0 B10R1.25 C=CC1=CC=C(C=C1C)C CNP0479270.0 [0,0,0,0,0,0|1,0,1]=2 1 B10R1.25 C=CC1=CC=C(C=C1O)O CNP0155671.0 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.25 C=CC1=NC=C(N=C1C)C CNP0178869.0 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.25 CC1=CC(=C(C=N1)C#N)C CNP0069171.0 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.25 CC1=CC(=CC=C1N=O)N CNP0033954.0 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.25 CC1=CC(=O)C=CC1=NO CNP0220999.0 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.25 CC1=CC=C(C(=C1)C)C#N CNP0033930.0 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.25 CC1=CC=C(C(=C1)C)C=O CNP0194374.0 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.25 CC1=CC=C(C(=C1)C)CCl CNP0377096.0 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.25 CC1=CC=C(C(=C1)C)CO CNP0490250.0 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.25 CC1=CC=C(C(=C1)Cl)C#N CNP0353020.0 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.25 CC1=CC=C(C(=C1)O)C=O CNP0384037.0 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.25 CCC1=CC=C(C=C1C)C CNP0219596.0 [0,0,0,0,0,0|1,0,0]=1 13 B10R1.25 CCC1=CC=C(C=C1O)C CNP0289222.0 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.25 CCC1=CC=C(C=C1O)O CNP0279225.0 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.25 CCC1=NC=C(N=C1C)C CNP0193103.0 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.25 COC1=CC=C(C=C1Br)Br CNP0018124.0 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.25 COC1=CC=C(C=C1C)C CNP0076750.0 [0,0,0,0,0,0|0,0,0]=0 18 B10R1.25 COC1=CC=C(C=C1C)O CNP0142095.0 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.25 COC1=CC=C(C=C1I)I CNP0051717.0 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.25 COC1=CC=C(C=C1N)C CNP0028982.0 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.25 COC1=CC=C(C=C1N)O CNP0285627.0 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.25 COC1=CC=C(C=C1O)C CNP0345030.0 [0,0,0,0,0,0|1,0,0]=1 23 B10R1.25 COC1=CC=C(C=C1O)O CNP0160849.0 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.25 COC1=CC=[N+](C=C1C)[O-] CNP0606691.0 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.25 COC1=NC=C(N=C1C)C CNP0234083.0 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.25 N#CC1=CC=C(C=C1O)O CNP0293189.0 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.25 O=CC1=CC=C(C=C1O)O CNP0382408.0 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.25 OCC1=CC=C(C=C1Cl)Cl CNP0569884.0 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.1 C=CC1=CC=C(C=C1)C CNP0003402.0 [1,0,0,0,0,0|1,0,1]=3 30 B9R1.1 C=CC1=CC=C(C=C1)O CNP0119518.0 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.1 CC1=CC=C(C=C1)C#N CNP0319761.0 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.1 CC1=CC=C(C=C1)C=O CNP0234694.0 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.1 CC1=CC=C(C=C1)CO CNP0002396.0 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.1 CC1=CC=C(C=C1)I=O CNP0508059.0 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.1 CC1=CC=C(C=C1)N=O CNP0522636.0 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.1 CCC1=CC=C(C=C1)Br CNP0211844.0 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.1 CCC1=CC=C(C=C1)C CNP0119285.0 [1,0,0,0,0,0|1,0,0]=2 38 B9R1.1 CCC1=CC=C(C=C1)N CNP0166611.0 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.1 CCC1=CC=C(C=C1)O CNP0299375.0 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.1 CCC1=CC=C(C=N1)C CNP0185750.0 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.1 CCC1=CC=C(N=C1)C CNP0341471.0 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.1 CCC1=CN=C(C=N1)C CNP0183380.0 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.1 CCN1C=CC(=N)C=C1 