0 B8R1.3 BrC1=CC=C(C=C1)Br CNP0468033.0 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.3 C=C1C=CC(=O)C=C1 CNP0610154.0 [0,0,0,0,0,0|0,0,2]=2 2 B8R1.3 CC1=CC=C(C=C1)Br CNP0372052.0 [0,0,0,0,0,0|1,0,0]=1 3 B8R1.3 CC1=CC=C(C=C1)C CNP0227482.0 [0,0,0,0,0,0|1,0,0]=1 4 B8R1.3 CC1=CC=C(C=C1)Cl CNP0177290.0 [0,0,0,0,0,0|1,0,0]=1 5 B8R1.3 CC1=CC=C(C=C1)N CNP0232157.0 [0,0,0,0,0,0|1,0,0]=1 6 B8R1.3 CC1=CC=C(C=C1)O CNP0267550.0 [0,0,0,0,0,0|0,0,0]=0 7 B8R1.3 CC1=CC=C(C=C1)S CNP0315228.0 [0,0,0,0,0,0|0,1,0]=1 8 B8R1.3 CC1=CC=C(C=N1)N CNP0257052.0 [0,0,0,0,0,0|2,0,0]=2 9 B8R1.3 CC1=CC=C(C=N1)O CNP0164492.0 [0,0,0,0,0,0|1,0,0]=1 10 B8R1.3 CC1=CC=C(N=C1)C CNP0244329.0 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.3 CC1=CC=C(N=C1)N CNP0531563.0 [0,0,0,0,0,0|2,0,0]=2 12 B8R1.3 CC1=CC=C(N=C1)O CNP0541416.0 [0,0,0,0,0,0|1,0,0]=1 13 B8R1.3 CC1=CC=C([NH+]=C1)N CNP0549835.0 [0,0,0,0,0,0|2,0,0]=2 14 B8R1.3 CC1=CCC(=O)CC1 CNP0134778.0 [0,0,0,0,0,0|0,0,4]=4 15 B8R1.3 CC1=CN=C(C=N1)C CNP0257272.0 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.3 CC1=CNC(=O)C=C1 CNP0085670.0 [0,0,0,0,0,0|1,0,1]=2 17 B8R1.3 CN1C=CC(=N)C=C1 CNP0407521.0 [0,0,0,0,0,0|2,0,0]=2 18 B8R1.3 ClC1=CC=C(C=C1)Cl CNP0341270.0 [0,0,0,0,0,0|2,0,0]=2 19 B8R1.3 NC1=CC=C(C=C1)Br CNP0044742.0 [0,0,0,0,0,0|2,0,0]=2 20 B8R1.3 NC1=CC=C(C=C1)I CNP0290133.0 [0,0,0,0,0,0|2,0,0]=2 21 B8R1.3 NC1=CC=C(C=C1)N CNP0208924.0 [0,0,0,0,0,0|2,0,0]=2 22 B8R1.3 NC1=CC=C(C=C1)O CNP0149529.0 [0,0,0,0,0,0|1,0,0]=1 23 B8R1.3 NC1=CC=C(C=N1)Br CNP0213494.0 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.3 NC1=CC=C(C=N1)Cl CNP0022545.0 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.3 NC1=CC=C(C=N1)I CNP0047532.0 [0,0,0,0,0,0|3,0,0]=3 26 B8R1.3 O=C1C=CC(=CN1)O CNP0491283.0 [0,0,0,0,0,0|2,0,0]=2 27 B8R1.3 O=C1C=CC(=O)C=C1 CNP0164682.0 [0,0,0,0,0,0|1,0,1]=2 28 B8R1.3 O=C1C=CC(=O)CC1 CNP0076081.0 [0,0,0,0,0,0|1,0,3]=4 29 B8R1.3 O=C1C=CC(=O)OC1 CNP0611320.0 [0,0,0,0,0,0|2,0,2]=4 30 B8R1.3 O=C1C=C[C@@H](CN1)O CNP0420822.2 [0,0,0,0,0,0|2,0,2]=4 31 B8R1.3 O=C1C=C[C@H](CN1)O CNP0420822.1 [0,0,0,0,0,0|2,0,2]=4 32 B8R1.3 OC1=CC=C(C=C1)Br CNP0085593.0 [0,0,0,0,0,0|1,0,0]=1 33 B8R1.3 OC1=CC=C(C=C1)Cl CNP0334769.0 [0,0,0,0,0,0|1,0,0]=1 34 B8R1.3 OC1=CC=C(C=C1)I CNP0471533.0 [0,0,0,0,0,0|1,0,0]=1 35 B8R1.3 OC1=CC=C(C=C1)O CNP0246516.0 [0,0,0,0,0,0|1,0,0]=1 36 B8R1.3 OC1=CC=C(C=C1)S CNP0531619.0 [0,0,0,0,0,0|1,0,0]=1 37 B8R1.3 OC1=CC=C(N=C1)O CNP0381187.0 [0,0,0,0,0,0|2,0,0]=2 38 B7R1.3 BrC1=CC=CC=C1 CNP0283267.0 [1,0,0,0,0,0|1,0,0]=2 39 B7R1.3 C=C1[CH]C=CC=C1 CNP0605393.0 [1,0,0,0,0,0|0,0,2]=3 40 B7R1.3 CC1=CC=CC=C1 CNP0156985.0 [1,0,0,0,0,0|0,0,0]=1 41 B7R1.3 CC1=CC=CC=N1 CNP0137947.0 [1,0,0,0,0,0|1,0,0]=2 42 B7R1.3 CC1=CC=CCC1 CNP0238161.0 [1,0,0,0,0,0|0,0,2]=3 43 B7R1.3 CC1=CC=CN=C1 CNP0206932.0 [1,0,0,0,0,0|1,0,0]=2 44 B7R1.3 CC1=CC=NC=C1 CNP0116906.0 [1,0,0,0,0,0|1,0,0]=2 45 B7R1.3 CC1=CC=NC=N1 CNP0609107.0 [1,0,0,0,0,0|2,0,0]=3 46 B7R1.3 CC1=CCC=CC1 CNP0481094.0 [1,0,0,0,0,0|0,0,2]=3 47 B7R1.3 CC1=CN=CC=N1 CNP0285763.0 [1,0,0,0,0,0|2,0,0]=3 48 B7R1.3 C[C@@H]1C=CC=CS1 CNP0200304.1 [1,0,0,0,0,0|1,0,1]=3 49 B7R1.3 C[C@H]1C=CC=CS1 CNP0200304.2 [1,0,0,0,0,0|1,0,1]=3 50 B7R1.3 C[N+]1=CC=CC=C1 CNP0509577.0 [1,0,0,0,0,0|1,0,0]=2 51 B7R1.3 C[N+]1=CC=NC=C1 CNP0506920.0 [1,0,0,0,0,0|2,0,0]=3 52 B7R1.3 ClC1=CC=CC=C1 CNP0009107.0 [1,0,0,0,0,0|1,0,0]=2 53 B7R1.3 IC1=CC=CC=C1 CNP0481848.0 [1,0,0,0,0,0|1,0,0]=2 54 B7R1.3 IC1=CC=NC=C1 CNP0582917.0 [1,0,0,0,0,0|2,0,0]=3 55 B7R1.3 N=C1C=CNC=C1 CNP0283346.0 [1,0,0,0,0,0|2,0,0]=3 56 B7R1.3 N=C1N=CC=CN1 CNP0547270.0 [1,0,0,0,0,0|3,0,0]=4 57 B7R1.3 NC1=CC=CC=C1 CNP0102805.0 [1,0,0,0,0,0|1,0,0]=2 58 B7R1.3 NC1=CC=CC=N1 CNP0140161.0 [1,0,0,0,0,0|2,0,0]=3 59 B7R1.3 NC1=CC=CN=C1 CNP0113226.0 [1,0,0,0,0,0|2,0,0]=3 60 B7R1.3 NC1=CC=NC=C1 CNP0484010.0 [1,0,0,0,0,0|2,0,0]=3 61 B7R1.3 NC1=CC=[NH+]C=C1 CNP0584651.0 [1,0,0,0,0,0|2,0,0]=3 62 B7R1.3 NC1=NC=CC=N1 CNP0050183.0 [1,0,0,0,0,0|3,0,0]=4 63 B7R1.3 O=C1C=CC=CC1 CNP0572434.0 [1,0,0,0,0,0|0,0,2]=3 64 B7R1.3 O=C1C=CC=CN1 CNP0533527.0 [1,0,0,0,0,0|1,0,1]=3 65 B7R1.3 O=C1C=CC=CO1 CNP0166350.0 [1,0,0,0,0,0|1,0,1]=3 66 B7R1.3 O=C1C=CC=NN1 CNP0517938.0 [1,0,0,0,0,0|2,0,1]=4 67 B7R1.3 O=C1C=CNC=C1 CNP0415820.0 [1,0,0,0,0,0|1,0,1]=3 68 B7R1.3 O=C1C=COC=C1 CNP0143392.0 [1,0,0,0,0,0|1,0,1]=3 69 B7R1.3 O=C1C=NC=CN1 CNP0318297.0 [1,0,0,0,0,0|2,0,1]=4 70 B7R1.3 OC1=CC=CC=C1 CNP0155356.0 [1,0,0,0,0,0|0,0,0]=1 71 B7R1.3 OC1=CC=CC=N1 CNP0105400.0 [1,0,0,0,0,0|1,0,0]=2 72 B7R1.3 OC1=CC=CN=C1 CNP0191812.0 [1,0,0,0,0,0|1,0,0]=2 73 B7R1.3 OC1=CC=NC=C1 CNP0509843.0 [1,0,0,0,0,0|1,0,0]=2 74 B7R1.3 OC1=NCCC=C1 CNP0563692.0 [1,0,0,0,0,0|1,0,2]=4 75 B7R1.3 SC1=CC=CC=C1 CNP0138972.0 [1,0,0,0,0,0|0,1,0]=2 76 B7R1.3 SC1=CC=CC=N1 CNP0567350.0 [1,0,0,0,0,0|1,1,0]=3 77 B9R1.1 C=CC1=CC=C(C=C1)C CNP0003402.0 [0,1,0,0,0,0|1,0,0]=2 78 B9R1.1 C=CC1=CC=C(C=C1)O CNP0119518.0 [0,1,0,0,0,0|0,0,1]=2 79 B9R1.1 C=CC1=CN=C(C=N1)C CNP0137155.0 [0,1,0,0,0,0|3,0,0]=4 80 B9R1.1 CC1=CC=C(C=C1)C#N CNP0319761.0 [0,1,0,0,0,0|1,0,0]=2 81 B9R1.1 CC1=CC=C(C=C1)C=O CNP0234694.0 [0,1,0,0,0,0|0,0,1]=2 82 B9R1.1 CC1=CC=C(C=C1)CO CNP0002396.0 [0,1,0,0,0,0|0,0,0]=1 83 B9R1.1 CC1=CC=C(C=C1)I=O CNP0508059.0 [0,1,0,0,0,0|0,0,1]=2 84 B9R1.1 CC1=CC=C(C=C1)N=O CNP0522636.0 [0,1,0,0,0,0|0,0,1]=2 85 B9R1.1 CC1=CN=C(C=N1)CO CNP0207768.0 [0,1,0,0,0,0|2,0,0]=3 86 B9R1.1 CCC1=CC=C(C=C1)Br CNP0211844.0 [0,1,0,0,0,0|1,0,0]=2 87 B9R1.1 CCC1=CC=C(C=C1)C CNP0119285.0 [0,1,0,0,0,0|1,0,0]=2 88 B9R1.1 CCC1=CC=C(C=C1)N CNP0166611.0 [0,1,0,0,0,0|1,0,0]=2 89 B9R1.1 CCC1=CC=C(C=C1)O CNP0299375.0 [0,1,0,0,0,0|0,0,0]=1 90 B9R1.1 CCC1=CC=C(C=N1)C CNP0185750.0 [0,1,0,0,0,0|2,0,0]=3 91 B9R1.1 CCC1=CC=C(N=C1)C CNP0341471.0 [0,1,0,0,0,0|2,0,0]=3 92 B9R1.1 CCC1=CN=C(C=N1)C CNP0183380.0 [0,1,0,0,0,0|3,0,0]=4 93 B9R1.1 CCN1C=CC(=N)C=C1 CNP0467750.0 [0,1,0,0,0,0|2,0,0]=3 94 B9R1.1 CCN1C=CC(=[N])C=C1 CNP0554973.0 [0,1,0,0,0,0|2,0,0]=3 95 B9R1.1 CNC1=CC=C(C=C1)O CNP0036253.0 [0,1,0,0,0,0|0,0,0]=1 96 B9R1.1 COC1=CC=C(C=C1)C CNP0160002.0 [0,1,0,0,0,0|0,0,0]=1 97 B9R1.1 COC1=CC=C(C=C1)N CNP0027059.0 [0,1,0,0,0,0|1,0,0]=2 