0 B4R0.1 C#CC(=C)C CNP0599820.0 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C#CC(=O)N CNP0485881.0 [0,0,0,0,0,0|3,0,1]=4 2 B4R0.1 C#CC(=O)O CNP0579203.0 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.1 C=C(Br)CO CNP0506207.0 [0,0,0,0,0,0|2,1,1]=4 4 B4R0.1 C=C(C)C#N CNP0560504.0 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 C=C(C)C=O CNP0479149.0 [0,0,0,0,0,0|3,0,0]=3 6 B4R0.1 C=C(C)CC CNP0605035.0 [0,0,0,0,0,0|3,0,1]=4 7 B4R0.1 C=C(C)CO CNP0505353.0 [0,0,0,0,0,0|3,0,1]=4 8 B4R0.1 C=C(Cl)C#N CNP0518154.0 [0,0,0,0,0,0|2,0,1]=3 9 B4R0.1 C=C(N)C#N CNP0550766.0 [0,0,0,0,0,0|3,0,1]=4 10 B4R0.1 C=C(O)C=O CNP0542377.0 [0,0,0,0,0,0|3,0,0]=3 11 B4R0.1 C=CC(=C)C CNP0489519.0 [0,0,0,0,0,0|3,0,0]=3 12 B4R0.1 C=CC(=N)N CNP0498731.0 [0,0,0,0,0,0|3,0,0]=3 13 B4R0.1 C=CC(=O)C CNP0571315.0 [0,0,0,0,0,0|3,0,0]=3 14 B4R0.1 C=CC(=O)Cl CNP0569586.0 [0,0,0,0,0,0|2,0,0]=2 15 B4R0.1 C=CC(=O)N CNP0574606.0 [0,0,0,0,0,0|3,0,0]=3 16 B4R0.1 C=CC(=O)O CNP0590547.0 [0,0,0,0,0,0|3,0,0]=3 17 B4R0.1 C=CC(=O)[O-] CNP0528918.0 [0,0,0,0,0,0|3,0,0]=3 18 B4R0.1 C=CC(C)C CNP0589769.0 [0,0,0,0,0,0|3,0,1]=4 19 B4R0.1 C=C[C@@H](C)O CNP0512445.2 [0,0,0,0,0,0|3,0,1]=4 20 B4R0.1 C=C[C@H](C)O CNP0512445.1 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 CC(=NO)C CNP0591673.0 [0,0,0,0,0,0|4,0,0]=4 22 B4R0.1 CC(=O)C#N CNP0551952.0 [0,0,0,0,0,0|3,0,1]=4 23 B4R0.1 CC(=O)C=O CNP0574322.0 [0,0,0,0,0,0|3,0,0]=3 24 B4R0.1 CC(=O)CBr CNP0602861.0 [0,0,0,0,0,0|2,1,1]=4 25 B4R0.1 CC(=O)CI CNP0515381.0 [0,0,0,0,0,0|2,1,1]=4 26 B4R0.1 CC(=O)CN CNP0602829.0 [0,0,0,0,0,0|3,0,1]=4 27 B4R0.1 CC(=O)CO CNP0487266.0 [0,0,0,0,0,0|3,0,1]=4 28 B4R0.1 CC(=O)CS CNP0514893.0 [0,0,0,0,0,0|3,0,1]=4 29 B4R0.1 CC(=O)N=N CNP0591627.0 [0,0,0,0,0,0|4,0,0]=4 30 B4R0.1 CC(=O)NN CNP0503904.0 [0,0,0,0,0,0|4,0,0]=4 31 B4R0.1 CC(=O)NO CNP0518042.0 [0,0,0,0,0,0|4,0,0]=4 32 B4R0.1 CC(=O)OO CNP0491052.0 [0,0,0,0,0,0|4,0,0]=4 33 B4R0.1 CC(=O)O[Hg+] CNP0504265.0 [0,0,0,0,0,0|4,0,0]=4 34 B4R0.1 CC(C)C=O CNP0511471.0 [0,0,0,0,0,0|3,0,1]=4 35 B4R0.1 CC(C)C=[17O] CNP0484940.0 [0,0,0,0,0,0|3,0,1]=4 36 B4R0.1 CC(N)C=O CNP0531209.0 [0,0,0,0,0,0|3,0,1]=4 37 B4R0.1 CC=C(C)C CNP0502707.0 [0,0,0,0,0,0|3,0,0]=3 38 B4R0.1 CCC(=N)S CNP0544659.0 [0,0,0,0,0,0|3,0,1]=4 39 B4R0.1 CCC(=O)Br CNP0583620.0 [0,0,0,0,0,0|2,1,1]=4 40 B4R0.1 CCC(=O)C CNP0486447.0 [0,0,0,0,0,0|3,0,1]=4 41 B4R0.1 CCC(=O)Cl CNP0502198.0 [0,0,0,0,0,0|2,0,1]=3 42 B4R0.1 CCC(=O)I CNP0549008.0 [0,0,0,0,0,0|2,1,1]=4 43 B4R0.1 CCC(=O)N CNP0512752.0 [0,0,0,0,0,0|3,0,1]=4 44 B4R0.1 CCC(=O)O CNP0572679.0 [0,0,0,0,0,0|3,0,1]=4 45 B4R0.1 CCC(=O)[O-] CNP0505645.0 [0,0,0,0,0,0|3,0,1]=4 46 B4R0.1 CCC(=O)[O-] CNP0584211.0 [0,0,0,0,0,0|3,0,1]=4 47 B4R0.1 CCC(=O)[O-] CNP0604604.0 [0,0,0,0,0,0|3,0,1]=4 48 B4R0.1 CN(C)C=O CNP0566193.0 [0,0,0,0,0,0|4,0,0]=4 49 B4R0.1 CN(C)C=S CNP0516551.0 [0,0,0,0,0,0|4,0,0]=4 50 B4R0.1 CN(N)C=O CNP0593819.0 [0,0,0,0,0,0|4,0,0]=4 51 B4R0.1 CN(O)C=S CNP0483835.0 [0,0,0,0,0,0|4,0,0]=4 52 B4R0.1 CN=C(N)N CNP0588415.0 [0,0,0,0,0,0|4,0,0]=4 53 B4R0.1 CNC(=N)N CNP0590894.0 [0,0,0,0,0,0|4,0,0]=4 54 B4R0.1 CNC(=O)C CNP0491397.0 [0,0,0,0,0,0|4,0,0]=4 55 B4R0.1 CNC(=O)N CNP0576116.0 [0,0,0,0,0,0|4,0,0]=4 56 B4R0.1 CNC(=O)O CNP0594440.0 [0,0,0,0,0,0|4,0,0]=4 57 B4R0.1 CNC(=S)N CNP0572685.0 [0,0,0,0,0,0|4,0,0]=4 58 B4R0.1 CNC(=S)S CNP0524147.0 [0,0,0,0,0,0|4,0,0]=4 59 B4R0.1 COC(=O)C CNP0578880.0 [0,0,0,0,0,0|4,0,0]=4 60 B4R0.1 COC(=O)N CNP0575874.0 [0,0,0,0,0,0|4,0,0]=4 61 B4R0.1 CSC(=N)N CNP0572889.0 [0,0,0,0,0,0|4,0,0]=4 62 B4R0.1 CSC(=O)C CNP0491622.0 [0,0,0,0,0,0|4,0,0]=4 63 B4R0.1 C[C@@H](Cl)CCl CNP0573757.1 [0,0,0,0,0,0|1,0,2]=3 64 B4R0.1 C[C@@H](O)C=O CNP0482941.1 [0,0,0,0,0,0|3,0,1]=4 65 B4R0.1 C[C@H](O)C=O CNP0482941.2 [0,0,0,0,0,0|3,0,1]=4 66 B4R0.1 C[C](C)C=O CNP0568847.0 [0,0,0,0,0,0|3,0,1]=4 67 B4R0.1 ClC=C(Cl)Cl CNP0539983.0 [0,0,0,0,0,0|0,0,0]=0 68 B4R0.1 ClCC(Cl)Cl CNP0506621.0 [0,0,0,0,0,0|0,0,2]=2 69 B4R0.1 N#C[C@@H](Cl)Br CNP0498573.1 [0,0,0,0,0,0|1,1,2]=4 70 B4R0.1 N=C(N)NN CNP0538712.0 [0,0,0,0,0,0|4,0,0]=4 71 B4R0.1 N=C(N)NO CNP0496900.0 [0,0,0,0,0,0|4,0,0]=4 72 B4R0.1 N=CC(=O)O CNP0521453.0 [0,0,0,0,0,0|3,0,0]=3 73 B4R0.1 NC(=O)CCl CNP0572781.0 [0,0,0,0,0,0|2,0,1]=3 74 B4R0.1 NC(=O)CI CNP0573172.0 [0,0,0,0,0,0|2,1,1]=4 