CNP0467750.0 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.1 CCN1C=CC(=[N])C=C1 CNP0554973.0 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.1 CNC1=CC=C(C=C1)O CNP0036253.0 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.1 COC1=CC=C(C=C1)C CNP0160002.0 [1,0,0,0,0,0|0,0,0]=1 47 B9R1.1 COC1=CC=C(C=C1)N CNP0027059.0 [1,0,0,0,0,0|1,0,0]=2 48 B9R1.1 COC1=CC=C(C=C1)O CNP0236213.0 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.1 COC1=CN=C(C=N1)C CNP0002521.0 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.1 CSC1=CN=C(C=N1)C CNP0168152.0 [1,0,0,0,0,0|2,1,0]=4 51 B9R1.1 N#CC1=CC=C(C=C1)N CNP0174653.0 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.1 N#CC1=CC=C(C=C1)O CNP0148599.0 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.1 N#[N+]C1=CC=C(C=C1)O CNP0595965.0 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.1 N#[N+]C1=CC=C(C=C1)[O-] CNP0612185.0 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 NC1=CC=C(C=C1)C=O CNP0263657.0 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.1 NCC1=CC=C(C=C1)O CNP0106686.0 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.1 O=CC1=CC=C(C=C1)O CNP0230702.0 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 O=NC1=CC=C(C=C1)Br CNP0452912.0 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 OCC1=CC=C(C=C1)Br CNP0519580.0 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 OCC1=CC=C(C=C1)O CNP0103281.0 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.1 [N-]=[N+]=C1C=CC(=O)C=C1 CNP0540787.0 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.15 C=CC1=CC=CC=C1C CNP0569304.0 [1,0,0,0,0,0|1,0,1]=3 63 B9R1.15 C=CC1=CC=CC=C1O CNP0164207.0 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.15 CC1=CC=CC=C1C#N CNP0120357.0 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.15 CC1=CC=CC=C1C=O CNP0312869.0 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.15 CC1=CC=CC=C1CCl CNP0029564.0 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.15 CC1=CC=CC=C1CO CNP0113926.0 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.15 CC1=CC=CC=C1I=O CNP0563313.0 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.15 CC1=CC=CN=C1N=O CNP0071253.0 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.15 CC1=CC=NC=C1CO CNP0046684.0 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 CCC1=CC=CC=C1Br CNP0315528.0 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.15 CCC1=CC=CC=C1C CNP0106326.0 [1,0,0,0,0,0|1,0,0]=2 73 B9R1.15 CCC1=CC=CC=C1N CNP0197081.0 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.15 CCC1=CC=CC=C1O CNP0206933.0 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.15 CCC1=CC=CC=C1S CNP0371262.0 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.15 CCC1=CN=CC=C1C CNP0308912.0 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.15 CCC1=NC=CC=C1O CNP0052915.0 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.15 CCC1=NC=CN=C1C CNP0243820.0 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.15 CC[N+]1=CC=CC=C1C CNP0536214.0 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.15 COC1=CC=CC=C1C CNP0180967.0 [1,0,0,0,0,0|0,0,0]=1 81 B9R1.15 COC1=CC=CC=C1N CNP0071243.0 [1,0,0,0,0,0|1,0,0]=2 82 B9R1.15 COC1=CC=CC=C1O CNP0269885.0 [1,0,0,0,0,0|1,0,0]=2 83 B9R1.15 COC1=CCC=CC1=O CNP0023044.0 [1,0,0,0,0,0|1,0,1]=3 84 B9R1.15 COC1=CN=CC=C1O CNP0541486.0 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.15 COC1=CNC=CC1=O CNP0190346.0 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.15 COC1=COC=CC1=O CNP0259077.0 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.15 COC1=NC=CC=C1O CNP0055948.0 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.15 COC1=NC=CN=C1C CNP0352774.0 