98 B9R1.1 COC1=CC=C(C=C1)O CNP0236213.0 [0,1,0,0,0,0|0,0,0]=1 99 B9R1.1 COC1=CN=C(C=N1)C CNP0002521.0 [0,1,0,0,0,0|2,0,0]=3 100 B9R1.1 CSC1=CN=C(C=N1)C CNP0168152.0 [0,1,0,0,0,0|2,1,0]=4 101 B9R1.1 N#CC1=CC=C(C=C1)N CNP0174653.0 [0,1,0,0,0,0|1,0,1]=3 102 B9R1.1 N#CC1=CC=C(C=C1)O CNP0148599.0 [0,1,0,0,0,0|0,0,1]=2 103 B9R1.1 N#[N+]C1=CC=C(C=C1)O CNP0595965.0 [0,1,0,0,0,0|1,0,0]=2 104 B9R1.1 N#[N+]C1=CC=C(C=C1)[O-] CNP0612185.0 [0,1,0,0,0,0|1,0,1]=3 105 B9R1.1 NC1=CC=C(C=C1)C=O CNP0263657.0 [0,1,0,0,0,0|1,0,1]=3 106 B9R1.1 NCC1=CC=C(C=C1)O CNP0106686.0 [0,1,0,0,0,0|0,0,0]=1 107 B9R1.1 O=CC1=CC=C(C=C1)O CNP0230702.0 [0,1,0,0,0,0|0,0,1]=2 108 B9R1.1 O=CC1=CC=C(OC1)O CNP0334419.0 [0,1,0,0,0,0|1,0,2]=4 109 B9R1.1 O=NC1=CC=C(C=C1)Br CNP0452912.0 [0,1,0,0,0,0|1,0,1]=3 110 B9R1.1 O=NC1=CC=C(C=N1)Br CNP0417097.0 [0,1,0,0,0,0|2,0,1]=4 111 B9R1.1 O=NC1=CC=C(C=N1)Cl CNP0071252.0 [0,1,0,0,0,0|2,0,1]=4 112 B9R1.1 OCC1=CC=C(C=C1)Br CNP0519580.0 [0,1,0,0,0,0|1,0,0]=2 113 B9R1.1 OCC1=CC=C(C=C1)O CNP0103281.0 [0,1,0,0,0,0|0,0,0]=1 114 B9R1.1 OCC1=CC=C(C=N1)O CNP0288074.0 [0,1,0,0,0,0|1,0,0]=2 115 B9R1.1 [N-]=[N+]=C1C=CC(=O)C=C1 CNP0540787.0 [0,1,0,0,0,0|1,0,1]=3 116 B9R1.69 C=C1C=C[C@@H](C(=C1)Cl)Cl CNP0546368.1 [0,1,0,0,0,0|1,0,2]=4 117 B9R1.69 C=C1C=NC(=NC1=N)C CNP0524346.0 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.69 CC1=C(NC(=O)N=C1)N CNP0315727.0 [0,1,0,0,0,0|2,0,1]=4 119 B9R1.69 CC1=CC(=C(C=N1)C)C CNP0375292.0 [0,1,0,0,0,0|2,0,0]=3 120 B9R1.69 CC1=CC(=CC=C1Br)Cl CNP0064949.0 [0,1,0,0,0,0|2,0,0]=3 121 B9R1.69 CC1=CC(=CC=C1Br)N CNP0054285.0 [0,1,0,0,0,0|2,0,0]=3 122 B9R1.69 CC1=CC(=CC=C1Br)O CNP0025703.0 [0,1,0,0,0,0|1,0,0]=2 123 B9R1.69 CC1=CC(=CC=C1Cl)Br CNP0266846.0 [0,1,0,0,0,0|2,0,0]=3 124 B9R1.69 CC1=CC(=CC=C1Cl)N CNP0024502.0 [0,1,0,0,0,0|2,0,0]=3 125 B9R1.69 CC1=CC(=CC=C1Cl)O CNP0329015.0 [0,1,0,0,0,0|1,0,0]=2 126 B9R1.69 CC1=CC(=CC=C1N)Br CNP0038450.0 [0,1,0,0,0,0|2,0,0]=3 127 B9R1.69 CC1=CC(=CC=C1N)Cl CNP0245359.0 [0,1,0,0,0,0|2,0,0]=3 128 B9R1.69 CC1=CC(=CC=C1O)O CNP0324010.0 [0,1,0,0,0,0|1,0,0]=2 129 B9R1.69 CC1=CC(=O)C(=CO1)O CNP0142931.0 [0,1,0,0,0,0|1,0,0]=2 130 B9R1.69 CC1=CC(=O)C=CC1=O CNP0221358.0 [0,1,0,0,0,0|1,0,1]=3 131 B9R1.69 CC1=CC(C=CC1O)O CNP0455439.0 [0,1,0,0,0,0|1,0,2]=4 132 B9R1.69 CC1=CC=C(C(=C1)Br)Br CNP0060402.0 [0,1,0,0,0,0|1,0,0]=2 133 B9R1.69 CC1=CC=C(C(=C1)Br)N CNP0031609.0 [0,1,0,0,0,0|1,0,0]=2 134 B9R1.69 CC1=CC=C(C(=C1)C)Br CNP0365794.0 [0,1,0,0,0,0|1,0,0]=2 135 B9R1.69 CC1=CC=C(C(=C1)C)C CNP0110255.0 [0,1,0,0,0,0|1,0,0]=2 136 B9R1.69 CC1=CC=C(C(=C1)C)Cl CNP0093284.0 [0,1,0,0,0,0|1,0,0]=2 137 B9R1.69 CC1=CC=C(C(=C1)C)N CNP0375981.0 [0,1,0,0,0,0|1,0,0]=2 138 B9R1.69 CC1=CC=C(C(=C1)C)O CNP0080029.0 [0,1,0,0,0,0|0,0,0]=1 139 B9R1.69 CC1=CC=C(C(=C1)Cl)C CNP0337392.0 [0,1,0,0,0,0|1,0,0]=2 140 B9R1.69 CC1=CC=C(C(=C1)Cl)Cl CNP0253916.0 [0,1,0,0,0,0|1,0,0]=2 141 B9R1.69 CC1=CC=C(C(=C1)Cl)N CNP0363714.0 [0,1,0,0,0,0|1,0,0]=2 142 B9R1.69 CC1=CC=C(C(=C1)Cl)O CNP0145784.0 [0,1,0,0,0,0|0,0,0]=1 143 B9R1.69 CC1=CC=C(C(=C1)N)Br CNP0057363.0 [0,1,0,0,0,0|1,0,0]=2 144 B9R1.69 CC1=CC=C(C(=C1)N)C CNP0307574.0 [0,1,0,0,0,0|1,0,0]=2 145 B9R1.69 CC1=CC=C(C(=C1)N)Cl CNP0495286.0 [0,1,0,0,0,0|1,0,0]=2 146 B9R1.69 CC1=CC=C(C(=C1)N)N CNP0080098.0 [0,1,0,0,0,0|1,0,0]=2 147 B9R1.69 CC1=CC=C(C(=C1)N)O CNP0421546.0 [0,1,0,0,0,0|0,0,0]=1 148 B9R1.69 CC1=CC=C(C(=C1)N)S CNP0463153.0 [0,1,0,0,0,0|0,1,0]=2 149 B9R1.69 CC1=CC=C(C(=C1)O)C CNP0172791.0 [0,1,0,0,0,0|1,0,0]=2 150 B9R1.69 CC1=CC=C(C(=C1)O)O CNP0114802.0 [0,1,0,0,0,0|0,0,0]=1 151 B9R1.69 CC1=CC=C(C(=N1)C)C CNP0390721.0 [0,1,0,0,0,0|2,0,0]=3 152 B9R1.69 CC1=CC=C(C(=N1)C)O CNP0056515.0 [0,1,0,0,0,0|1,0,0]=2 153 B9R1.69 CC1=CC=C(C(=N1)Cl)N CNP0043466.0 [0,1,0,0,0,0|2,0,0]=3 154 B9R1.69 CC1=CC=C(C=C1Br)Cl CNP0186814.0 [0,1,0,0,0,0|1,0,0]=2 155 B9R1.69 CC1=CC=C(C=C1C)Br CNP0125395.0 [0,1,0,0,0,0|1,0,0]=2 156 B9R1.69 CC1=CC=C(C=C1C)Cl CNP0482651.0 [0,1,0,0,0,0|1,0,0]=2 157 B9R1.69 CC1=CC=C(C=C1C)N CNP0171920.0 [0,1,0,0,0,0|1,0,0]=2 158 B9R1.69 CC1=CC=C(C=C1C)O CNP0160429.0 [0,1,0,0,0,0|0,0,0]=1 159 B9R1.69 CC1=CC=C(C=C1Cl)N CNP0028854.0 [0,1,0,0,0,0|1,0,0]=2 160 B9R1.69 CC1=CC=C(C=C1N)N CNP0023048.0 [0,1,0,0,0,0|1,0,0]=2 161 B9R1.69 CC1=CC=C(C=C1O)O CNP0256040.0 [0,1,0,0,0,0|0,0,0]=1 162 B9R1.69 CC1=CN=C(C(=C1)C)C CNP0331632.0 [0,1,0,0,0,0|2,0,0]=3 163 B9R1.69 CC1=CN=C(C(=C1)Cl)Br CNP0177235.0 [0,1,0,0,0,0|2,0,0]=3 164 B9R1.69 CC1=CN=C(C(=N1)C)C CNP0313440.0 [0,1,0,0,0,0|3,0,0]=4 165 B9R1.69 CC1=CN=C(C(=O)N1)C CNP0598520.0 [0,1,0,0,0,0|3,0,0]=4 166 B9R1.69 CC1=CN=C(N=C1O)O CNP0517257.0 [0,1,0,0,0,0|2,0,0]=3 167 B9R1.69 CC1=CN=[11C](N=C1O)O CNP0546373.0 [0,1,0,0,0,0|2,0,0]=3 168 B9R1.69 CC1=CNC(=O)C=C1O CNP0017901.0 [0,1,0,0,0,0|1,0,1]=3 169 B9R1.69 CC1=CNC(=O)N=C1N CNP0513326.0 [0,1,0,0,0,0|2,0,1]=4 170 B9R1.69 CC1=CNC(=O)NC1=O CNP0143365.0 [0,1,0,0,0,0|2,0,1]=4 171 B9R1.69 CC1=C[N+](=C(C=N1)C)[O-] CNP0514079.0 [0,1,0,0,0,0|3,0,0]=4 172 B9R1.69 CC1=NC=C(C(=N1)N)C CNP0518359.0 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.69 CN1C=CC(=NC1=O)N CNP0579381.0 [0,1,0,0,0,0|3,0,0]=4 174 B9R1.69 CN1C=CC(=NC1=O)O CNP0514957.0 [0,1,0,0,0,0|2,0,0]=3 175 B9R1.69 CN1C=CC(=O)NC1=O CNP0199194.0 [0,1,0,0,0,0|2,0,1]=4 176 B9R1.69 CN1C=CC(=O)NC1=S CNP0157783.0 [0,1,0,0,0,0|2,0,1]=4 177 B9R1.69 C[N+]1=CC(=CC=C1N)I CNP0606794.0 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.69 ClC1=CC=C(C(=C1)Cl)Cl CNP0206286.0 [0,1,0,0,0,0|2,0,0]=3 179 B9R1.69 N=C1C=CC(=O)C(=C1)O CNP0274436.0 [0,1,0,0,0,0|1,0,1]=3 180 B9R1.69 NC1=CC(=CC=C1Cl)Cl CNP0040093.0 [0,1,0,0,0,0|2,0,0]=3 181 B9R1.69 NC1=CC(=CC=C1O)O CNP0176630.0 [0,1,0,0,0,0|1,0,0]=2 182 B9R1.69 NC1=CC(=CC=C1S)Cl CNP0458275.0 [0,1,0,0,0,0|1,1,0]=3 183 B9R1.69 NC1=CC=C(C(=C1)N)N CNP0131312.0 [0,1,0,0,0,0|2,0,0]=3 184 B9R1.69 NC1=CC=C(C(=C1)N)O CNP0003471.0 [0,1,0,0,0,0|1,0,0]=2 185 B9R1.69 NC1=CC=C(C=C1Br)Br CNP0063783.0 [0,1,0,0,0,0|2,0,0]=3 186 B9R1.69 NC1=CC=C(C=C1Cl)Cl CNP0048955.0 [0,1,0,0,0,0|2,0,0]=3 187 B9R1.69 NC1=NC=C(C=C1Br)Br CNP0105917.0 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.69 O=C1C=C(C(=CN1)Cl)O