75 B4R0.1 NC(=O)CO CNP0610142.0 [0,0,0,0,0,0|3,0,1]=4 76 B4R0.1 NC(=O)NO CNP0593192.0 [0,0,0,0,0,0|4,0,0]=4 77 B4R0.1 NCC(=O)N CNP0542212.0 [0,0,0,0,0,0|3,0,1]=4 78 B4R0.1 NCC(=O)O CNP0563879.0 [0,0,0,0,0,0|3,0,1]=4 79 B4R0.1 NCC(=O)[O] CNP0605168.0 [0,0,0,0,0,0|3,0,1]=4 80 B4R0.1 NN=C(N)N CNP0609058.0 [0,0,0,0,0,0|4,0,0]=4 81 B4R0.1 NNC(=S)N CNP0493193.0 [0,0,0,0,0,0|4,0,0]=4 82 B4R0.1 O=C(Cl)CCl CNP0491057.0 [0,0,0,0,0,0|1,0,1]=2 83 B4R0.1 O=C(Cl)CI CNP0533753.0 [0,0,0,0,0,0|1,1,1]=3 84 B4R0.1 O=C(Cl)SCl CNP0604698.0 [0,0,0,0,0,0|2,0,0]=2 85 B4R0.1 O=C(O)CBr CNP0605480.0 [0,0,0,0,0,0|2,1,1]=4 86 B4R0.1 O=C(O)CCl CNP0514898.0 [0,0,0,0,0,0|2,0,1]=3 87 B4R0.1 O=C(O)CI CNP0542117.0 [0,0,0,0,0,0|2,1,1]=4 88 B4R0.1 O=C(O)CO CNP0564020.0 [0,0,0,0,0,0|3,0,1]=4 89 B4R0.1 O=C(O)CS CNP0502399.0 [0,0,0,0,0,0|3,0,1]=4 90 B4R0.1 O=CC(=O)O CNP0571230.0 [0,0,0,0,0,0|3,0,0]=3 91 B4R0.1 O=CC(Br)Br CNP0551465.0 [0,0,0,0,0,0|1,2,1]=4 92 B4R0.1 O=CC(Cl)Cl CNP0500598.0 [0,0,0,0,0,0|1,0,1]=2 93 B4R0.1 OCC(Cl)Cl CNP0479097.0 [0,0,0,0,0,0|1,0,2]=3 94 B4R0.1 O[C@@H](Cl)CBr CNP0538567.1 [0,0,0,0,0,0|1,1,2]=4 95 B3R0.1 C#CC=O CNP0511000.0 [1,0,0,0,0,0|2,0,1]=4 96 B3R0.1 C=C=CBr CNP0595246.0 [1,0,0,0,0,0|1,1,1]=4 97 B3R0.1 C=C=CC CNP0584937.0 [1,0,0,0,0,0|2,0,1]=4 98 B3R0.1 C=CC#N CNP0580732.0 [1,0,0,0,0,0|2,0,1]=4 99 B3R0.1 C=CC=C CNP0574781.0 [1,0,0,0,0,0|2,0,0]=3 100 B3R0.1 C=CC=O CNP0603221.0 [1,0,0,0,0,0|2,0,0]=3 101 B3R0.1 C=CC=S CNP0501678.0 [1,0,0,0,0,0|2,0,0]=3 102 B3R0.1 C=CCC CNP0490956.0 [1,0,0,0,0,0|2,0,1]=4 103 B3R0.1 C=CCN CNP0585503.0 [1,0,0,0,0,0|2,0,1]=4 104 B3R0.1 C=CCO CNP0561492.0 [1,0,0,0,0,0|2,0,1]=4 105 B3R0.1 C=CCS CNP0575677.0 [1,0,0,0,0,0|2,0,1]=4 106 B3R0.1 C=COC CNP0611794.0 [1,0,0,0,0,0|3,0,0]=4 107 B3R0.1 CC=CBr CNP0509639.0 [1,0,0,0,0,0|1,1,0]=3 108 B3R0.1 CC=CC CNP0597271.0 [1,0,0,0,0,0|2,0,0]=3 109 B3R0.1 CC=CS CNP0589530.0 [1,0,0,0,0,0|2,0,0]=3 110 B3R0.1 CC=NO CNP0512137.0 [1,0,0,0,0,0|3,0,0]=4 111 B3R0.1 CC=[N+]=[N-] CNP0532727.0 [1,0,0,0,0,0|3,0,0]=4 112 B3R0.1 CCC=O CNP0570013.0 [1,0,0,0,0,0|2,0,1]=4 113 B3R0.1 CCC=S CNP0546828.0 [1,0,0,0,0,0|2,0,1]=4 