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.15 CSC1=CC=CC=C1O CNP0318961.0 [1,0,0,0,0,0|1,1,0]=3 90 B9R1.15 CSC1=NC=CN=C1C CNP0238636.0 [1,0,0,0,0,0|2,1,0]=4 91 B9R1.15 NC1=CC=CC=C1C=O CNP0254479.0 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.15 NC1=CC=CC=C1CO CNP0420692.0 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.15 NCC1=CC=CC=C1O CNP0216216.0 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.15 NNC1=CC=CC=C1Cl CNP0024117.0 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.15 O=CC1=CC=CC=C1Cl CNP0042746.0 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.15 O=CC1=CC=CC=C1O CNP0132365.0 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.15 OCC1=CC=CC=C1O CNP0104167.0 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.15 SCC1=CC=CC=C1I CNP0505108.0 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.15 [C-]#[N+]C1=CC=CC=C1C CNP0486531.0 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.69 CC1=CC(=C(C=N1)C)C CNP0375292.0 [1,0,0,0,0,0|1,0,0]=2 101 B9R1.69 CC1=CC(=CC=C1Br)Cl CNP0064949.0 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.69 CC1=CC(=CC=C1Br)N CNP0054285.0 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.69 CC1=CC(=CC=C1Br)O CNP0025703.0 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.69 CC1=CC(=CC=C1Cl)Br CNP0266846.0 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.69 CC1=CC(=CC=C1Cl)N CNP0024502.0 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.69 CC1=CC(=CC=C1Cl)O CNP0329015.0 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.69 CC1=CC(=CC=C1N)Br CNP0038450.0 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.69 CC1=CC(=CC=C1N)Cl CNP0245359.0 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.69 CC1=CC(=CC=C1O)O CNP0324010.0 [1,0,0,0,0,0|1,0,0]=2 110 B9R1.69 CC1=CC(=O)C(=CO1)O CNP0142931.0 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.69 CC1=CC(=O)C=CC1=O CNP0221358.0 [1,0,0,0,0,0|1,0,1]=3 112 B9R1.69 CC1=CC(C=CC1O)O CNP0455439.0 [1,0,0,0,0,0|1,0,2]=4 113 B9R1.69 CC1=CC=C(C(=C1)Br)Br CNP0060402.0 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.69 CC1=CC=C(C(=C1)Br)N CNP0031609.0 [1,0,0,0,0,0|2,0,0]=3 115 B9R1.69 CC1=CC=C(C(=C1)C)Br CNP0365794.0 [1,0,0,0,0,0|1,0,0]=2 116 B9R1.69 CC1=CC=C(C(=C1)C)C CNP0110255.0 [1,0,0,0,0,0|0,0,0]=1 117 B9R1.69 CC1=CC=C(C(=C1)C)Cl CNP0093284.0 [1,0,0,0,0,0|1,0,0]=2 118 B9R1.69 CC1=CC=C(C(=C1)C)N CNP0375981.0 [1,0,0,0,0,0|1,0,0]=2 119 B9R1.69 CC1=CC=C(C(=C1)C)O CNP0080029.0 [1,0,0,0,0,0|0,0,0]=1 120 B9R1.69 CC1=CC=C(C(=C1)Cl)C CNP0337392.0 [1,0,0,0,0,0|1,0,0]=2 121 B9R1.69 CC1=CC=C(C(=C1)Cl)Cl CNP0253916.0 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.69 CC1=CC=C(C(=C1)Cl)N CNP0363714.0 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.69 CC1=CC=C(C(=C1)Cl)O CNP0145784.0 [1,0,0,0,0,0|1,0,0]=2 124 B9R1.69 CC1=CC=C(C(=C1)N)Br CNP0057363.0 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.69 CC1=CC=C(C(=C1)N)C CNP0307574.0 [1,0,0,0,0,0|1,0,0]=2 126 B9R1.69 CC1=CC=C(C(=C1)N)Cl CNP0495286.0 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.69 CC1=CC=C(C(=C1)N)N CNP0080098.0 [1,0,0,0,0,0|2,0,0]=3 128 B9R1.69 CC1=CC=C(C(=C1)N)O CNP0421546.0 [1,0,0,0,0,0|1,0,0]=2 129 B9R1.69 CC1=CC=C(C(=C1)N)S CNP0463153.0 [1,0,0,0,0,0|1,1,0]=3 130 B9R1.69 CC1=CC=C(C(=C1)O)C CNP0172791.0 [1,0,0,0,0,0|1,0,0]=2 131 B9R1.69 CC1=CC=C(C(=C1)O)O CNP0114802.0 [1,0,0,0,0,0|1,0,0]=2 132 B9R1.69 CC1=CC=C(C(=N1)C)C CNP0390721.0 [1,0,0,0,0,0|1,0,0]=2 133 B9R1.69 CC1=CC=C(C(=N1)C)O CNP0056515.0 [1,0,0,0,0,0|1,0,0]=2 134 B9R1.69 CC1=CC=C(C(=N1)Cl)N CNP0043466.0 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.69 CC1=CC=C(C=C1Br)Cl CNP0186814.0 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.69 