CNP0569686.0 [0,1,0,0,0,0|2,0,1]=4 189 B9R1.69 O=C1C=CC(=O)C(=C1)O CNP0230039.0 [0,1,0,0,0,0|1,0,1]=3 190 B9R1.69 O=C1C=CN(C(=O)N1)O CNP0212690.0 [0,1,0,0,0,0|3,0,0]=4 191 B9R1.69 O=C1NC=C(C(=O)N1)O CNP0573977.0 [0,1,0,0,0,0|3,0,0]=4 192 B9R1.69 OC1=CC(=CC=C1Cl)Cl CNP0236901.0 [0,1,0,0,0,0|2,0,0]=3 193 B9R1.69 OC1=CC=C(C(=C1)Br)O CNP0161760.0 [0,1,0,0,0,0|1,0,0]=2 194 B9R1.69 OC1=CC=C(C(=C1)Cl)Cl CNP0386646.0 [0,1,0,0,0,0|1,0,0]=2 195 B9R1.69 OC1=CC=C(C(=C1)Cl)O CNP0331365.0 [0,1,0,0,0,0|1,0,0]=2 196 B9R1.69 OC1=CC=C(C(=C1)O)O CNP0187325.0 [0,1,0,0,0,0|1,0,0]=2 197 B9R1.69 OC1=CC=C(C=C1Br)Br CNP0216116.0 [0,1,0,0,0,0|1,0,0]=2 198 B9R1.69 OC1=CC=C(C=C1Cl)Cl CNP0401033.0 [0,1,0,0,0,0|1,0,0]=2 199 B9R1.69 OC1=NC=C(C(=N1)O)O CNP0090439.0 [0,1,0,0,0,0|3,0,0]=4 200 B9R1.69 OC1C=CC(=CC1O)Br CNP0083764.0 [0,1,0,0,0,0|1,0,2]=4 201 B9R1.69 OC1C=CC(=CC1O)Cl CNP0158763.0 [0,1,0,0,0,0|1,0,2]=4 202 B7R0.3 C=CC(=CC=CC)C CNP0321924.0 [0,0,1,0,0,0|1,0,0]=2 203 B7R0.3 C=CC(=CCCC)C CNP0605951.0 [0,0,1,0,0,0|1,0,2]=4 204 B7R0.3 C=CC=CC(C)C=C CNP0076743.0 [0,0,1,0,0,0|1,0,1]=3 205 B7R0.6 CC(=CC=C(C)C)C CNP0084726.0 [0,0,1,0,0,0|1,0,2]=4 206 B7R0.6 CC(=CCC(=O)O)C CNP0178388.0 [0,0,1,0,0,0|1,0,2]=4 207 B7R0.6 CC(=O)C=CC(=O)C CNP0303603.0 [0,0,1,0,0,0|1,0,2]=4 208 B7R0.6 CC(=O)C=CC(=O)O CNP0237218.0 [0,0,1,0,0,0|2,0,0]=3 209 B7R0.6 CC(C)C=CC(=O)O CNP0205254.0 [0,0,1,0,0,0|1,0,2]=4 210 B7R0.6 N=C(N)C=CC(=O)O CNP0421555.0 [0,0,1,0,0,0|3,0,0]=4 211 B7R0.6 N=C(O)C=CC(=O)O CNP0546682.0 [0,0,1,0,0,0|3,0,0]=4 212 B7R0.6 NC(=CC=C(N)O)O CNP0445751.0 [0,0,1,0,0,0|3,0,0]=4 213 B7R0.6 NC(=O)C=CC(=O)O CNP0299428.0 [0,0,1,0,0,0|3,0,0]=4 214 B7R0.6 O=C(O)C=CC(=O)O CNP0289193.0 [0,0,1,0,0,0|3,0,0]=4 215 B7R0.6 O=C([O-])C=CC(=O)O CNP0594402.0 [0,0,1,0,0,0|3,0,0]=4 216 B9R2.21 BrC1=CC2OC2C=C1 CNP0105064.0 [0,0,0,1,0,0|1,0,2]=4 217 B7R1.2 C=C1C=CC(=O)O1 CNP0331663.0 [0,0,0,0,1,0|1,0,2]=4 218 B7R1.2 CC1=CC(=CO1)S CNP0229693.0 [0,0,0,0,1,0|1,1,0]=3 219 B7R1.2 CC1=CC(=CS1)S CNP0155844.0 [0,0,0,0,1,0|1,1,0]=3 220 B7R1.2 CC1=CC(=NO1)O CNP0075615.0 [0,0,0,0,1,0|2,0,0]=3 221 B7R1.2 CC1=CC(=O)CC1 CNP0317275.0 [0,0,0,0,1,0|0,0,3]=4 222 B7R1.2 CC1=CC(=O)CO1 CNP0257916.0 [0,0,0,0,1,0|1,0,2]=4 223 B7R1.2 CC1=CC(=O)OC1 CNP0565176.0 [0,0,0,0,1,0|1,0,2]=4 224 B7R1.2 CC1=CC(=S)CC1 CNP0042519.0 [0,0,0,0,1,0|0,1,2]=4 225 B7R1.2 CC1=CC=C(N1)C CNP0293795.0 [0,0,0,0,1,0|2,0,0]=3 226 B7R1.2 CC1=CC=C(O1)C CNP0204172.0 [0,0,0,0,1,0|2,0,0]=3 227 B7R1.2 CC1=CC=C(S1)C CNP0108172.0 [0,0,0,0,1,0|2,0,0]=3 228 B7R1.2 CC1=CCC(=O)O1 CNP0256319.0 [0,0,0,0,1,0|1,0,2]=4 229 B7R1.2 CC1=CN(C=N1)C CNP0371299.0 [0,0,0,0,1,0|3,0,0]=4 230 B7R1.2 CC1=CN=C(N1)C CNP0491637.0 [0,0,0,0,1,0|3,0,0]=4 231 B7R1.2 CC1=CN=C(O1)C CNP0342440.0 [0,0,0,0,1,0|3,0,0]=4 232 B7R1.2 CC1=CN=C(S1)C CNP0104615.0 [0,0,0,0,1,0|3,0,0]=4 233 B7R1.2 CC1=CNC(=N1)C CNP0266432.0 [0,0,0,0,1,0|3,0,0]=4 234 B7R1.2 CC1=CNC(=N1)N CNP0282776.0 [0,0,0,0,1,0|3,0,0]=4 235 B7R1.2 CC1=COC(=C1)C CNP0386095.0 [0,0,0,0,1,0|2,0,0]=3 236 B7R1.2 CC1=COC(=N1)C CNP0003151.0 [0,0,0,0,1,0|3,0,0]=4 237 B7R1.2 CC1=CSC(=C1)C CNP0354538.0 [0,0,0,0,1,0|2,0,0]=3 238 B7R1.2 CC1=CSC(=N1)C CNP0325740.0 [0,0,0,0,1,0|3,0,0]=4 239 B7R1.2 CC1=NN(C=C1)C CNP0605610.0 [0,0,0,0,1,0|3,0,0]=4 240 B7R1.2 CC1=NOC(=C1)C CNP0609091.0 [0,0,0,0,1,0|3,0,0]=4 241 B7R1.2 CC1C=C(CC1)O CNP0082123.0 [0,0,0,0,1,0|0,0,3]=4 242 B7R1.2 CC1C=CC(=O)O1 CNP0003646.0 [0,0,0,0,1,0|1,0,2]=4 243 B7R1.2 N=C1C=C[C@H](N1)O CNP0200378.1 [0,0,0,0,1,0|2,0,1]=4 244 B7R1.2 O=C1C=C(CO1)O CNP0181857.0 [0,0,0,0,1,0|2,0,1]=4 245 B7R1.2 O=C1C=CC(=O)C1 CNP0421080.0 [0,0,0,0,1,0|1,0,2]=4 246 B7R1.2 O=C1C=CC(=O)N1 CNP0413509.0 [0,0,0,0,1,0|2,0,1]=4 247 B7R1.2 O=C1C=CC(=O)O1 CNP0609075.0 [0,0,0,0,1,0|2,0,1]=4 248 B7R1.2 O=C1C=CC(C1)O CNP0594515.0 [0,0,0,0,1,0|1,0,2]=4 249 B7R1.2 O=C1C=C[C@H](N1)O CNP0582707.1 [0,0,0,0,1,0|2,0,1]=4 250 B7R1.2 OC1=NC(C=C1)O CNP0132128.0 [0,0,0,0,1,0|2,0,1]=4 251 B6R0.1 C=CC=C(C)C=C CNP0076815.0 [1,0,1,0,0,0|0,0,0]=2 252 B6R0.1 C=CC=C(C)CO CNP0191364.0 [1,0,1,0,0,0|1,0,1]=4 253 B6R0.1 CC=CC(=CC)C CNP0535908.0 [1,0,1,0,0,0|0,0,2]=4 254 B6R0.4 C=CC=CC(=O)O CNP0076475.0 [1,0,1,0,0,0|1,0,0]=3 255 B6R0.4 CC=CC=C(C)C CNP0318303.0 [1,0,1,0,0,0|0,0,2]=4 256 B6R0.4 CC=CCC(=O)O CNP0610144.0 [1,0,1,0,0,0|1,0,1]=4 257 B6R0.4 CCC=CC(=O)O CNP0185292.0 [1,0,1,0,0,0|1,0,1]=4 258 B6R0.4 CSC=CC(=O)O CNP0140653.0 [1,0,1,0,0,0|2,0,0]=4 259 B6R0.6 C=CC#CC=CC CNP0360102.0 [1,0,1,0,0,0|0,0,2]=4 260 B6R0.6 C=CC=CC=CC CNP0610379.0 [1,0,1,0,0,0|0,0,0]=2 261 B6R0.6 C=CC=CCCC CNP0526826.0 [1,0,1,0,0,0|0,0,2]=4 262 B6R0.6 C=CCCC=CC CNP0426808.0 [1,0,1,0,0,0|0,0,2]=4 263 B6R0.6 CC=CC=CC=O CNP0182801.0 [1,0,1,0,0,0|1,0,0]=3 264 B6R0.6 CC=CC=CCC CNP0608489.0 [1,0,1,0,0,0|0,0,2]=4 265 B6R0.6 CC=CC=CCO CNP0292375.0 [1,0,1,0,0,0|0,0,2]=4 266 B6R0.6 CC=COC=CC CNP0612224.0 [1,0,1,0,0,0|1,0,1]=4 267 B6R0.6 CC=CSC=CC CNP0002507.0 [1,0,1,0,0,0|1,0,1]=4 268 B6R1.1 C1=CC=CC=C1 CNP0140642.0 [2,0,0,0,0,0|0,0,0]=2 269 B6R1.1 C1=CC=NC=C1 CNP0160377.0 [2,0,0,0,0,0|1,0,0]=3 270 B6R1.1 C1=CC=[GeH]C=C1 CNP0610073.0 [2,0,0,0,0,0|0,1,0]=3 271 B6R1.1 C1=CCC=CC1 CNP0508932.0 [2,0,0,0,0,0|0,0,2]=4 272 B6R1.1 C1=CCCC=C1 CNP0267898.0 [2,0,0,0,0,0|0,0,2]=4 273 B6R1.1 C1=CCNC=C1 CNP0081217.0 [2,0,0,0,0,0|1,0,1]=4 274 B6R1.1 C1=CCOC=C1 CNP0513975.0 [2,0,0,0,0,0|1,0,1]=4 275 B6R1.1 C1=CC[IH]C=C1 CNP0564978.0 [2,0,0,0,0,0|1,0,1]=4 276 B6R1.1 C1=CN=CC=N1 CNP0190332.0 [2,0,0,0,0,0|2,0,0]=4 277 B6R1.1 C1=CN=CN=C1 CNP0415803.0 [2,0,0,0,0,0|2,0,0]=4 278 B6R1.1 C1=CSSC=C1 CNP0509445.0 [2,0,0,0,0,0|2,0,0]=4 279 B6R1.1 [C]1=CC=CC=C1 CNP0517520.0 [2,0,0,0,0,0|0,0,1]=3 280 B8R0.1 CC=CS[S+](O)C=CC CNP0334165.0 [0,1,1,0,0,0|2,0,0]=4 281 B8R0.6 C=CC(=O)CC=CCC CNP0046682.0 [0,1,1,0,0,0|0,0,2]=4 282 B8R0.6 C=CC(O)CCC=CC CNP0288913.0 [0,1,1,0,0,0|0,0,2]=4 283 B8R0.6 C=C[C@@H](O)/C=C/CCC CNP0182495.1 [0,1,1,0,0,0|0,0,2]=4 284 B8R0.6 C=C[C@@H](O)C/C=C/CC CNP0227768.1 [0,1,1,0,0,0|0,0,2]=4 285 B8R0.6 C=C[C@@H](O)C/C=C\CC CNP0227768.2 [0,1,1,0,0,0|0,0,2]=4 286 B8R0.6 C=C[C@H](O)C/C=C/CC CNP0227768.4 [0,1,1,0,0,0|0,0,2]=4 287 B8R0.6 C=C[C@H](O)C/C=C\CC CNP0227768.3 [0,1,1,0,0,0|0,0,2]=4 288 B8R0.8 CC=CC=C(C)C(=O)O CNP0232532.0 [0,1,1,0,0,0|2,0,0]=4 289 B8R0.9 C=C(O)C=CC(=O)C=O CNP0588260.0 [0,1,1,0,0,0|2,0,0]=4 290 B8R0.9 C=C(O)C=CC(=O)C=O CNP0602025.0 [0,1,1,0,0,0|2,0,0]=4 291 B8R0.19 CC=C(C)C=C(C)C=O CNP0259001.0 [0,1,1,0,0,0|0,0,2]=4 292 B8R0.19 CC=C(C)C=C(C)CO CNP0307713.0 [0,1,1,0,0,0|0,0,2]=4 293 B8R1.2 BrCC1=CN=CC=N1 CNP0076953.0 [1,1,0,0,0,0|2,0,0]=4 294 B8R1.2 C#CC1=CC=CC=C1 CNP0227628.0 [1,1,0,0,0,0|0,0,1]=3 295 B8R1.2 C=CC1=CC=CC=C1 CNP0111430.0 [1,1,0,0,0,0|0,0,1]=3 296 B8R1.2 C=CC1=CC=CN=C1 CNP0522857.0 [1,1,0,0,0,0|1,0,1]=4 297 B8R1.2 C=CC1=CC=NC=C1 CNP0355769.0 [1,1,0,0,0,0|1,0,1]=4 298 B8R1.2 CCC1=CC=CC=C1 CNP0245508.0 [1,1,0,0,0,0|0,0,0]=2 299 B8R1.2 CCC1=CC=CC=N1 CNP0003463.0 [1,1,0,0,0,0|1,0,0]=3 300 B8R1.2 CCC1=CC=CN=C1 CNP0396997.0 [1,1,0,0,0,0|1,0,0]=3 301 B8R1.2 CCC1=CN=CC=N1 CNP0259600.0 [1,1,0,0,0,0|2,0,0]=4 302 B8R1.2 CC[N+]1=CC=CC=C1 CNP0507760.0 [1,1,0,0,0,0|1,0,0]=3 303 B8R1.2 CNC1=CC=CC=C1 CNP0238665.0 [1,1,0,0,0,0|0,0,0]=2 304 B8R1.2 COC1=CC=CC=C1 CNP0226394.0 [1,1,0,0,0,0|0,0,0]=2 305 B8R1.2 COC1=CC=CC=N1 CNP0086328.0 [1,1,0,0,0,0|1,0,0]=3 306 B8R1.2 COC1=CC=CN=C1 CNP0181639.0 [1,1,0,0,0,0|1,0,0]=3 307 B8R1.2 COC1=CC=[C-]C=C1 CNP0559014.0 [1,1,0,0,0,0|0,0,1]=3 308 B8R1.2 COC1=CN=CC=N1 CNP0003478.0 [1,1,0,0,0,0|2,0,0]=4 309 B8R1.2 CSC1=CC=CC=C1 CNP0220907.0 [1,1,0,0,0,0|0,0,0]=2 310 B8R1.2 CSC1=CN=CC=N1 CNP0003124.0 [1,1,0,0,0,0|2,0,0]=4 311 B8R1.2 ClCC1=CC=CC=C1 CNP0182098.0 [1,1,0,0,0,0|0,0,0]=2 312 B8R1.2 N#CC1=CC=CC=C1 CNP0417536.0 [1,1,0,0,0,0|0,0,1]=3 313 B8R1.2 N#CC1=CC=CC=N1 CNP0133217.0 [1,1,0,0,0,0|1,0,1]=4 314 B8R1.2 N#CC1=CC=CN=C1 CNP0196992.0 [1,1,0,0,0,0|1,0,1]=4 315 B8R1.2 N#CC1=CC=NC=C1 CNP0375790.0 [1,1,0,0,0,0|1,0,1]=4 316 B8R1.2 NCC1=CC=CC=C1 CNP0287581.0 [1,1,0,0,0,0|0,0,0]=2 317 B8R1.2 NCC1=CC=CC=N1 CNP0472987.0 [1,1,0,0,0,0|1,0,0]=3 318 B8R1.2 NNC1=CC=CC=C1 CNP0343489.0 [1,1,0,0,0,0|1,0,0]=3 319 B8R1.2 NOC1=CC=CC=C1 CNP0086444.0 [1,1,0,0,0,0|0,0,0]=2 320 B8R1.2 O=CC1=CC=CC=C1 CNP0105179.0 [1,1,0,0,0,0|0,0,1]=3 321 B8R1.2 O=CC1=CC=CC=N1 CNP0343249.0 [1,1,0,0,0,0|1,0,1]=4 322 B8R1.2 O=CC1=CC=CN=C1 CNP0275958.0 [1,1,0,0,0,0|1,0,1]=4 323 B8R1.2 O=NC1=CC=CC=C1 CNP0458645.0 [1,1,0,0,0,0|0,0,1]=3 324 B8R1.2 O=NC1=CC=CC=N1 CNP0402135.0 [1,1,0,0,0,0|1,0,1]=4 325 B8R1.2 OCC1=CC=CC=C1 CNP0263608.0 [1,1,0,0,0,0|0,0,0]=2 326 B8R1.2 OCC1=CC=CCC1 CNP0584064.0 [1,1,0,0,0,0|0,0,2]=4 327 B8R1.2 OCC1=CC=CN=C1 CNP0208151.0 [1,1,0,0,0,0|1,0,0]=3 328 B8R1.2 OCC1=CC=NC=C1 CNP0397488.0 [1,1,0,0,0,0|1,0,0]=3 329 B8R1.2 S=CC1=CC=CC=C1 CNP0390890.0 [1,1,0,0,0,0|0,0,1]=3 330 B8R1.2 SCC1=CC=CC=C1 CNP0118345.0 [1,1,0,0,0,0|0,0,0]=2 331 B8R1.2 SCC1=CC=CC=N1 CNP0105723.0 [1,1,0,0,0,0|1,0,0]=3 332 B8R1.2 SCC1=CC=CN=C1 CNP0566755.0 [1,1,0,0,0,0|1,0,0]=3 333 B8R1.2 SCC1=CN=CC=N1 CNP0229809.0 [1,1,0,0,0,0|2,0,0]=4 334 B8R1.2 [18OH]CC1=CC=CC=C1 CNP0583905.0 [1,1,0,0,0,0|0,0,0]=2 335 B8R1.2 [CH2]CC1=CC=CC=C1 CNP0592603.0 [1,1,0,0,0,0|0,0,0]=2 336 B8R1.4 BrC1=CN=CC(=C1)Br CNP0184336.0 [1,1,0,0,0,0|2,0,0]=4 337 B8R1.4 CC1=CC(=CC=N1)O CNP0308761.0 [1,1,0,0,0,0|1,0,0]=3 338 B8R1.4 CC1=CC(=O)C=CN1 CNP0513735.0 [1,1,0,0,0,0|1,0,0]=3 339 B8R1.4 CC1=CC(=O)C=CO1 CNP0179458.0 [1,1,0,0,0,0|1,0,0]=3 340 B8R1.4 CC1=CC=CC(=C1)Br CNP0039148.0 [1,1,0,0,0,0|0,0,0]=2 341 B8R1.4 CC1=CC=CC(=C1)C CNP0152592.0 [1,1,0,0,0,0|0,0,0]=2 342 B8R1.4 CC1=CC=CC(=C1)Cl CNP0583031.0 [1,1,0,0,0,0|0,0,0]=2 343 B8R1.4 CC1=CC=CC(=C1)N CNP0300821.0 [1,1,0,0,0,0|0,0,0]=2 344 B8R1.4 CC1=CC=CC(=C1)O CNP0355586.0 [1,1,0,0,0,0|0,0,0]=2 345 B8R1.4 CC1=CC=CC(=N1)Br CNP0033684.0 [1,1,0,0,0,0|1,0,0]=3 346 B8R1.4 CC1=CC=CC(=N1)C CNP0246832.0 [1,1,0,0,0,0|1,0,0]=3 347 B8R1.4 CC1=CC=CC(=N1)N CNP0039742.0 [1,1,0,0,0,0|1,0,0]=3 348 B8R1.4 CC1=CC=C[N+](=C1)[O-] CNP0579325.0 [1,1,0,0,0,0|1,0,0]=3 349 B8R1.4 CC1=CC=NC(=C1)C CNP0143367.0 [1,1,0,0,0,0|1,0,0]=3 350 B8R1.4 CC1=CC=NC(=C1)N CNP0425527.0 [1,1,0,0,0,0|1,0,0]=3 351 B8R1.4 CC1=CC=NC(=N1)N CNP0413539.0 [1,1,0,0,0,0|2,0,0]=4 352 B8R1.4 CC1=CC=NC(=O)N1 CNP0522184.0 [1,1,0,0,0,0|2,0,0]=4 353 B8R1.4 CC1=CC=[NH+]C(=C1)N CNP0513297.0 [1,1,0,0,0,0|1,0,0]=3 354 B8R1.4 CC1=CCCC(=C1)C CNP0118398.0 [1,1,0,0,0,0|0,0,2]=4 355 B8R1.4 CC1=CN=CC(=C1)C CNP0366505.0 [1,1,0,0,0,0|1,0,0]=3 356 B8R1.4 CC1=CN=CC(=C1)O CNP0135310.0 [1,1,0,0,0,0|1,0,0]=3 357 B8R1.4 CC1=CN=CC(=N1)C CNP0296461.0 [1,1,0,0,0,0|2,0,0]=4 358 B8R1.4 CC1=C[N+](=CC=N1)[O-] CNP0582367.0 [1,1,0,0,0,0|2,0,0]=4 359 B8R1.4 ClC1=CC=CC(=C1)Cl CNP0080171.0 [1,1,0,0,0,0|1,0,0]=3 360 B8R1.4 N=C1C=CN=C(N1)O CNP0571963.0 [1,1,0,0,0,0|2,0,0]=4 361 B8R1.4 NC1=CC=CC(=C1)Cl CNP0066965.0 [1,1,0,0,0,0|1,0,0]=3 362 B8R1.4 NC1=CC=CC(=C1)N CNP0033147.0 [1,1,0,0,0,0|1,0,0]=3 363 B8R1.4 NC1=CC=CC(=C1)O CNP0172517.0 [1,1,0,0,0,0|0,0,0]=2 364 B8R1.4 NC1=CC=NC(=N1)O CNP0547363.0 [1,1,0,0,0,0|2,0,0]=4 365 B8R1.4 OC1=CC=CC(=C1)Cl CNP0109649.0 [1,1,0,0,0,0|0,0,0]=2 366 B8R1.4 OC1=CC=CC(=C1)O CNP0414137.0 [1,1,0,0,0,0|0,0,0]=2 367 B8R1.4 OC1=CC=NC(=N1)O CNP0482999.0 [1,1,0,0,0,0|2,0,0]=4 368 B8R1.4 OC1=CC=NC(=N1)S CNP0482108.0 [1,1,0,0,0,0|2,0,0]=4 369 B8R1.4 OC1=NC=CC(=N1)S CNP0275474.0 [1,1,0,0,0,0|2,0,0]=4 370 B8R1.4 [O-]C1=CC=CC(=C1)[O-] CNP0552554.0 [1,1,0,0,0,0|0,0,1]=3 371 B8R1.4 [O-][N+]1=CC=NC(=C1)O CNP0482940.0 [1,1,0,0,0,0|2,0,0]=4 372 B8R1.4 [O]C1=NC=CC(=N1)O CNP0583301.0 [1,1,0,0,0,0|2,0,0]=4 373 B8R1.5 C=C1[CH]C=CC=C1C CNP0546829.0 [1,1,0,0,0,0|0,0,1]=3 374 B8R1.5 CC1=C(CC=CC1)C CNP0076227.0 [1,1,0,0,0,0|0,0,2]=4 375 B8R1.5 CC1=CC=CC=C1Br CNP0035566.0 [1,1,0,0,0,0|0,0,0]=2 376 B8R1.5 CC1=CC=CC=C1C CNP0365784.0 [1,1,0,0,0,0|0,0,0]=2 377 B8R1.5 CC1=CC=CC=C1Cl CNP0335361.0 [1,1,0,0,0,0|0,0,0]=2 378 B8R1.5 CC1=CC=CC=C1N CNP0178803.0 [1,1,0,0,0,0|0,0,0]=2 379 B8R1.5 CC1=CC=CC=C1O CNP0242840.0 [1,1,0,0,0,0|0,0,0]=2 380 B8R1.5 CC1=CC=CC=C1S CNP0309831.0 [1,1,0,0,0,0|0,0,0]=2 381 B8R1.5 CC1=CC=CC=[N+]1C CNP0553099.0 [1,1,0,0,0,0|1,0,0]=3 382 B8R1.5 CC1=CC=CC=[N+]1[O-] CNP0511667.0 [1,1,0,0,0,0|1,0,0]=3 383 B8R1.5 CC1=CC=CN=C1C CNP0151242.0 [1,1,0,0,0,0|1,0,0]=3 384 B8R1.5 CC1=CC=CN=C1N CNP0505128.0 [1,1,0,0,0,0|1,0,0]=3 385 B8R1.5 CC1=CC=C[NH+]=C1N