114 B3R0.1 CNC=O CNP0565671.0 [1,0,0,0,0,0|3,0,0]=4 115 B3R0.1 COC=O CNP0494242.0 [1,0,0,0,0,0|3,0,0]=4 116 B3R0.1 ClC#CCl CNP0502936.0 [1,0,0,0,0,0|0,0,2]=3 117 B3R0.1 ClC=CCl CNP0610334.0 [1,0,0,0,0,0|0,0,0]=1 118 B3R0.1 ClCCBr CNP0493040.0 [1,0,0,0,0,0|0,1,2]=4 119 B3R0.1 ClCCCl CNP0592018.0 [1,0,0,0,0,0|0,0,2]=3 120 B3R0.1 N=CCN CNP0547283.0 [1,0,0,0,0,0|2,0,1]=4 121 B3R0.1 NC=CS CNP0577276.0 [1,0,0,0,0,0|2,0,0]=3 122 B3R0.1 NCC=O CNP0566697.0 [1,0,0,0,0,0|2,0,1]=4 123 B3R0.1 NNC=O CNP0501881.0 [1,0,0,0,0,0|3,0,0]=4 124 B3R0.1 O=CC=O CNP0605189.0 [1,0,0,0,0,0|2,0,0]=3 125 B3R0.1 O=CCBr CNP0516788.0 [1,0,0,0,0,0|1,1,1]=4 126 B3R0.1 O=CCO CNP0600524.0 [1,0,0,0,0,0|2,0,1]=4 127 B3R0.1 O=CCS CNP0591045.0 [1,0,0,0,0,0|2,0,1]=4 128 B3R0.1 OC=CO CNP0508859.0 [1,0,0,0,0,0|2,0,0]=3 129 B3R0.1 OCCCl CNP0532317.0 [1,0,0,0,0,0|1,0,2]=4 130 B3R0.2 C=C(C)C CNP0512482.0 [1,0,0,0,0,0|2,0,0]=3 131 B3R0.2 C=C(C)O CNP0514997.0 [1,0,0,0,0,0|2,0,0]=3 132 B3R0.2 C=C(Cl)Cl CNP0573882.0 [1,0,0,0,0,0|0,0,0]=1 133 B3R0.2 CC(=N)S CNP0537692.0 [1,0,0,0,0,0|2,0,1]=4 134 B3R0.2 CC(=O)C CNP0572494.0 [1,0,0,0,0,0|2,0,1]=4 135 B3R0.2 CC(=O)Cl CNP0537278.0 [1,0,0,0,0,0|1,0,1]=3 136 B3R0.2 CC(=O)N CNP0570171.0 [1,0,0,0,0,0|2,0,1]=4 137 B3R0.2 CC(=O)O CNP0495539.0 [1,0,0,0,0,0|2,0,1]=4 138 B3R0.2 CC(=O)[O-] CNP0505268.0 [1,0,0,0,0,0|2,0,1]=4 139 B3R0.2 CC(=S)N CNP0579768.0 [1,0,0,0,0,0|2,0,1]=4 140 B3R0.2 ClC(Br)Br CNP0573891.0 [1,0,0,0,0,0|0,2,1]=4 141 B3R0.2 ClC(Cl)Br CNP0524174.0 [1,0,0,0,0,0|0,1,1]=3 142 B3R0.2 ClC(Cl)Cl CNP0479643.0 [1,0,0,0,0,0|0,0,1]=2 143 B3R0.2 ClN(Cl)Cl CNP0555840.0 [1,0,0,0,0,0|1,0,0]=2 144 B3R0.2 Cl[111In](Cl)Cl CNP0525709.0 [1,0,0,0,0,0|1,0,0]=2 145 B3R0.2 Cl[Al](Cl)Cl CNP0559880.0 [1,0,0,0,0,0|1,0,0]=2 146 B3R0.2 Cl[C@@H](Br)I CNP0538147.2 [1,0,0,0,0,0|0,2,1]=4 147 B3R0.2 Cl[C@H](Br)I CNP0538147.1 [1,0,0,0,0,0|0,2,1]=4 148 B3R0.2 Cl[Sb](Cl)Cl CNP0508944.0 [1,0,0,0,0,0|1,0,0]=2 149 B3R0.2 N=C(N)N CNP0564001.0 [1,0,0,0,0,0|3,0,0]=4 150 B3R0.2 N=C(N)S CNP0589508.0 [1,0,0,0,0,0|3,0,0]=4 151 B3R0.2 N=C(S)S CNP0522891.0 [1,0,0,0,0,0|3,0,0]=4 152 B3R0.2 NC(=O)N CNP0520286.0 [1,0,0,0,0,0|3,0,0]=4 153 B3R0.2 NC(=O)O CNP0575336.0 [1,0,0,0,0,0|3,0,0]=4 154 B3R0.2 NC(=S)N CNP0599742.0 [1,0,0,0,0,0|3,0,0]=4 155 B3R0.2 NC(=S)S CNP0574797.0 [1,0,0,0,0,0|3,0,0]=4 156 B3R0.2 N[14C](=O)N CNP0600423.0 [1,0,0,0,0,0|3,0,0]=4 157 B3R0.2 O=C(O)O CNP0491655.0 [1,0,0,0,0,0|3,0,0]=4 158 B3R0.2 O=C(O)P CNP0562466.0 [1,0,0,0,0,0|3,0,0]=4 159 B5R0.1 C=C(C)C=CC CNP0348667.0 [0,1,0,0,0,0|3,0,0]=4 160 B5R0.1 C=CC=C(C)C CNP0130651.0 [0,1,0,0,0,0|3,0,0]=4 161 B5R0.1 C=CCC(=O)C CNP0385825.0 [0,1,0,0,0,0|3,0,0]=4 162 B5R0.1 C=CCC(=O)N CNP0292806.0 [0,1,0,0,0,0|3,0,0]=4 163 B5R0.1 C=CCC(=O)O CNP0172155.0 [0,1,0,0,0,0|3,0,0]=4 164 B5R0.1 C=COC(=O)C CNP0003526.0 [0,1,0,0,0,0|3,0,0]=4 165 B5R0.1 CC(=CC#N)C CNP0294715.0 [0,1,0,0,0,0|3,0,0]=4 166 B5R0.1 CC(=CC=O)C CNP0325416.0 [0,1,0,0,0,0|3,0,0]=4 167 B5R0.1 CC(=CCO)C CNP0241702.0 [0,1,0,0,0,0|3,0,0]=4 168 B5R0.1 CC(=CCS)C CNP0262600.0 [0,1,0,0,0,0|3,0,0]=4 169 B5R0.1 CC(=O)C=NO CNP0397193.0 [0,1,0,0,0,0|3,0,0]=4 170 B5R0.1 CC=CC(=N)S CNP0609462.0 [0,1,0,0,0,0|3,0,0]=4 171 B5R0.1 CC=CC(=O)C CNP0158055.0 [0,1,0,0,0,0|3,0,0]=4 172 B5R0.1 CC=CC(=O)Cl CNP0018733.0 [0,1,0,0,0,0|2,0,0]=3 173 B5R0.1 CC=CC(=O)N CNP0376163.0 [0,1,0,0,0,0|3,0,0]=4 174 B5R0.1 CC=CC(=O)O CNP0379669.0 [0,1,0,0,0,0|3,0,0]=4 175 B5R0.1 CC=CC(=O)S CNP0128183.0 [0,1,0,0,0,0|3,0,0]=4 176 B5R0.1 CC=CC(=S)N CNP0219494.0 [0,1,0,0,0,0|3,0,0]=4 177 B5R0.1 CCC=C(C)C CNP0331653.0 [0,1,0,0,0,0|3,0,0]=4 178 B5R0.1 CCC=C(C)O CNP0225775.0 [0,1,0,0,0,0|3,0,0]=4 179 B5R0.1 NC(=O)C=CI CNP0204270.0 [0,1,0,0,0,0|2,1,0]=4 180 B5R0.1 O=C(O)C=CBr CNP0310992.0 [0,1,0,0,0,0|2,1,0]=4 181 B5R0.1 O=C(O)C=CCl CNP0293481.0 [0,1,0,0,0,0|2,0,0]=3 182 B5R0.1 O=C(O)C=CI CNP0239582.0 [0,1,0,0,0,0|2,1,0]=4 183 B5R0.1 O=C(O)C=NO CNP0286362.0 [0,1,0,0,0,0|3,0,0]=4 184 B5R0.1 O=CC=C(Br)Br CNP0270728.0 [0,1,0,0,0,0|1,2,0]=4 185 B5R0.1 O=CCC(=O)O CNP0149091.0 [0,1,0,0,0,0|3,0,0]=4 186 B5R0.3 C=C(C=O)CC CNP0542605.0 [0,1,0,0,0,0|3,0,0]=4 187 B5R0.3 C=CC(=CC)C CNP0134384.0 [0,1,0,0,0,0|3,0,0]=4 188 B5R0.3 C=CC(=O)CC CNP0362181.0 [0,1,0,0,0,0|3,0,0]=4 189 B5R0.3 C=CC(=O)OC CNP0217866.0 [0,1,0,0,0,0|3,0,0]=4 