CC1=CC=C(C=C1C)Br CNP0125395.0 [1,0,0,0,0,0|1,0,0]=2 137 B9R1.69 CC1=CC=C(C=C1C)Cl CNP0482651.0 [1,0,0,0,0,0|1,0,0]=2 138 B9R1.69 CC1=CC=C(C=C1C)N CNP0171920.0 [1,0,0,0,0,0|1,0,0]=2 139 B9R1.69 CC1=CC=C(C=C1C)O CNP0160429.0 [1,0,0,0,0,0|1,0,0]=2 140 B9R1.69 CC1=CC=C(C=C1Cl)N CNP0028854.0 [1,0,0,0,0,0|2,0,0]=3 141 B9R1.69 CC1=CC=C(C=C1N)N CNP0023048.0 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.69 CC1=CC=C(C=C1O)O CNP0256040.0 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.69 CC1=CN=C(C(=C1)C)C CNP0331632.0 [1,0,0,0,0,0|1,0,0]=2 144 B9R1.69 CC1=CN=C(C(=C1)Cl)Br CNP0177235.0 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.69 CC1=CN=C(C(=N1)C)C CNP0313440.0 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.69 CC1=CN=C(C(=O)N1)C CNP0598520.0 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.69 CC1=CNC(=O)C=C1O CNP0017901.0 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.69 CC1=C[N+](=C(C=N1)C)[O-] CNP0514079.0 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.69 CC1=NC=C(C(=N1)N)C CNP0518359.0 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.69 C[N+]1=CC(=CC=C1N)I CNP0606794.0 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.69 ClC1=CC=C(C(=C1)Cl)Cl CNP0206286.0 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.69 N=C1C=CC(=O)C(=C1)O CNP0274436.0 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.69 NC1=CC(=CC=C1Cl)Cl CNP0040093.0 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.69 NC1=CC(=CC=C1O)O CNP0176630.0 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.69 NC1=CC(=CC=C1S)Cl CNP0458275.0 [1,0,0,0,0,0|2,1,0]=4 156 B9R1.69 NC1=CC=C(C(=C1)N)N CNP0131312.0 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.69 NC1=CC=C(C(=C1)N)O CNP0003471.0 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.69 NC1=CC=C(C=C1Br)Br CNP0063783.0 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.69 NC1=CC=C(C=C1Cl)Cl CNP0048955.0 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.69 O=C1C=CC(=O)C(=C1)O CNP0230039.0 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.69 OC1=CC(=CC=C1Cl)Cl CNP0236901.0 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.69 OC1=CC=C(C(=C1)Br)O CNP0161760.0 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.69 OC1=CC=C(C(=C1)Cl)Cl CNP0386646.0 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.69 OC1=CC=C(C(=C1)Cl)O CNP0331365.0 [1,0,0,0,0,0|2,0,0]=3 165 B9R1.69 OC1=CC=C(C(=C1)O)O CNP0187325.0 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.69 OC1=CC=C(C=C1Br)Br CNP0216116.0 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.69 OC1=CC=C(C=C1Cl)Cl CNP0401033.0 [1,0,0,0,0,0|2,0,0]=3 168 B11R1.37 C=CC1=CC=C(C=C1OC)O CNP0611852.0 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.37 CCC1=CC=C(C=C1CC)C CNP0183897.0 [0,1,0,0,0,0|1,0,0]=2 170 B11R1.37 CCC1=CC=C(C=C1CC)O CNP0155765.0 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.37 CCC1=CC=C(C=C1CO)C CNP0299444.0 [0,1,0,0,0,0|1,0,0]=2 172 B11R1.37 CCC1=NC=C(N=C1CC)C CNP0079896.0 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.37 COC1=C(CN(C=C1)C)OC CNP0265801.0 [0,1,0,0,0,0|1,0,1]=3 174 B11R1.37 COC1=CC(=CC=C1C=O)O CNP0328475.0 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.37 COC1=CC(=O)C=CC1=[N+]=[N-] CNP0510276.0 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.37 COC1=CC=C(C=C1C=O)O CNP0214934.0 [0,1,0,0,0,0|1,0,1]=3 177 B11R1.37 COC1=CC=C(C=C1OC)C CNP0142648.0 [0,1,0,0,0,0|0,0,0]=1 178 B11R1.37 COC1=CC=C(C=C1OC)I CNP0034495.0 [0,1,0,0,0,0|1,0,0]=2 179 B11R1.37 COC1=CC=C(C=C1OC)O CNP0220201.0 [0,1,0,0,0,0|1,0,0]=2 180 B11R1.37 COC1=CC=[N+](C=C1C#N)[O-] CNP0484476.0 [0,1,0,0,0,0|2,0,1]=4 181 B11R1.37 COC1=CCN(C=C1OC)C