1.2 Cc1cccc(c1)OC AS01016 [0,0,0,0,0,1|3,0,0]=4 41 B9R1.2 Cc1cccc(c1)SC AS04308 [0,0,0,0,0,1|3,0,0]=4 42 B9R1.2 c1cc(cc(c1)Br)CBr AS00624 [0,0,0,0,0,1|3,0,0]=4 43 B9R1.2 c1cc(cc(c1)Br)CN AS02267 [0,0,0,0,0,1|3,0,0]=4 44 B9R1.2 c1cc(cc(c1)Br)CN AS03102 [0,0,0,0,0,1|3,0,0]=4 45 B9R1.2 c1cc(cc(c1)Br)CO AS03953 [0,0,0,0,0,1|2,0,0]=3 46 B9R1.2 c1cc(cc(c1)Cl)CBr AS00001 [0,0,0,0,0,1|3,0,0]=4 47 B9R1.2 c1cc(cc(c1)Cl)CCl AS02066 [0,0,0,0,0,1|3,0,0]=4 48 B9R1.2 c1cc(cc(c1)Cl)CN AS00386 [0,0,0,0,0,1|3,0,0]=4 49 B9R1.2 c1cc(cc(c1)Cl)CN AS02688 [0,0,0,0,0,1|3,0,0]=4 50 B9R1.2 c1cc(cc(c1)Cl)CO AS03964 [0,0,0,0,0,1|2,0,0]=3 51 B9R1.2 c1cc(cc(c1)F)CBr AS00663 [0,0,0,0,0,1|3,0,0]=4 52 B9R1.2 c1cc(cc(c1)F)CCl AS00661 [0,0,0,0,0,1|3,0,0]=4 53 B9R1.2 c1cc(cc(c1)F)CF AS05720 [0,0,0,0,0,1|3,0,0]=4 54 B9R1.2 c1cc(cc(c1)F)CN AS00833 [0,0,0,0,0,1|3,0,0]=4 55 B9R1.2 c1cc(cc(c1)F)CN AS01937 [0,0,0,0,0,1|3,0,0]=4 56 B9R1.2 c1cc(cc(c1)F)CO AS03977 [0,0,0,0,0,1|2,0,0]=3 57 B9R1.2 c1cc(cc(c1)I)CBr AS00643 [0,0,0,0,0,1|3,0,0]=4 58 B9R1.2 c1cc(cc(c1)I)CN AS02222 [0,0,0,0,0,1|3,0,0]=4 59 B9R1.2 c1cc(cc(c1)I)CN AS02300 [0,0,0,0,0,1|3,0,0]=4 60 B9R1.2 c1cc(cc(c1)I)CO AS03986 [0,0,0,0,0,1|2,0,0]=3 61 B9R1.2 c1cc(cc(c1)N)CO AS00403 [0,0,0,0,0,1|2,0,0]=3 62 B9R1.2 c1cc(cc(c1)O)CO AS00159 [0,0,0,0,0,1|2,0,0]=3 63 B9R1.2 c1cc(nc(c1)Br)CO AS04914 [0,0,0,0,0,1|2,0,0]=3 64 B8R1.7 B(c1cccs1)(O)O AS06041 [1,1,0,0,0,0|1,1,0]=4 65 B8R1.8 c1cc(sc1)C=NO AS06778 [1,1,0,0,0,0|0,1,1]=4 66 B8R1.11 c1csc(c1CO)Br AS06498 [1,1,0,0,0,0|2,0,0]=4 67 B10R1.1 Cc1ccc(cc1)CC#N AS01373 [0,1,0,0,0,1|2,0,0]=4 68 B10R1.1 Cc1ccc(cc1)CC#N AS06119 [0,1,0,0,0,1|2,0,0]=4 69 B10R1.1 Cc1ccc(cc1)CCBr AS06761 [0,1,0,0,0,1|2,0,0]=4 70 B10R1.1 Cc1ccc(cc1)CCN AS00487 [0,1,0,0,0,1|2,0,0]=4 71 B10R1.1 Cc1ccc(cc1)CCO AS00590 [0,1,0,0,0,1|1,0,0]=3 72 B10R1.1 c1cc(ccc1CCO)Br AS00568 [0,1,0,0,0,1|2,0,0]=4 73 B10R1.1 c1cc(ccc1CCO)Cl AS06008 [0,1,0,0,0,1|2,0,0]=4 74 B10R1.1 c1cc(ccc1CCO)F AS00589 [0,1,0,0,0,1|2,0,0]=4 75 B10R1.1 c1cc(ccc1CCO)N AS00567 [0,1,0,0,0,1|2,0,0]=4 76 B10R1.1 c1cc(ccc1CCO)O AS00553 [0,1,0,0,0,1|2,0,0]=4 77 B10R1.3 CCc1ccc(cc1)OC AS02574 [0,1,0,0,0,1|2,0,0]=4 78 B10R1.3 COc1ccc(cc1)CCl AS02049 [0,1,0,0,0,1|2,0,0]=4 