CNP0549558.0 [1,1,0,0,0,0|1,0,0]=3 386 B8R1.5 CC1=CC=NC=C1C CNP0275303.0 [1,1,0,0,0,0|1,0,0]=3 387 B8R1.5 CC1=CC=NC=C1N CNP0236716.0 [1,1,0,0,0,0|1,0,0]=3 388 B8R1.5 CC1=CN=CC=[N+]1[O-] CNP0547202.0 [1,1,0,0,0,0|2,0,0]=4 389 B8R1.5 CC1=NC=CC=C1O CNP0418507.0 [1,1,0,0,0,0|1,0,0]=3 390 B8R1.5 CC1=NC=CN=C1C CNP0119963.0 [1,1,0,0,0,0|2,0,0]=4 391 B8R1.5 ClC1=CC=CC=C1Cl CNP0284887.0 [1,1,0,0,0,0|1,0,0]=3 392 B8R1.5 N=C1C=CNC=C1N CNP0546227.0 [1,1,0,0,0,0|2,0,0]=4 393 B8R1.5 NC1=CC=CC=C1Br CNP0295031.0 [1,1,0,0,0,0|1,0,0]=3 394 B8R1.5 NC1=CC=CC=C1N CNP0232275.0 [1,1,0,0,0,0|1,0,0]=3 395 B8R1.5 NC1=CC=CC=C1O CNP0115137.0 [1,1,0,0,0,0|0,0,0]=2 396 B8R1.5 NC1=CC=CC=C1S CNP0083879.0 [1,1,0,0,0,0|0,1,0]=3 397 B8R1.5 NC1=CC=CN=C1Cl CNP0096813.0 [1,1,0,0,0,0|2,0,0]=4 398 B8R1.5 NC1=CN=CC=C1I CNP0081944.0 [1,1,0,0,0,0|2,0,0]=4 399 B8R1.5 O=C1C=CC=CC1=O CNP0309111.0 [1,1,0,0,0,0|0,0,1]=3 400 B8R1.5 O=C1C=CCC=C1O CNP0560107.0 [1,1,0,0,0,0|0,0,1]=3 401 B8R1.5 O=C1C=CNC=C1O CNP0258387.0 [1,1,0,0,0,0|1,0,0]=3 402 B8R1.5 O=C1C=COC=C1O CNP0116604.0 [1,1,0,0,0,0|1,0,0]=3 403 B8R1.5 O=C1NC=CC=C1O CNP0598897.0 [1,1,0,0,0,0|1,0,0]=3 404 B8R1.5 O=C1OC=CC=C1O CNP0103332.0 [1,1,0,0,0,0|1,0,0]=3 405 B8R1.5 OC1=CC=CC=C1Br CNP0083000.0 [1,1,0,0,0,0|0,0,0]=2 406 B8R1.5 OC1=CC=CC=C1Cl CNP0071171.0 [1,1,0,0,0,0|0,0,0]=2 407 B8R1.5 OC1=CC=CC=C1O CNP0143972.0 [1,1,0,0,0,0|0,0,0]=2 408 B8R1.5 OC1=CC=CN=C1I CNP0061816.0 [1,1,0,0,0,0|1,0,0]=3 409 B8R1.5 OC1=CC=CN=C1O CNP0082051.0 [1,1,0,0,0,0|1,0,0]=3 410 B8R1.5 OC1=CC=NC=C1O CNP0510670.0 [1,1,0,0,0,0|1,0,0]=3 411 B8R1.5 ON1C=CC=CC1=S CNP0586487.0 [1,1,0,0,0,0|1,0,0]=3 412 B8R1.5 O[14C]1=[14CH][14CH]=[14CH][14CH]=[14C]1O CNP0513395.0 [1,1,0,0,0,0|0,0,0]=2 413 B8R1.5 O[C@@H]1C=CC=C[C@@H]1O CNP0314922.2 [1,1,0,0,0,0|0,0,2]=4 414 B8R1.5 O[C@@H]1C=CC=C[C@H]1O CNP0314922.1 [1,1,0,0,0,0|0,0,2]=4 415 B8R1.5 O[C@H]1C=CC=C[C@@H]1O CNP0314922.3 [1,1,0,0,0,0|0,0,2]=4 416 B8R1.5 [CH2]C1=CC=CC=C1C CNP0593977.0 [1,1,0,0,0,0|0,0,0]=2 417 B8R1.5 [O-]N1C=CC=CC1=S CNP0491195.0 [1,1,0,0,0,0|1,0,1]=4 418 B8R1.5 [O-]N1C=CC=CC1=S CNP0532331.0 [1,1,0,0,0,0|1,0,1]=4 419 B8R1.5 [O-][N+]1=CC=CC=C1S CNP0592307.0 [1,1,0,0,0,0|1,0,1]=4 420 B8R1.1 CC1=CC=C(N1)C=O CNP0263778.0 [0,1,0,0,1,0|1,0,1]=4 421 B8R1.1 CC1=CC=C(O1)C=O CNP0142902.0 [0,1,0,0,1,0|1,0,1]=4 422 B8R1.1 CC1=CC=C(O1)CO CNP0526210.0 [0,1,0,0,1,0|1,0,0]=3 423 B8R1.1 CC1=CC=C(O1)CS CNP0002606.0 [0,1,0,0,1,0|1,1,0]=4 424 B8R1.1 CC1=CC=C(S1)C=O CNP0611712.0 [0,1,0,0,1,0|1,0,1]=4 425 B8R1.1 CC=C1C=CC(=O)O1 CNP0289286.0 [0,1,0,0,1,0|1,0,1]=4 426 B8R1.1 CCC1=CC=C(O1)C CNP0251701.0 [0,1,0,0,1,0|2,0,0]=4 427 B8R1.1 CCC1=CC=C(S1)C CNP0003636.0 [0,1,0,0,1,0|2,0,0]=4 428 B8R1.1 COC1=CN=C(S1)C CNP0335219.0 [0,1,0,0,1,0|2,0,0]=4 429 B8R1.1 CSC1=CC=C(O1)C CNP0304917.0 [0,1,0,0,1,0|1,1,0]=4 430 B8R1.1 CSC1=CC=C(S1)C CNP0231852.0 [0,1,0,0,1,0|1,1,0]=4 431 B8R1.1 NCC1=CC(=NO1)O CNP0352634.0 [0,1,0,0,1,0|2,0,0]=4 432 B8R1.1 O=C1C=CC(=N1)NO CNP0612038.0 [0,1,0,0,1,0|2,0,0]=4 433 B8R1.1 O=C1C=CC(=NO)N1 CNP0272476.0 [0,1,0,0,1,0|2,0,0]=4 434 B8R1.1 O=CC1=CC=C(O1)O CNP0326852.0 [0,1,0,0,1,0|1,0,1]=4 435 B8R1.1 O=NC1=CC=C(N1)O CNP0611370.0 [0,1,0,0,1,0|2,0,0]=4 436 B8R1.18 CC1=CC(=C(N1)C)C CNP0194129.0 [0,1,0,0,1,0|2,0,0]=4 437 B8R1.18 CC1=CC(=C(O1)C)C CNP0302629.0 [0,1,0,0,1,0|2,0,0]=4 438 B8R1.18 CC1=CC(=C(O1)C)S CNP0277106.0 [0,1,0,0,1,0|1,1,0]=4 439 B8R1.18 CC1=CC(=O)NC1=O CNP0134947.0 [0,1,0,0,1,0|1,0,1]=4 440 B8R1.18 CC1=CC(=O)OC1=O CNP0323366.0 [0,1,0,0,1,0|1,0,1]=4 441 B8R1.18 CC1=C[C@@H](N=C1O)O CNP0545516.1 [0,1,0,0,1,0|1,0,1]=4 442 B8R1.18 CC1=C[C@H](NC1=O)O CNP0240241.1 [0,1,0,0,1,0|1,0,1]=4 443 B8R1.18 CC1=C[C@H](OC1=O)O CNP0160871.1 [0,1,0,0,1,0|1,0,1]=4 444 B8R1.18 CC1C=C(C(=O)O1)O CNP0612035.0 [0,1,0,0,1,0|1,0,1]=4 445 B8R1.18 C[C@@H]1C=C(C(=O)C1)O CNP0171928.1 [0,1,0,0,1,0|0,0,2]=4 446 B8R1.18 O=C1N=C(C=C1Br)O CNP0598689.0 [0,1,0,0,1,0|2,0,0]=4 447 B8R1.50 CC1=CCC(=C1C)C CNP0578082.0 [0,1,0,0,1,0|1,0,1]=4 448 B8R1.50 C[C@H]1CC=C(C1=O)O CNP0292071.1 [0,1,0,0,1,0|0,0,2]=4 449 B8R1.50 O=C1C=CC(=C1O)O CNP0105932.0 [0,1,0,0,1,0|1,0,0]=3 450 B8R1.50 OC1=COC(=C1O)O CNP0555359.0 [0,1,0,0,1,0|2,0,0]=4 451 B10R1.302 CC1=CC=CC(C=C1)(C)C CNP0418898.0 [0,1,0,0,0,1|1,0,1]=4 452 B10R1.332 CC1=C(C=CC(=O)C=C1)Cl CNP0070609.0 [0,1,0,0,0,1|0,0,1]=3 453 B10R1.1 C=CCC1=CC=C(C=C1)C CNP0192313.0 [0,2,0,0,0,0|1,0,0]=3 454 B10R1.1 C=CCC1=CC=C(C=C1)O CNP0155812.0 [0,2,0,0,0,0|0,0,0]=2 455 B10R1.1 CC1=CC=C(C=C1)C=NO CNP0256781.0 [0,2,0,0,0,0|0,0,0]=2 456 B10R1.1 CC1=CC=C(C=C1)CC=O CNP0003643.0 [0,2,0,0,0,0|0,0,1]=3 457 B10R1.1 CC1=CC=C(C=C1)SC#N CNP0533747.0 [0,2,0,0,0,0|0,1,0]=3 458 B10R1.1 CC=CC1=CC=C(C=C1)C CNP0487359.0 [0,2,0,0,0,0|1,0,0]=3 459 B10R1.1 CC=CC1=CC=C(C=C1)O CNP0186527.0 [0,2,0,0,0,0|0,0,0]=2 460 B10R1.1 CCCC1=CC=C(C=C1)O CNP0049862.0 [0,2,0,0,0,0|0,0,0]=2 461 B10R1.1 CCCN1C=CC(=N)C=C1 CNP0126576.0 [0,2,0,0,0,0|2,0,0]=4 462 B10R1.1 CCNC1=CC=C(C=C1)C CNP0218913.0 [0,2,0,0,0,0|1,0,0]=3 463 B10R1.1 CCOC1=CC=C(C=C1)C CNP0163796.0 [0,2,0,0,0,0|0,0,0]=2 464 B10R1.1 CCOC1=CC=C(C=C1)N CNP0071165.0 [0,2,0,0,0,0|1,0,0]=3 465 B10R1.1 CCOC1=CC=C(C=C1)O CNP0003327.0 [0,2,0,0,0,0|0,0,0]=2 466 B10R1.1 CCOC1=CN=C(C=N1)C CNP0144720.0 [0,2,0,0,0,0|2,0,0]=4 467 B10R1.1 COCC1=CC=C(C=C1)O CNP0145249.0 [0,2,0,0,0,0|0,0,0]=2 468 B10R1.1 N#CCC1=CC=C(C=C1)O CNP0232327.0 [0,2,0,0,0,0|0,0,0]=2 469 B10R1.1 N#CNC1=CC=C(C=C1)Cl CNP0231069.0 [0,2,0,0,0,0|1,0,1]=4 470 B10R1.1 N#CSC1=CC=C(C=C1)O CNP0157204.0 [0,2,0,0,0,0|0,0,1]=3 471 B10R1.1 NC1=CC=C(C=C1)C=NO CNP0185919.0 [0,2,0,0,0,0|1,0,0]=3 472 B10R1.1 NC=CC1=CC=C(C=C1)O CNP0527921.0 [0,2,0,0,0,0|0,0,1]=3 473 B10R1.1 NCCC1=CC=C(C=C1)O CNP0111205.0 [0,2,0,0,0,0|0,0,0]=2 474 B10R1.1 O=CCC1=CC=C(C=C1)O CNP0103441.0 [0,2,0,0,0,0|0,0,0]=2 475 B10R1.1 OCCC1=CC=C(C=C1)O CNP0160217.0 [0,2,0,0,0,0|0,0,0]=2 476 B10R1.1 ON=CC1=CC=C(C=C1)Br CNP0046844.0 [0,2,0,0,0,0|1,0,0]=3 477 B10R1.1 ON=CC1=CC=C(C=C1)Cl CNP0036786.0 [0,2,0,0,0,0|1,0,0]=3 478 B10R1.1 ON=CC1=CC=C(C=C1)O CNP0057124.0 [0,2,0,0,0,0|0,0,1]=3 479 B10R1.1 [2H]/C=C\C1=CC=C(C=C1)O CNP0496441.0 [0,2,0,0,0,0|0,0,1]=3 480 B10R1.3 