CNP0568941.0 [0,1,0,0,0,0|1,0,1]=3 182 B11R1.81 CC1=CC(=CC=C1NC=O)Cl CNP0105293.0 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.81 CC=CC1=CC=C(C=C1O)O CNP0287059.0 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.81 CC=CC1=NC=C(N=C1C)C CNP0185639.0 [0,1,0,0,0,0|3,0,0]=4 185 B11R1.81 CCCC1=CC=C(C=C1C)C CNP0112480.0 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.81 CCCC1=CC=C(C=C1O)C CNP0518001.0 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.81 CCCC1=NC=C(N=C1C)C CNP0325666.0 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.81 CCOC1=CC=C(C=C1Br)Br CNP0017924.0 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.81 CNCC1=CC=C(C=C1O)Cl CNP0445122.0 [0,1,0,0,0,0|3,0,0]=4 190 B11R1.81 OCCC1=CC=C(C=C1O)O CNP0163682.0 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.166 CC(=O)C1=CC=C(C=C1C)C CNP0090387.0 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.166 CC(=O)C1=CC=C(C=C1C)O CNP0234659.0 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.166 CC(=O)C1=CC=C(C=C1O)C CNP0265619.0 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.166 CC(=O)C1=CC=C(C=C1O)N CNP0529513.0 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.166 CC(=O)C1=CC=C(C=C1O)O CNP0230310.0 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.166 CC(=O)C1=NC=C(N=C1C)C CNP0361229.0 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.166 CC1=CC(=CC=C1C(=O)O)O CNP0075319.0 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.166 CC1=CC(=CC=C1C(C)C)O CNP0343687.0 [0,1,0,0,0,0|2,0,0]=3 199 B11R1.166 CC1=CC(=CC=C1[N+](=O)[O-])N CNP0541671.0 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.166 CC1=CC=C(C(=C1)C)C(=O)Cl CNP0035950.0 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.166 CC1=CC=C(C(=C1)C)C(=O)O CNP0439432.0 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.166 CC1=CC=C(C(=C1)C)C(C)C CNP0278893.0 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.166 CC1=CC=C(C(=C1)N)[N+](=O)[O-] CNP0575477.0 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.166 CC1=CC=C(C(=C1)O)C(=O)N CNP0081106.0 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.166 CC1=CC=C(C(=C1)O)C(C)C CNP0135128.0 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.277 CC1=CC(=C(C=C1C)C=O)C CNP0085942.0 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.277 CC1=CC(=C(C=C1C)CO)C CNP0612014.0 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.277 CC1=CC(=C(C=C1O)C)N=O CNP0314907.0 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.277 CC1=CC(=NO)C(=CC1=O)C CNP0294852.0 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.277 CCC1=CC(=C(C=C1C)C)C CNP0561211.0 [0,1,0,0,0,0|1,0,0]=2 211 B11R1.277 CCC1=CC(=C(C=C1O)C)C CNP0088843.0 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.277 CCC1=CC(=O)C(=CC1=O)C CNP0227006.0 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.277 CCC1=NC(=C(N=C1C)C)C CNP0342125.0 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.277 COC1=CC(=C(C=C1C)Br)C CNP0408849.0 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.277 COC1=CC(=C(C=C1C)C)C CNP0537102.0 [0,1,0,0,0,0|0,0,0]=1 216 B11R1.277 COC1=CC(=C(C=C1O)C)O CNP0167756.0 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.277 COC1=CC(=O)C(=CC1=O)C CNP0269462.0 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.278 CC1=C(C(=NO)C=CC1=O)C CNP0222665.0 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.278 CC1=C(C=CC(=C1O)O)C=O CNP0202109.0 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.278 CC1=CC=C(C(=C1C)C)C=O CNP0307883.0 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.278 CC1=NC=C(C(=C1O)C)CO CNP0346238.0 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.278 CCC1=CC=C(C(=C1O)C)C CNP0328437.0 