79 B10R1.3 COc1ccc(cc1)CN AS00371 [0,1,0,0,0,1|2,0,0]=4 80 B10R1.3 CSc1ccc(cc1)CN AS06024 [0,1,0,0,0,1|2,0,0]=4 81 B10R1.3 c1cc(ccc1CBr)CBr AS00653 [0,1,0,0,0,1|2,0,0]=4 82 B10R1.3 c1cc(ccc1CO)CBr AS05951 [0,1,0,0,0,1|1,0,0]=3 83 B10R1.3 c1cc(ccc1CO)CO AS00556 [0,1,0,0,0,1|1,0,0]=3 84 B10R1.13 B(c1ccc(cc1)C)(O)O AS07183 [0,1,0,0,0,1|2,0,0]=4 85 B10R1.13 CC(c1ccc(cc1)Br)O AS03465 [0,1,0,0,0,1|2,0,0]=4 86 B10R1.13 CC(c1ccc(cc1)Cl)O AS02839 [0,1,0,0,0,1|2,0,0]=4 87 B10R1.13 CC(c1ccc(cc1)F)O AS00895 [0,1,0,0,0,1|2,0,0]=4 88 B10R1.13 Cc1ccc(cc1)C(=O)O AS00864 [0,1,0,0,0,1|1,0,1]=4 89 B10R1.25 Cc1cc(ccc1CO)Br AS05952 [0,1,0,0,0,1|2,0,0]=4 90 B10R1.25 Cc1cc(ccc1CO)F AS00602 [0,1,0,0,0,1|2,0,0]=4 91 B10R1.25 Cc1ccc(c(c1)C)CCl AS00710 [0,1,0,0,0,1|2,0,0]=4 92 B10R1.25 c1cc(c(cc1Br)Br)CO AS03971 [0,1,0,0,0,1|2,0,0]=4 93 B10R1.25 c1cc(c(cc1Br)F)CO AS03958 [0,1,0,0,0,1|2,0,0]=4 94 B10R1.25 c1cc(c(cc1Br)N)CO AS01411 [0,1,0,0,0,1|2,0,0]=4 95 B10R1.25 c1cc(c(cc1Br)O)CO AS05949 [0,1,0,0,0,1|2,0,0]=4 96 B10R1.25 c1cc(c(cc1Cl)Cl)CO AS00605 [0,1,0,0,0,1|2,0,0]=4 97 B10R1.25 c1cc(c(cc1Cl)F)CO AS00595 [0,1,0,0,0,1|2,0,0]=4 98 B10R1.25 c1cc(c(cc1F)Br)CO AS03955 [0,1,0,0,0,1|2,0,0]=4 99 B10R1.25 c1cc(c(cc1F)Cl)CO AS03966 [0,1,0,0,0,1|2,0,0]=4 100 B10R1.25 c1cc(c(cc1F)F)CO AS00610 [0,1,0,0,0,1|2,0,0]=4 101 B10R1.176 Cc1ccc(cc1C)CCl AS00712 [0,1,0,0,0,1|2,0,0]=4 102 B10R1.176 Cc1ccc(cc1C)CN AS06971 [0,1,0,0,0,1|2,0,0]=4 103 B10R1.176 Cc1ccc(cc1C)CO AS00594 [0,1,0,0,0,1|1,0,0]=3 104 B10R1.176 Cc1ccc(cc1Cl)CN AS00381 [0,1,0,0,0,1|2,0,0]=4 105 B10R1.176 Cc1ccc(cc1F)CN AS06972 [0,1,0,0,0,1|2,0,0]=4 106 B10R1.176 c1cc(c(cc1CO)Br)Br AS03972 [0,1,0,0,0,1|2,0,0]=4 107 B10R1.176 c1cc(c(cc1CO)Cl)Cl AS00608 [0,1,0,0,0,1|2,0,0]=4 108 B10R1.176 c1cc(c(cc1CO)F)Cl AS03968 [0,1,0,0,0,1|2,0,0]=4 109 B10R1.176 c1cc(c(cc1CO)F)F AS00612 [0,1,0,0,0,1|2,0,0]=4 110 B10R1.176 c1cc(c(cc1CO)O)I AS05984 [0,1,0,0,0,1|2,0,0]=4 111 B10R1.2 Cc1cccc(c1C)CBr AS05971 [0,1,0,0,0,1|2,0,0]=4 112 B10R1.2 Cc1cccc(c1C)CCl AS00713 [0,1,0,0,0,1|2,0,0]=4 113 B10R1.2 Cc1cccc(c1N)CO AS06954 [0,1,0,0,0,1|1,0,0]=3 114 B10R1.2 c1cc(c(c(c1)Cl)Br)CO AS06524 [0,1,0,0,0,1|2,0,0]=4 115 B10R1.2 c1cc(c(c(c1)F)Br)CO AS05945 [0,1,0,0,0,1|2,0,0]=4 116 B10R1.2 c1cc(c(c(c1)F)F)CO AS00614 [0,1,0,0,0,1|2,0,0]=4 117 B10R1.8 Cc1cc(cc(c1)CBr)C AS07240 [0,1,0,0,0,1|2,0,0]=4 118 B10R1.8 Cc1cc(cc(c1)N)CO AS05937 [0,1,0,0,0,1|1,0,0]=3 119 B10R1.8 c1c(cc(cc1Br)Br)CO AS03973 [0,1,0,0,0,1|2,0,0]=4 120 B10R1.8 c1c(cc(cc1Cl)Cl)CO AS00607 [0,1,0,0,0,1|2,0,0]=4 121 B10R1.8 c1c(cc(cc1F)Br)CO AS03957 [0,1,0,0,0,1|2,0,0]=4 122 B10R1.8 c1c(cc(cc1F)Br)CO AS04688 [0,1,0,0,0,1|2,0,0]=4 123 B10R1.8 c1c(cc(cc1F)Cl)CO AS00596 [0,1,0,0,0,1|2,0,0]=4 124 B10R1.8 c1c(cc(cc1F)F)CO AS00611 [0,1,0,0,0,1|2,0,0]=4 125 B10R1.10 COCc1cccc(c1)Br AS03401 [0,1,0,0,0,1|2,0,0]=4 126 B10R1.10 Cc1cccc(c1)CC#N AS01378 [0,1,0,0,0,1|2,0,0]=4 127 B10R1.10 Cc1cccc(c1)CCO AS00588 [0,1,0,0,0,1|1,0,0]=3 128 B10R1.10 c1cc(cc(c1)Br)CCO AS04438 [0,1,0,0,0,1|2,0,0]=4 129 B10R1.10 c1cc(cc(c1)Cl)CCO AS00585 [0,1,0,0,0,1|2,0,0]=4 130 B10R1.10 c1cc(cc(c1)F)CCO AS01801 [0,1,0,0,0,1|2,0,0]=4 131 B10R1.10 c1cc(cc(c1)O)CCO AS06800 [0,1,0,0,0,1|2,0,0]=4 132 B10R1.30 Cc1ccc(c(c1)CCl)C AS00714 [0,1,0,0,0,1|2,0,0]=4 133 B10R1.30 Cc1ccc(c(c1)CO)F AS00597 [0,1,0,0,0,1|1,0,0]=3 134 B10R1.30 c1cc(c(cc1Br)CO)Cl AS04004 [0,1,0,0,0,1|2,0,0]=4 135 B10R1.30 c1cc(c(cc1Br)CO)O AS00554 [0,1,0,0,0,1|2,0,0]=4 136 B10R1.30 c1cc(c(cc1Cl)CO)Br AS00550 [0,1,0,0,0,1|2,0,0]=4 137 B10R1.30 c1cc(c(cc1Cl)CO)Cl AS00609 [0,1,0,0,0,1|2,0,0]=4 138 B10R1.30 c1cc(c(cc1Cl)CO)F AS00564 [0,1,0,0,0,1|2,0,0]=4 139 B10R1.30 c1cc(c(cc1F)CO)Br AS00552 [0,1,0,0,0,1|2,0,0]=4 140 B10R1.30 c1cc(c(cc1F)CO)F AS00616 [0,1,0,0,0,1|2,0,0]=4 141 B10R1.30 c1cc(c(cc1I)CO)Br AS05950 [0,1,0,0,0,1|2,0,0]=4 142 B10R1.30 c1cc(c(cc1N)CO)Cl AS05936 [0,1,0,0,0,1|2,0,0]=4 143 B10R1.113 CC(c1cccc(c1)Br)O AS03464 [0,1,0,0,0,1|2,0,0]=4 144 B10R1.113 CC(c1cccc(c1)Cl)O AS02838 [0,1,0,0,0,1|2,0,0]=4 145 B10R1.113 CC(c1cccc(c1)F)O AS00894 [0,1,0,0,0,1|2,0,0]=4 146 B10R1.113 Cc1cccc(c1)C(=O)O AS00863 [0,1,0,0,0,1|1,0,1]=4 147 B10R1.172 COc1cccc(c1)CCl AS02050 [0,1,0,0,0,1|2,0,0]=4 148 B10R1.172 COc1cccc(c1)CN AS00384 [0,1,0,0,0,1|2,0,0]=4 149 B10R1.172 COc1cccc(c1)CO AS00566 [0,1,0,0,0,1|1,0,0]=3 150 B10R1.172 c1cc(cc(c1)CBr)CBr AS00652 [0,1,0,0,0,1|2,0,0]=4 151 B8R1.2 c1ccc(cc1)CO AS04466 [0,0,1,1,0,0|1,0,1]=4