190 B5R0.3 CC=C(C)C=O CNP0281160.0 [0,1,0,0,0,0|3,0,0]=4 191 B5R0.3 CC=C(C)CC CNP0247687.0 [0,1,0,0,0,0|3,0,0]=4 192 B5R0.3 CC=C(C)CO CNP0120418.0 [0,1,0,0,0,0|3,0,0]=4 193 B5R0.3 CCC(=CS)C CNP0025997.0 [0,1,0,0,0,0|3,0,0]=4 194 B5R0.3 CCC(=O)C=O CNP0301331.0 [0,1,0,0,0,0|3,0,0]=4 195 B5R0.3 ClCC(Cl)CCl CNP0159084.0 [0,1,0,0,0,0|0,0,2]=3 196 B5R0.3 O=C(CCl)CBr CNP0149884.0 [0,1,0,0,0,0|1,1,1]=4 197 B5R0.3 O=C(CCl)CCl CNP0301990.0 [0,1,0,0,0,0|1,0,1]=3 198 B5R0.3 O=C(CCl)CI CNP0408833.0 [0,1,0,0,0,0|1,1,1]=4 199 B5R0.3 O=C(CO)CCl CNP0281226.0 [0,1,0,0,0,0|2,0,1]=4 200 B5R0.3 O=CC(=CO)O CNP0278717.0 [0,1,0,0,0,0|3,0,0]=4 201 B5R0.3 OC(CCl)CCl CNP0294183.0 [0,1,0,0,0,0|1,0,2]=4 202 B5R0.3 [O]CC(=O)CCl CNP0505790.0 [0,1,0,0,0,0|2,0,1]=4 203 B5R0.4 O=CC(Cl)(Cl)Cl CNP0323670.0 [0,1,0,0,0,0|1,0,1]=3 204 B5R0.4 OCC(Cl)(Cl)Cl CNP0418010.0 [0,1,0,0,0,0|1,0,2]=4 205 B5R0.5 C=C(C)C(=C)C CNP0186706.0 [0,1,0,0,0,0|3,0,0]=4 206 B5R0.5 C=C(C)C(=O)C CNP0137327.0 [0,1,0,0,0,0|3,0,0]=4 207 B5R0.5 C=C(C)C(=O)Cl CNP0281632.0 [0,1,0,0,0,0|2,0,0]=3 208 B5R0.5 C=C(C)C(=O)N CNP0186369.0 [0,1,0,0,0,0|3,0,0]=4 209 B5R0.5 C=C(C)C(=O)O CNP0147624.0 [0,1,0,0,0,0|3,0,0]=4 210 B5R0.5 C=C(Cl)C(=O)Cl CNP0018136.0 [0,1,0,0,0,0|1,0,0]=2 211 B5R0.5 C=C(Cl)C(=O)N CNP0229491.0 [0,1,0,0,0,0|2,0,0]=3 212 B5R0.5 C=C(Cl)C(=O)O CNP0239649.0 [0,1,0,0,0,0|2,0,0]=3 213 B5R0.5 C=C(N)C(=O)N CNP0591175.0 [0,1,0,0,0,0|3,0,0]=4 214 B5R0.5 C=C(N)C(=O)O CNP0224979.0 [0,1,0,0,0,0|3,0,0]=4 215 B5R0.5 C=C(O)C(=O)O CNP0422136.0 [0,1,0,0,0,0|3,0,0]=4 216 B5R0.5 CC(=C(C)C)C CNP0192659.0 [0,1,0,0,0,0|3,0,0]=4 217 B5R0.5 CC(=C(C)O)C CNP0164530.0 [0,1,0,0,0,0|3,0,0]=4 218 B5R0.5 CC(=N)C(=O)O CNP0556238.0 [0,1,0,0,0,0|3,0,0]=4 219 B5R0.5 CC(=O)C(=O)C CNP0153215.0 [0,1,0,0,0,0|3,0,0]=4 220 B5R0.5 CC(=O)C(=O)N CNP0289593.0 [0,1,0,0,0,0|3,0,0]=4 221 B5R0.5 CC(=O)C(=O)O CNP0269827.0 [0,1,0,0,0,0|3,0,0]=4 222 B5R0.5 CC(C)C(=O)Cl CNP0337045.0 [0,1,0,0,0,0|2,0,1]=4 223 B5R0.5 ClC(=C(Cl)Cl)Cl CNP0108674.0 [0,1,0,0,0,0|0,0,0]=1 224 B5R0.5 ClC(Cl)C(Cl)Cl CNP0311098.0 [0,1,0,0,0,0|0,0,2]=3 225 B5R0.5 NC(=O)C(=O)N CNP0365298.0 [0,1,0,0,0,0|3,0,0]=4 226 B5R0.5 NC(=O)C(=O)O CNP0300477.0 [0,1,0,0,0,0|3,0,0]=4 227 B5R0.5 NC(=O)C(Cl)Cl CNP0516271.0 [0,1,0,0,0,0|1,0,1]=3 228 B5R0.5 NC(=O)[C@@H](Cl)I CNP0321983.1 [0,1,0,0,0,0|1,1,1]=4 229 B5R0.5 O=C(Br)C(=O)Br CNP0244658.0 [0,1,0,0,0,0|1,2,0]=4 230 B5R0.5 O=C(O)C(=O)O CNP0235859.0 [0,1,0,0,0,0|3,0,0]=4 231 B5R0.5 O=C(O)C(Cl)Cl CNP0151680.0 [0,1,0,0,0,0|1,0,1]=3 232 B5R0.5 O=C(O)[C@@H](Cl)Br CNP0017815.1 [0,1,0,0,0,0|1,1,1]=4 233 B5R0.5 O=C(O)[C@@H](Cl)I CNP0145949.2 [0,1,0,0,0,0|1,1,1]=4 234 B5R0.5 O=C(O)[C@H](Cl)I CNP0145949.1 [0,1,0,0,0,0|1,1,1]=4 235 B5R0.5 O=[13C](O)[13C](=O)O CNP0502595.0 [0,1,0,0,0,0|3,0,0]=4 236 B5R1.3 CC=C1CC1 CNP0594561.0 [0,0,0,1,0,0|3,0,0]=4 237 B5R1.5 ClC1(CO1)Cl CNP0513034.0 [0,0,0,1,0,0|1,0,2]=4 238 B2R0.1 C=CBr CNP0609063.0 [2,0,0,0,0,0|0,1,0]=3 239 B2R0.1 C=CC CNP0522895.0 [2,0,0,0,0,0|1,0,0]=3 240 B2R0.1 C=CO CNP0606787.0 [2,0,0,0,0,0|1,0,0]=3 241 B2R0.1 C=C[O] CNP0584213.0 [2,0,0,0,0,0|1,0,0]=3 242 B2R0.1 C=NO CNP0573273.0 [2,0,0,0,0,0|2,0,0]=4 243 B2R0.1 C=[N+]=[N-] CNP0484380.0 [2,0,0,0,0,0|2,0,0]=4 244 B2R0.1 CC=O CNP0566693.0 [2,0,0,0,0,0|1,0,1]=4 245 B2R0.1 CCCl CNP0605324.0 [2,0,0,0,0,0|0,0,2]=4 246 B2R0.1 ClCBr CNP0528283.0 [2,0,0,0,0,0|0,1,1]=4 247 B2R0.1 ClCCl CNP0529345.0 [2,0,0,0,0,0|0,0,1]=3 248 B2R0.1 ClCI CNP0600514.0 [2,0,0,0,0,0|0,1,1]=4 249 B2R0.1 Cl[223Ra]Cl CNP0546854.0 [2,0,0,0,0,0|1,0,0]=3 250 B2R0.1 Cl[Cu]Cl CNP0563720.0 [2,0,0,0,0,0|1,0,0]=3 251 B2R0.1 Cl[Hg]Cl CNP0530716.0 [2,0,0,0,0,0|1,0,0]=3 252 B2R0.1 NC=O CNP0569834.0 [2,0,0,0,0,0|2,0,0]=4 253 B2R0.1 O=CO CNP0494819.0 [2,0,0,0,0,0|2,0,0]=4 254 B2R0.1 O=NCl CNP0485266.0 [2,0,0,0,0,0|2,0,0]=4 255 B2R0.1 [CH-]=CC CNP0546792.0 [2,0,0,0,0,0|1,0,1]=4 256 B4R0.2 C#CC=CC CNP0541501.0 [1,1,0,0,0,0|2,0,0]=4 257 B4R0.2 C=CC=CC CNP0501543.0 [1,1,0,0,0,0|2,0,0]=4 258 B4R0.2 C=CC=NO CNP0532391.0 [1,1,0,0,0,0|2,0,0]=4 259 B4R0.2 C=CCC=C CNP0494589.0 [1,1,0,0,0,0|2,0,0]=4 260 B4R0.2 C=CSC=C CNP0525399.0 [1,1,0,0,0,0|2,0,0]=4 261 B4R0.2 CC=CC#N CNP0588304.0 [1,1,0,0,0,0|2,0,0]=4 262 B4R0.2 CC=CC=O CNP0576575.0 [1,1,0,0,0,0|2,0,0]=4 263 B4R0.2 CC=CCC CNP0524560.0 [1,1,0,0,0,0|2,0,0]=4 264 B4R0.2 CC=CCO CNP0498228.0 [1,1,0,0,0,0|2,0,0]=4 265 B4R0.2 CC=CCS CNP0606069.0 [1,1,0,0,0,0|2,0,0]=4 266 B4R0.2 CC=CSC CNP0587371.0 [1,1,0,0,0,0|2,0,0]=4 267 B4R0.2 CC=CSO CNP0521494.0 [1,1,0,0,0,0|2,0,0]=4 268 B4R0.2 CN=CC=S CNP0547393.0 [1,1,0,0,0,0|2,0,0]=4 269 B4R0.2 ClC=CCCl CNP0530301.0 [1,1,0,0,0,0|0,0,0]=2 270 B4R0.2 O=CC=CCl CNP0542132.0 [1,1,0,0,0,0|1,0,0]=3 271 B4R0.2 O=CCC=O CNP0495847.0 [1,1,0,0,0,0|2,0,0]=4 272 B4R0.2 OCC=CCl CNP0578872.0 [1,1,0,0,0,0|1,0,0]=3 273 B4R0.3 CC(Cl)(Cl)Cl CNP0581486.0 [1,1,0,0,0,0|0,0,1]=3 274 B4R0.3 ClC(Cl)(Cl)Cl CNP0532519.0 [1,1,0,0,0,0|0,0,1]=3 275 B4R0.3 FC(Cl)(Cl)Cl CNP0609082.0 [1,1,0,0,0,0|0,0,1]=3 276 B4R0.3 N[Pt](N)(Cl)Cl CNP0488578.0 [1,1,0,0,0,0|2,0,0]=4 277 B4R0.3 O=P(Cl)(Cl)Cl CNP0574545.0 [1,1,0,0,0,0|1,0,0]=3 278 B6R0.2 CC(=CC(=O)Cl)C CNP0301599.0 [0,2,0,0,0,0|2,0,0]=4 279 B6R0.2 ClC(Cl)C=C(Br)Br CNP0320277.0 [0,2,0,0,0,0|0,1,1]=4 280 B6R0.2 Cl[C@@H](Br)C=C(Br)Br CNP0172086.1 [0,2,0,0,0,0|0,2,0]=4 281 B6R0.2 NC(=O)C=C(Cl)Cl CNP0268623.0 [0,2,0,0,0,0|1,0,0]=3 282 B6R0.2 O=C(Cl)C=C(Br)Br CNP0351146.0 [0,2,0,0,0,0|0,2,0]=4 283 B6R0.2 O=C(Cl)C=C(Cl)Cl CNP0284346.0 [0,2,0,0,0,0|0,0,0]=2 284 B6R0.2 O=C(Cl)CC(=O)Cl CNP0314978.0 [0,2,0,0,0,0|1,0,0]=3 285 B6R0.2 O=C(O)C=C(Cl)Cl CNP0345285.0 [0,2,0,0,0,0|1,0,0]=3 286 B6R0.3 C=C(Cl)C(=O)OC CNP0115457.0 [0,2,0,0,0,0|2,0,0]=4 287 B6R0.3 COC(=O)C(=O)Cl CNP0247015.0 [0,2,0,0,0,0|2,0,0]=4 288 B6R0.3 O=C(CBr)C(Cl)Cl CNP0175070.0 [0,2,0,0,0,0|0,1,1]=4 289 B6R0.3 O=C(CCl)C(Cl)Cl CNP0243162.0 [0,2,0,0,0,0|0,0,1]=3 290 B6R0.3 O=C(CCl)[C@H](Cl)Br CNP0320239.1 [0,2,0,0,0,0|0,1,1]=4 291 B6R0.3 O=C(O)C(=CCl)Cl CNP0278545.0 [0,2,0,0,0,0|1,0,0]=3 292 B6R0.3 OC(CCl)C(Cl)Cl CNP0323730.0 [0,2,0,0,0,0|0,0,2]=4 293 B6R0.5 ON=CC(Cl)(Cl)Cl CNP0236130.0 [0,2,0,0,0,0|1,0,1]=4 294 B6R0.7 NC(=O)C(Cl)(Cl)Cl CNP0023989.0 [0,2,0,0,0,0|1,0,1]=4 295 B6R0.7 O=C(O)C(Cl)(Cl)Cl CNP0083486.0 [0,2,0,0,0,0|1,0,1]=4 296 B4R1.1 C1=COC1 CNP0610072.0 [1,0,0,1,0,0|2,0,0]=4 297 B4R1.2 CC1=CC1 CNP0610335.0 [1,0,0,1,0,0|2,0,0]=4 298 B6R1.9 ClC1OC1(Cl)Cl CNP0339973.0 [0,1,0,1,0,0|0,0,2]=4