BrCC1=CC=C(C=C1)CBr CNP0025281.0 [0,2,0,0,0,0|1,0,0]=3 481 B10R1.3 C=CC1=CC=C(C=C1)C=C CNP0540510.0 [0,2,0,0,0,0|1,0,1]=4 482 B10R1.3 C=CC1=CC=C(C=C1)C=O CNP0512344.0 [0,2,0,0,0,0|0,0,2]=4 483 B10R1.3 C=CC1=CC=C(C=C1)CC CNP0084147.0 [0,2,0,0,0,0|1,0,0]=3 484 B10R1.3 C=CC1=CC=C(C=C1)CO CNP0018712.0 [0,2,0,0,0,0|0,0,1]=3 485 B10R1.3 C=CC1=CC=C(C=C1)OC CNP0327301.0 [0,2,0,0,0,0|0,0,1]=3 486 B10R1.3 CCC1=CC=C(C=C1)C#N CNP0223506.0 [0,2,0,0,0,0|1,0,0]=3 487 B10R1.3 CCC1=CC=C(C=C1)C=O CNP0279142.0 [0,2,0,0,0,0|0,0,1]=3 488 B10R1.3 CCC1=CC=C(C=C1)CC CNP0158802.0 [0,2,0,0,0,0|1,0,0]=3 489 B10R1.3 CCC1=CC=C(C=C1)OC CNP0330277.0 [0,2,0,0,0,0|0,0,0]=2 490 B10R1.3 CNC1=CC=C(C=C1)C=O CNP0246789.0 [0,2,0,0,0,0|0,0,1]=3 491 B10R1.3 COC1=CC=C(C=C1)C#N CNP0311472.0 [0,2,0,0,0,0|0,0,1]=3 492 B10R1.3 COC1=CC=C(C=C1)C=O CNP0234469.0 [0,2,0,0,0,0|0,0,1]=3 493 B10R1.3 COC1=CC=C(C=C1)C=S CNP0185667.0 [0,2,0,0,0,0|0,0,1]=3 494 B10R1.3 COC1=CC=C(C=C1)CN CNP0143724.0 [0,2,0,0,0,0|0,0,0]=2 495 B10R1.3 COC1=CC=C(C=C1)CO CNP0301946.0 [0,2,0,0,0,0|0,0,0]=2 496 B10R1.3 COC1=CC=C(C=C1)OC CNP0161668.0 [0,2,0,0,0,0|0,0,0]=2 497 B10R1.3 N#[N+]C1=CC=C(C=C1)CO CNP0355335.0 [0,2,0,0,0,0|1,0,0]=3 498 B10R1.3 O=CC1=CC=C(C=C1)C=O CNP0454004.0 [0,2,0,0,0,0|0,0,2]=4 499 B10R1.3 O=CC1=CC=C(C=C1)CBr CNP0064464.0 [0,2,0,0,0,0|0,0,1]=3 500 B10R1.13 C=C(C)C1=CC=C(C=C1)C CNP0302429.0 [0,2,0,0,0,0|1,0,0]=3 501 B10R1.13 C=C(C)C1=CC=C(N=C1)C CNP0550241.0 [0,2,0,0,0,0|2,0,0]=4 502 B10R1.13 CC(=O)C1=CC=C(C=C1)Br CNP0078494.0 [0,2,0,0,0,0|1,0,0]=3 503 B10R1.13 CC(=O)C1=CC=C(C=C1)C CNP0415909.0 [0,2,0,0,0,0|0,0,1]=3 504 B10R1.13 CC(=O)C1=CC=C(C=C1)I CNP0361256.0 [0,2,0,0,0,0|1,0,0]=3 505 B10R1.13 CC(=O)C1=CC=C(C=C1)N CNP0127987.0 [0,2,0,0,0,0|1,0,0]=3 506 B10R1.13 CC(=O)C1=CC=C(C=C1)O CNP0327993.0 [0,2,0,0,0,0|0,0,0]=2 507 B10R1.13 CC(=O)C1=CC=C(C=N1)C CNP0046782.0 [0,2,0,0,0,0|1,0,1]=4 508 B10R1.13 CC(=O)C1=CC=C(N=C1)C CNP0135801.0 [0,2,0,0,0,0|1,0,1]=4 509 B10R1.13 CC(C)C1=CC=C(C=C1)N CNP0455541.0 [0,2,0,0,0,0|1,0,0]=3 510 B10R1.13 CC(C)C1=CC=C(C=C1)O CNP0127505.0 [0,2,0,0,0,0|0,0,0]=2 511 B10R1.13 CC(N)C1=CC=C(C=C1)O CNP0292009.0 [0,2,0,0,0,0|0,0,0]=2 512 B10R1.13 CC1=CC=C(C=C1)C(=O)Br CNP0248072.0 [0,2,0,0,0,0|0,0,1]=3 513 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl CNP0150539.0 [0,2,0,0,0,0|0,0,1]=3 514 B10R1.13 CC1=CC=C(C=C1)C(=O)N CNP0158656.0 [0,2,0,0,0,0|0,0,1]=3 515 B10R1.13 CC1=CC=C(C=C1)C(=O)O CNP0232170.0 [0,2,0,0,0,0|0,0,0]=2 516 B10R1.13 CC1=CC=C(C=C1)C(C)C CNP0145577.0 [0,2,0,0,0,0|1,0,0]=3 517 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O CNP0154242.1 [0,2,0,0,0,0|0,0,0]=2 518 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O CNP0154242.2 [0,2,0,0,0,0|0,0,0]=2 519 B10R1.13 CC1=CC=C(C=N1)[C@H](C)N CNP0243226.1 [0,2,0,0,0,0|2,0,0]=4 520 B10R1.13 CN(C)C1=CC=C(C=C1)N CNP0581368.0 [0,2,0,0,0,0|1,0,0]=3 521 B10R1.13 CN(N)C1=CC=[N+](C=C1)[O-] CNP0580487.0 [0,2,0,0,0,0|1,0,1]=4 522 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)O CNP0112149.2 [0,2,0,0,0,0|0,0,0]=2 523 B10R1.13 C[C@H](O)C1=CC=C(C=C1)O CNP0112149.1 [0,2,0,0,0,0|0,0,0]=2 524 B10R1.13 N=C(N)C1=CC=C(C=C1)N CNP0095026.0 [0,2,0,0,0,0|1,0,1]=4 525 B10R1.13 NC(=O)C1=CC=C(C=C1)O CNP0330477.0 [0,2,0,0,0,0|0,0,1]=3 526 B10R1.13 NC1=CC=C(C=C1)C(=O)O CNP0152805.0 [0,2,0,0,0,0|1,0,0]=3 527 B10R1.13 NC1=CC=C(C=C1)C(=O)[O-] CNP0528356.0 [0,2,0,0,0,0|1,0,1]=4 528 B10R1.13 NC1=CC=C(C=C1)C(=O)[O-] CNP0585530.0 [0,2,0,0,0,0|1,0,1]=4 529 B10R1.13 NC1=CC=C(C=C1)[N+](=O)[O-] CNP0491985.0 [0,2,0,0,0,0|1,0,1]=4 530 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl CNP0147578.0 [0,2,0,0,0,0|1,0,0]=3 531 B10R1.13 O=C(O)C1=CC=C(C=C1)O CNP0253685.0 [0,2,0,0,0,0|0,0,1]=3 532 B10R1.13 O=C(O)C1=CC=C(C=C1)[Hg] CNP0481307.0 [0,2,0,0,0,0|1,0,0]=3 533 B10R1.13 O=C(O)C1=CC=C(C=C1)[O-] CNP0538591.0 [0,2,0,0,0,0|1,0,0]=3 534 B10R1.13 O=C(O)C1=CC=C(C=N1)O CNP0261665.0 [0,2,0,0,0,0|1,0,1]=4 535 B10R1.13 O=C(O)C1=CC=C(N=C1)O CNP0320055.0 [0,2,0,0,0,0|1,0,1]=4 536 B10R1.13 O=C(O)C1=CNC(=O)C=C1 CNP0533542.0 [0,2,0,0,0,0|2,0,0]=4 537 B10R1.13 O=C(O)C1=COC(=O)C=C1 CNP0363999.0 [0,2,0,0,0,0|2,0,0]=4 538 B10R1.13 O=C(S)C1=CC=C(C=C1)Br CNP0564653.0 [0,2,0,0,0,0|1,0,1]=4 539 B10R1.13 O=C([O-])C1=CC=C(C=C1)O CNP0600449.0 [0,2,0,0,0,0|0,0,1]=3 540 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O CNP0593615.0 [0,2,0,0,0,0|1,0,0]=3 541 B10R1.25 C=CC1=CC=C(C=C1C)C CNP0479270.0 [0,2,0,0,0,0|1,0,0]=3 542 B10R1.25 C=CC1=CC=C(C=C1O)O CNP0155671.0 [0,2,0,0,0,0|0,0,1]=3 543 B10R1.25 CC1=CC(=C(C=N1)C#N)C CNP0069171.0 [0,2,0,0,0,0|2,0,0]=4 544 B10R1.25 CC1=CC(=CC=C1N=O)N CNP0033954.0 [0,2,0,0,0,0|1,0,1]=4 545 B10R1.25 CC1=CC(=O)C=CC1=NO CNP0220999.0 [0,2,0,0,0,0|1,0,0]=3 546 B10R1.25 CC1=CC=C(C(=C1)C)C#N CNP0033930.0 [0,2,0,0,0,0|1,0,0]=3 547 B10R1.25 CC1=CC=C(C(=C1)C)C=O CNP0194374.0 [0,2,0,0,0,0|0,0,1]=3 548 B10R1.25 CC1=CC=C(C(=C1)C)CCl CNP0377096.0 [0,2,0,0,0,0|1,0,0]=3 549 B10R1.25 CC1=CC=C(C(=C1)C)CO CNP0490250.0 [0,2,0,0,0,0|0,0,0]=2 550 B10R1.25 CC1=CC=C(C(=C1)Cl)C#N CNP0353020.0 [0,2,0,0,0,0|1,0,0]=3 551 B10R1.25 CC1=CC=C(C(=C1)O)C=O CNP0384037.0 [0,2,0,0,0,0|0,0,1]=3 552 B10R1.25 CC1=NC=C(C(=N)N1)CO CNP0546737.0 [0,2,0,0,0,0|2,0,0]=4 553 B10R1.25 CC1=NC=C(C(=N1)N)CO CNP0300516.0 [0,2,0,0,0,0|2,0,0]=4 554 B10R1.25 CCC1=CC=C(C=C1C)C CNP0219596.0 [0,2,0,0,0,0|1,0,0]=3 555 B10R1.25 CCC1=CC=C(C=C1O)C CNP0289222.0 [0,2,0,0,0,0|1,0,0]=3 556 B10R1.25 CCC1=CC=C(C=C1O)O CNP0279225.0 [0,2,0,0,0,0|0,0,0]=2 557 B10R1.25 CCC1=CN=C(N=C1O)O CNP0514605.0 [0,2,0,0,0,0|2,0,0]=4 558 B10R1.25 COC1=CC=C(C=C1Br)Br CNP0018124.0 [0,2,0,0,0,0|1,0,0]=3 559 B10R1.25 COC1=CC=C(C=C1C)C CNP0076750.0 [0,2,0,0,0,0|0,0,0]=2 560 B10R1.25 COC1=CC=C(C=C1C)O CNP0142095.0 [0,2,0,0,0,0|0,0,0]=2 561 B10R1.25 COC1=CC=C(C=C1I)I CNP0051717.0 [0,2,0,0,0,0|1,0,0]=3 562 B10R1.25 COC1=CC=C(C=C1N)C CNP0028982.0 [0,2,0,0,0,0|0,0,0]=2 563 B10R1.25 COC1=CC=C(C=C1N)O CNP0285627.0 [0,2,0,0,0,0|0,0,0]=2 564 B10R1.25 COC1=CC=C(C=C1O)C CNP0345030.0 [0,2,0,0,0,0|0,0,0]=2 565 B10R1.25 COC1=CC=C(C=C1O)O CNP0160849.0 [0,2,0,0,0,0|0,0,0]=2 566 B10R1.25 COC1=CC=[N+](C=C1C)[O-] CNP0606691.0 [0,2,0,0,0,0|1,0,1]=4 567 B10R1.25 COC1=NC=C(N=C1C)C CNP0234083.0 [0,2,0,0,0,0|2,0,0]=4 568 B10R1.25 N#CC1=CC=C(C=C1O)O CNP0293189.0 [0,2,0,0,0,0|0,0,1]=3 569 B10R1.25 O=CC1=CC=C(C=C1O)O CNP0382408.0 [0,2,0,0,0,0|0,0,1]=3 570 B10R1.25 OCC1=CC=C(C=C1Cl)Cl CNP0569884.0 [0,2,0,0,0,0|1,0,0]=3 571 B10R1.25 OCC1=CN=C(N=C1O)O CNP0334383.0 [0,2,0,0,0,0|2,0,0]=4 572 B10R1.176 C=CC1=CC=C(C(=C1)C)C CNP0083008.0 [0,2,0,0,0,0|1,0,0]=3 573 B10R1.176 C=CC1=CC=C(C(=C1)O)O CNP0218096.0 [0,2,0,0,0,0|0,0,1]=3 574 B10R1.176 CC1=CC(=CC=C1N)N=O CNP0042604.0 [0,2,0,0,0,0|1,0,1]=4 575 B10R1.176 CC1=CC(=CC=C1O)C=O CNP0018890.0 [0,2,0,0,0,0|0,0,1]=3 576 B10R1.176 CC1=CC(=NO)C=CC1=O CNP0254335.0 [0,2,0,0,0,0|1,0,0]=3 577 B10R1.176 CC1=CC=C(C=C1C)C#N CNP0181583.0 [0,2,0,0,0,0|1,0,0]=3 578 B10R1.176 CC1=CC=C(C=C1C)CO CNP0515257.0 [0,2,0,0,0,0|0,0,0]=2 579 B10R1.176 CC1=NC=C(N=C1C)CO CNP0333058.0 [0,2,0,0,0,0|2,0,0]=4 580 B10R1.176 CCC1=CC=C(C(=C1)C)C CNP0111798.0 [0,2,0,0,0,0|1,0,0]=3 581 B10R1.176 CCC1=CC=C(C(=C1)C)O CNP0271974.0 [0,2,0,0,0,0|0,0,0]=2 582 B10R1.176 CCC1=CC=C(C(=C1)O)C CNP0152157.0 [0,2,0,0,0,0|1,0,0]=3 583 B10R1.176 CCC1=CC=C(C(=C1)O)O CNP0344368.0 [0,2,0,0,0,0|0,0,0]=2 584 B10R1.176 CCC1=CC=C(C(=N1)C)C CNP0105764.0 [0,2,0,0,0,0|2,0,0]=4 585 B10R1.176 COC1=CC=C(C(=C1)C)Br CNP0334567.0 [0,2,0,0,0,0|1,0,0]=3 586 B10R1.176 COC1=CC=C(C(=C1)C)Cl CNP0187648.0 [0,2,0,0,0,0|1,0,0]=3 587 B10R1.176 COC1=CC=C(C(=C1)C)O CNP0175131.0 [0,2,0,0,0,0|0,0,0]=2 588 B10R1.176 COC1=CC=C(C(=C1)Cl)Cl CNP0369428.0 [0,2,0,0,0,0|1,0,0]=3 589 B10R1.176 COC1=CC=C(C(=C1)N)O CNP0323578.0 [0,2,0,0,0,0|0,0,0]=2 590 B10R1.176 COC1=CC=C(C(=C1)O)O CNP0241033.0 [0,2,0,0,0,0|0,0,0]=2 591 B10R1.176 N#CC1=CC=C(C(=C1)O)O CNP0155663.0 [0,2,0,0,0,0|0,0,1]=3 592 B10R1.176 NC1=CC(=CC=C1O)C=O CNP0343365.0 [0,2,0,0,0,0|0,0,1]=3 593 B10R1.176 NCC1=CC=C(C(=C1)O)O CNP0353669.0 [0,2,0,0,0,0|0,0,0]=2 594 B10R1.176 O=C1C=C(OC=C1O)CO CNP0328434.0 [0,2,0,0,0,0|1,0,0]=3 595 B10R1.176 O=CC1=CC=C(C(=C1)Br)O CNP0212461.0 [0,2,0,0,0,0|0,0,1]=3 596 B10R1.176 O=CC1=CC=C(C(=C1)Cl)Cl CNP0066778.0 [0,2,0,0,0,0|1,0,1]=4 597 B10R1.176 O=CC1=CC=C(C(=C1)O)O CNP0203672.0 [0,2,0,0,0,0|0,0,1]=3 598 B10R1.176 OCC1=CC=C(C(=C1)Br)O CNP0161139.0 [0,2,0,0,0,0|0,0,0]=2 599 B10R1.176 OCC1=CC=C(C(=C1)O)O CNP0262481.0 [0,2,0,0,0,0|0,0,0]=2 600 B10R1.22 CC1=C(C=C(C=C1Cl)S)Cl CNP0108382.0 [0,2,0,0,0,0|0,1,0]=3 601 B10R1.22 CC1=C(C=C(C=C1O)O)O CNP0270802.0 [0,2,0,0,0,0|0,0,0]=2 602 B10R1.22 CC1=CC(=C(C(=C1)Br)I)Cl CNP0179139.0 [0,2,0,0,0,0|1,0,0]=3 603 B10R1.22 CC1=CC(=C(C(=C1)Br)N)Cl CNP0063027.0 [0,2,0,0,0,0|1,0,0]=3 604 B10R1.22 CC1=CC(=C(C(=C1)Br)N)N CNP0039347.0 [0,2,0,0,0,0|1,0,0]=3 605 B10R1.22 CC1=CC(=C(C(=C1)Br)O)Br CNP0242146.0 [0,2,0,0,0,0|0,0,0]=2 606 B10R1.22 CC1=CC(=C(C(=C1)C)C)C CNP0375454.0 [0,2,0,0,0,0|1,0,0]=3 607 B10R1.22 CC1=CC(=C(C(=C1)C)N)C CNP0072418.0 [0,2,0,0,0,0|1,0,0]=3 608 B10R1.22 CC1=CC(=C(C(=C1)C)O)C CNP0321032.0 [0,2,0,0,0,0|0,0,0]=2 609 B10R1.22 CC1=CC(=C(C(=C1)Cl)Br)Cl CNP0296853.0 [0,2,0,0,0,0|1,0,0]=3 610 B10R1.22 CC1=CC(=C(C(=C1)Cl)N)N CNP0097451.0 [0,2,0,0,0,0|1,0,0]=3 611 B10R1.22 CC1=CC(=C(C(=C1)N)C)C CNP0027884.0 [0,2,0,0,0,0|1,0,0]=3 612 B10R1.22 CC1=CC(=C(C(=C1)O)C)C CNP0281157.0 [0,2,0,0,0,0|1,0,0]=3 613 B10R1.22 CC1=CC(=C(C(=C1)O)C)O CNP0156178.0 [0,2,0,0,0,0|1,0,0]=3 614 B10R1.22 CC1=CC(=C(C(=C1)O)Cl)O CNP0171455.0 [0,2,0,0,0,0|1,0,0]=3 615 B10R1.22 CC1=CC(=C(C(=C1)O)O)C CNP0386654.0 [0,2,0,0,0,0|0,0,0]=2 616 B10R1.22 CC1=CC(=C(C(=C1)O)O)O CNP0266425.0 [0,2,0,0,0,0|0,0,0]=2 617 B10R1.22 CC1=CC(=C(C(=N1)C)C)C CNP0182494.0 [0,2,0,0,0,0|2,0,0]=4 618 B10R1.22 CC1=CC(=C(C(=O)O1)C)O CNP0371588.0 [0,2,0,0,0,0|2,0,0]=4 619 B10R1.22 CC1=CC(=CC(=C1C)C)N CNP0214882.0 [0,2,0,0,0,0|1,0,0]=3 620 B10R1.22 CC1=CC(=CC(=C1C)C)O CNP0208232.0 [0,2,0,0,0,0|0,0,0]=2 621 B10R1.22 CC1=CC(=CC(=C1C)O)O CNP0138651.0 [0,2,0,0,0,0|0,0,0]=2 622 B10R1.22 CC1=CC(=CC(=C1Cl)C)O CNP0229378.0 [0,2,0,0,0,0|1,0,0]=3 623 B10R1.22 CC1=CC(=CC(=C1Cl)O)O CNP0283107.0 [0,2,0,0,0,0|1,0,0]=3 624 B10R1.22 CC1=CC(=CC(=C1N)C)I CNP0086270.0 [0,2,0,0,0,0|2,0,0]=4 625 B10R1.22 CC1=CC(=CC(=C1O)C)O CNP0107250.0 [0,2,0,0,0,0|1,0,0]=3 626 B10R1.22 CC1=CC(=CC(=C1O)O)O CNP0249116.0 [0,2,0,0,0,0|1,0,0]=3 627 B10R1.22 CC1=CC(=O)C=C(C1=O)C CNP0081563.0 [0,2,0,0,0,0|1,0,1]=4 628 B10R1.22 CC1=CC(=O)C=C(C1=O)O CNP0106705.0 [0,2,0,0,0,0|1,0,1]=4 629 B10R1.22 CC1=CC(=[N+](C(=C1)C)[O-])C CNP0516353.0 [0,2,0,0,0,0|1,0,1]=4 630 B10R1.22 NC1=C(C=C(C=C1Br)Br)Br CNP0057961.0 [0,2,0,0,0,0|2,0,0]=4 631 B10R1.22 NC1=C(C=C(C=C1Cl)Cl)Cl CNP0036320.0 [0,2,0,0,0,0|2,0,0]=4 632 B10R1.22 NC1=CC(=C(C(=C1)O)O)N CNP0223457.0 [0,2,0,0,0,0|1,0,0]=3 633 B10R1.22 NC1=CC(=O)C=C(C1=O)O CNP0072657.0 [0,2,0,0,0,0|1,0,1]=4 634 B10R1.22 O=C1C=C(C(=O)C(=C1)Br)Br CNP0157909.0 [0,2,0,0,0,0|1,0,1]=4 635 B10R1.22 O=C1C=C(C(=O)C(=C1)O)O CNP0322998.0 [0,2,0,0,0,0|1,0,1]=4 636 B10R1.22 OC1=C(C=C(C=C1Br)Br)Br CNP0415243.0 [0,2,0,0,0,0|1,0,0]=3 637 B10R1.22 OC1=C(C=C(C=C1Br)Br)Cl CNP0017890.0 [0,2,0,0,0,0|1,0,0]=3 638 B10R1.22 OC1=C(C=C(C=C1Br)Cl)Br CNP0371629.0 [0,2,0,0,0,0|1,0,0]=3 639 B10R1.22 OC1=C(C=C(C=C1Br)Cl)Cl CNP0322036.0 [0,2,0,0,0,0|1,0,0]=3 640 B10R1.22 OC1=C(C=C(C=C1Cl)I)Cl CNP0173173.0 [0,2,0,0,0,0|1,0,0]=3 641 B10R1.22 OC1=CC(=C(C(=C1)Br)Br)O CNP0224842.0 [0,2,0,0,0,0|1,0,0]=3 642 B10R1.22 OC1=CC(=C(C(=C1)Br)O)Br CNP0113606.0 [0,2,0,0,0,0|1,0,0]=3 643 B10R1.22 OC1=CC(=C(C(=C1)Cl)O)Cl CNP0083796.0 [0,2,0,0,0,0|1,0,0]=3 644 B10R1.22 OC1=CC(=C(C(=C1)I)O)I CNP0313558.0 [0,2,0,0,0,0|1,0,0]=3 645 B10R1.22 OC1=CC(=C(C(=C1)O)Br)O CNP0173865.0 [0,2,0,0,0,0|1,0,0]=3 646 B10R1.22 OC1=CC(=C(C(=C1)O)Cl)O CNP0254438.0 [0,2,0,0,0,0|1,0,0]=3 647 B10R1.22 OC1=CC(=C(C(=C1)O)I)O CNP0053849.0 [0,2,0,0,0,0|1,0,0]=3 648 B10R1.22 OC1=CC(=C(C(=C1)O)O)O CNP0134222.0 [0,2,0,0,0,0|1,0,0]=3 649 B10R1.22 OC1=CC(=CC(=C1O)Br)Br CNP0081702.0 [0,2,0,0,0,0|1,0,0]=3 650 B10R1.22 OC1=CC(=CC(=C1O)Cl)Cl CNP0598413.0 [0,2,0,0,0,0|1,0,0]=3 651 B10R1.30 C=CC1=CC(=CC=C1C)C CNP0027363.0 [0,2,0,0,0,0|1,0,0]=3 652 B10R1.30 CC1=CC=C(C(=C1)C#N)C CNP0233289.0 [0,2,0,0,0,0|1,0,0]=3 653 B10R1.30 CC1=CC=C(C(=C1)C#N)Cl CNP0033668.0 [0,2,0,0,0,0|1,0,0]=3 654 B10R1.30 CC1=CC=C(C(=C1)C=O)C CNP0076382.0 [0,2,0,0,0,0|1,0,0]=3 655 B10R1.30 CC1=CC=C(C(=C1)CO)C CNP0281493.0 [0,2,0,0,0,0|1,0,0]=3 656 B10R1.30 CC1=CC=[N+](C=C1C#N)[O-] CNP0495146.0 [0,2,0,0,0,0|1,0,1]=4 657 B10R1.30 CC1=CC=[N+](C=C1CO)[O-] CNP0579255.0 [0,2,0,0,0,0|1,0,1]=4 658 B10R1.30 CCC1=CC(=CC=C1C)C CNP0220953.0 [0,2,0,0,0,0|1,0,0]=3 659 B10R1.30 CCC1=CC(=CC=C1C)O CNP0305920.0 [0,2,0,0,0,0|0,0,0]=2 660 B10R1.30 CCC1=CC(=CC=C1O)C CNP0329742.0 [0,2,0,0,0,0|0,0,0]=2 661 B10R1.30 CCC1=CC(=CC=C1O)O CNP0246876.0 [0,2,0,0,0,0|1,0,0]=3 662 B10R1.30 CCC1=CC(=O)C=CC1=O CNP0391524.0 [0,2,0,0,0,0|1,0,1]=4 663 B10R1.30 CCC1=NC(=CC=C1O)C CNP0422716.0 [0,2,0,0,0,0|1,0,0]=3 664 B10R1.30 CN1C=CC(=O)C(=C1)C#N CNP0196141.0 [0,2,0,0,0,0|1,0,1]=4 665 B10R1.30 CN1C=CC(=O)C=C1C#N CNP0198738.0 [0,2,0,0,0,0|1,0,1]=4 666 B10R1.30 COC1=CC(=CC=C1C)C CNP0250959.0 [0,2,0,0,0,0|1,0,0]=3 667 B10R1.30 COC1=CC(=CC=C1N)O CNP0304667.0 [0,2,0,0,0,0|1,0,0]=3 668 B10R1.30 COC1=CC(=CC=C1O)C CNP0264266.0 [0,2,0,0,0,0|0,0,0]=2 669 B10R1.30 COC1=CC(=CC=C1O)O CNP0204166.0 [0,2,0,0,0,0|1,0,0]=3 670 B10R1.30 COC1=CC(=N)C=CC1=O CNP0141181.0 [0,2,0,0,0,0|1,0,1]=4 671 B10R1.30 COC1=CC(=O)C=CC1=O CNP0221542.0 [0,2,0,0,0,0|1,0,1]=4 672 B10R1.30 N#CC1=CC(=CC=C1O)O CNP0284631.0 [0,2,0,0,0,0|1,0,0]=3 673 B10R1.30 O=C1C=C(C(=CO1)O)CO CNP0349514.0 [0,2,0,0,0,0|2,0,0]=4 674 B10R1.30 O=C1C=CC(=O)C(=C1)CO CNP0212904.0 [0,2,0,0,0,0|1,0,1]=4 675 B10R1.30 O=C1OC=C(C=C1CO)O CNP0541420.0 [0,2,0,0,0,0|2,0,0]=4 676 B10R1.30 O=CC1=CC(=CC=C1O)O CNP0326066.0 [0,2,0,0,0,0|1,0,0]=3 677 B10R1.30 OCC1=CC(=CC=C1Cl)O CNP0112835.0 [0,2,0,0,0,0|1,0,0]=3 678 B10R1.30 OCC1=CC(=CC=C1O)O CNP0290995.0 [0,2,0,0,0,0|1,0,0]=3 679 B10R1.118 BrC1=C(C=C(C(=C1)Br)Br)Br CNP0049506.0 [0,2,0,0,0,0|2,0,0]=4 680 B10R1.118 CC1=C(C=C(C(=C1)C)C)C CNP0218764.0 [0,2,0,0,0,0|1,0,0]=3 681 B10R1.118 CC1=CC(=C(C=C1Br)C)Br CNP0024349.0 [0,2,0,0,0,0|1,0,0]=3 682 B10R1.118 CC1=CC(=C(C=C1C)N)N CNP0106845.0 [0,2,0,0,0,0|1,0,0]=3 683 B10R1.118 CC1=CC(=C(C=C1C)O)C CNP0242109.0 [0,2,0,0,0,0|0,0,0]=2 684 B10R1.118 CC1=CC(=C(C=C1Cl)C)Cl CNP0062326.0 [0,2,0,0,0,0|1,0,0]=3 685 B10R1.118 CC1=CC(=C(C=C1O)C)O CNP0533659.0 [0,2,0,0,0,0|1,0,0]=3 686 B10R1.118 CC1=CC(=C(N=C1C)C)C CNP0272756.0 [0,2,0,0,0,0|2,0,0]=4 687 B10R1.118 CC1=CC(=O)C(=CC1=O)C CNP0221747.0 [0,2,0,0,0,0|1,0,0]=3 688 B10R1.118 CC1=CC(=O)C(=CC1=O)O CNP0288982.0 [0,2,0,0,0,0|0,0,0]=2 689 B10R1.118 CC1=CN(C(=O)N=C1O)C CNP0516273.0 [0,2,0,0,0,0|2,0,0]=4 690 B10R1.118 O=C1C=C(C(=O)C=C1O)O CNP0327645.0 [0,2,0,0,0,0|1,0,0]=3 691 B10R1.118 OC1=C(C=C(C(=C1)O)O)O CNP0611719.0 [0,2,0,0,0,0|1,0,0]=3 692 B10R1.118 OC1=CC(=C(C=C1Cl)O)Cl CNP0067457.0 [0,2,0,0,0,0|1,0,0]=3 693 B10R1.118 OC1=CC(=C(C=C1O)Br)Br CNP0556999.0 [0,2,0,0,0,0|1,0,0]=3 694 B10R1.118 OC1=NC(=C(C=C1Cl)Cl)Cl CNP0363725.0 [0,2,0,0,0,0|2,0,0]=4 695 B10R1.119 CC1=C(C(=O)C(=CO1)C)O CNP0126465.0 [0,2,0,0,0,0|2,0,0]=4 696 B10R1.119 CC1=C(C(=O)C(=CO1)O)O CNP0249032.0 [0,2,0,0,0,0|1,0,0]=3 697 B10R1.119 CC1=C(C(=O)C=CC1=O)C CNP0252044.0 [0,2,0,0,0,0|1,0,1]=4 698 B10R1.119 CC1=C(C(=O)C=CC1=O)O CNP0304817.0 [0,2,0,0,0,0|1,0,1]=4 699 B10R1.119 CC1=C(C(=O)C=CN1C)O CNP0409474.0 [0,2,0,0,0,0|1,0,1]=4 700 B10R1.119 CC1=C(C=CC(=C1C)O)N CNP0562106.0 [0,2,0,0,0,0|1,0,0]=3 701 B10R1.119 CC1=C(C=CC(=C1C)O)O CNP0119775.0 [0,2,0,0,0,0|1,0,0]=3 702 B10R1.119 CC1=C(C=CC(=C1O)O)O CNP0354287.0 [0,2,0,0,0,0|1,0,0]=3 703 B10R1.119 CC1=CC=C(C(=C1C)C)C CNP0376974.0 [0,2,0,0,0,0|1,0,0]=3 704 B10R1.119 CC1=CC=C(C(=C1C)O)C CNP0224100.0 [0,2,0,0,0,0|1,0,0]=3 705 B10R1.119 CC1=CC=C(C(=C1C)O)O CNP0352924.0 [0,2,0,0,0,0|0,0,0]=2 706 B10R1.119 CC1=CC=C(C(=C1Cl)C)S CNP0345116.0 [0,2,0,0,0,0|0,1,0]=3 707 B10R1.119 CC1=CC=C(C(=C1O)C)O CNP0142427.0 [0,2,0,0,0,0|0,0,0]=2 708 B10R1.119 CC1=CC=C(C(=C1O)O)C CNP0183636.0 [0,2,0,0,0,0|1,0,0]=3 709 B10R1.119 CC1=CN=C(C(=C1C)C)C CNP0265742.0 [0,2,0,0,0,0|2,0,0]=4 710 B10R1.119 CC1=CN=C(N(C1=O)C)O CNP0559149.0 [0,2,0,0,0,0|2,0,0]=4 711 B10R1.119 ClC1=CC=C(C(=C1Cl)Cl)Cl CNP0445745.0 [0,2,0,0,0,0|2,0,0]=4 712 B10R1.119 NC1=CC=C(C(=C1Br)N)Br CNP0090854.0 [0,2,0,0,0,0|2,0,0]=4 713 B10R1.119 O=C1C=CC(=O)C(=C1O)O CNP0263917.0 [0,2,0,0,0,0|1,0,1]=4 714 B10R1.119 OC1=C(C=CC(=C1O)Cl)Cl CNP0043594.0 [0,2,0,0,0,0|2,0,0]=4 715 B10R1.119 OC1=CC=C(C(=C1Br)Br)Br CNP0133044.0 [0,2,0,0,0,0|1,0,0]=3 716 B10R1.119 OC1=CC=C(C(=C1Br)O)Br CNP0192123.0 [0,2,0,0,0,0|1,0,0]=3 717 B10R1.119 OC1=CC=C(C(=C1O)O)O CNP0189021.0 [0,2,0,0,0,0|1,0,0]=3 718 B8R1.22 O=C1C=CC=CC=C1 CNP0609083.0 [0,0,1,1,0,0|0,0,2]=4 719 B8R2.25 C1=CC2OC2C=C1 CNP0472206.0 [1,0,0,1,0,0|0,0,2]=4 720 B8R2.25 C1=CC=C2CC2=C1 CNP0076757.0 [1,0,0,1,0,0|0,0,0]=2 721 B6R0.2 CC(=CC(=O)O)C CNP0191929.0 [0,0,1,0,1,0|1,0,1]=4 722 B6R0.2 CC(=CC(=O)O)O CNP0487751.0 [0,0,1,0,1,0|2,0,0]=4 723 B6R0.2 CC(=O)C=C(C)O CNP0344390.0 [0,0,1,0,1,0|1,0,1]=4 724 B6R1.2 C=C1C=CC=N1 CNP0533988.0 [1,0,0,0,1,0|1,0,1]=4 725 B6R1.2 CC1=CC=CN1 CNP0003130.0 [1,0,0,0,1,0|1,0,0]=3 726 B6R1.2 CC1=CC=CO1 CNP0204821.0 [1,0,0,0,1,0|1,0,0]=3 727 B6R1.2 CC1=CC=CS1 CNP0308280.0 [1,0,0,0,1,0|1,0,0]=3 728 B6R1.2 CC1=CN=CN1 CNP0175437.0 [1,0,0,0,1,0|2,0,0]=4 729 B6R1.2 CC1=CN=CS1 CNP0003129.0 [1,0,0,0,1,0|2,0,0]=4 730 B6R1.2 CC1=CNC=C1 CNP0578230.0 [1,0,0,0,1,0|1,0,0]=3 731 B6R1.2 CC1=CNC=N1 CNP0484047.0 [1,0,0,0,1,0|2,0,0]=4 732 B6R1.2 CC1=CNN=C1 CNP0179752.0 [1,0,0,0,1,0|2,0,0]=4 733 B6R1.2 CC1=COC=C1 CNP0401605.0 [1,0,0,0,1,0|1,0,0]=3 734 B6R1.2 CC1=CSC=C1 CNP0153726.0 [1,0,0,0,1,0|1,0,0]=3 735 B6R1.2 CC1=CSC=N1 CNP0121199.0 [1,0,0,0,1,0|2,0,0]=4 736 B6R1.2 CC1=NC=CS1 CNP0611676.0 [1,0,0,0,1,0|2,0,0]=4 737 B6R1.2 CN1C=CC=C1 CNP0084622.0 [1,0,0,0,1,0|1,0,0]=3 738 B6R1.2 CN1C=CN=C1 CNP0492624.0 [1,0,0,0,1,0|2,0,0]=4 739 B6R1.2 NN1C=CC=C1 CNP0148646.0 [1,0,0,0,1,0|2,0,0]=4 740 B6R1.2 OC1=CC=CO1 CNP0600093.0 [1,0,0,0,1,0|1,0,0]=3 741 B6R1.2 OC1=CON=C1 CNP0302207.0 [1,0,0,0,1,0|2,0,0]=4 742 B6R1.2 SC1=CC=CS1 CNP0113015.0 [1,0,0,0,1,0|1,1,0]=4 743 B6R1.2 SC1=CSC=C1 CNP0208450.0 [1,0,0,0,1,0|1,1,0]=4 744 B8R0.28 C=C(C)C=CCC(=C)C CNP0611898.0 [0,0,1,0,0,1|1,0,0]=3