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.278 COC1=C(N(C(=O)C=C1)O)C CNP0329943.0 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.278 COC1=C(N(C(=O)C=C1)[O-])C CNP0494378.0 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.278 COC1=CC=C(C(=C1Br)C)Cl CNP0611848.0 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.278 COC1=CC=C(C(=C1C)C)Br CNP0059488.0 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.278 COC1=CC=C(C(=O)C1=O)C CNP0534932.0 [0,1,0,0,0,0|1,0,0]=2 228 B11R1.279 C=CC1=CC=C(C(=C1)O)OC CNP0342720.0 [0,1,0,0,0,0|1,0,1]=3 229 B11R1.279 CC1=CC(=CC=C1C=O)C=O CNP0301871.0 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.279 CC1=CC(=CC=C1N=O)N=O CNP0373828.0 [0,1,0,0,0,0|3,0,0]=4 231 B11R1.279 CC1=CC(=CC=C1OP)C=O CNP0344714.0 [0,1,0,0,0,0|1,0,1]=3 232 B11R1.279 CC1=CC(=NO)C=CC1=NO CNP0317320.0 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.279 CCC1=CC=C(C(=C1)C)CC CNP0174684.0 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.279 CCC1=CC=C(C(=C1)O)OC CNP0241141.0 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.279 CCC1=CN=C(C(=N1)C)CC CNP0165721.0 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.279 COC1=CC=C(C(=C1)Br)OC CNP0224499.0 [0,1,0,0,0,0|1,0,0]=2 237 B11R1.279 COC1=CC=C(C(=C1)C)OC CNP0235109.0 [0,1,0,0,0,0|0,0,0]=1 238 B11R1.279 COC1=CC=C(C(=C1)Cl)OC CNP0294313.0 [0,1,0,0,0,0|1,0,0]=2 239 B11R1.279 COC1=CC=C(C(=C1)N)OC CNP0151673.0 [0,1,0,0,0,0|1,0,0]=2 240 B11R1.279 COC1=CC=C(C(=C1)O)C=O CNP0298651.0 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.279 COC1=CC=C(C(=C1)O)OC CNP0373176.0 [0,1,0,0,0,0|1,0,0]=2 242 B11R1.279 COC1=CC=C(C=C1Br)C=O CNP0185743.0 [0,1,0,0,0,0|1,0,1]=3 243 B11R1.279 COC1=CC=C(C=C1Br)CO CNP0163543.0 [0,1,0,0,0,0|1,0,0]=2 244 B11R1.279 COC1=CC=C(C=C1C)C=O CNP0009035.0 [0,1,0,0,0,0|0,0,1]=2 245 B11R1.279 COC1=CC=C(C=C1Cl)C=O CNP0247895.0 [0,1,0,0,0,0|1,0,1]=3 246 B11R1.279 COC1=CC=C(C=C1Cl)CO CNP0187706.0 [0,1,0,0,0,0|1,0,0]=2 247 B11R1.279 COC1=CC=C(C=C1O)C=O CNP0420166.0 [0,1,0,0,0,0|1,0,1]=3 248 B11R1.279 COC1=CC=C(C=C1O)CN CNP0009082.0 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.279 COC1=CC=C(C=C1O)CO CNP0153100.0 [0,1,0,0,0,0|1,0,0]=2 250 B11R1.279 COC1=COC(=CC1=O)CO CNP0312690.0 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.279 NCC1=CC=C(C(=C1)O)CO CNP0119562.0 [0,1,0,0,0,0|3,0,0]=4 252 B11R1.464 CC1=CC(=C(C(=C1)C)C=O)C CNP0234902.0 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.464 CC1=CC(=C(C(=C1)C)N=O)C CNP0216799.0 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.464 CC1=CC(=C(C(=C1)Cl)C=O)Cl CNP0026222.0 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.464 CC1=CC(=C(C(=C1)O)C=O)O CNP0218508.0 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.464 CC1=CC(=CC(=C1C=O)O)O CNP0115622.0 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.464 CCC1=C(C=C(C=C1C)C)C CNP0246344.0 [0,1,0,0,0,0|1,0,0]=2 258 B11R1.464 CCC1=C(C=C(C=C1C)O)C CNP0365832.0 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.464 CCC1=C(C=C(C=C1Cl)C)C CNP0233565.0 [0,1,0,0,0,0|1,0,0]=2 260 B11R1.464 CCC1=C(C=C(N=C1Cl)C)Cl CNP0188033.0 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.464 CCC1=C(C=C(OC1=O)C)O CNP0431819.0 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.464 CCN1C(=NC(=CC1=O)C)C CNP0482502.0 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.464 COC1=C(C=C(C=C1Br)Br)Br CNP0126610.0 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.464 COC1=C(C=C(C=C1Br)Br)O CNP0097750.0 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.464 COC1=C(C=C(C=C1Br)O)Br CNP0178459.0 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.464 COC1=C(C=C(C=C1C)C)C CNP0565570.0 [0,1,0,0,0,0|0,0,0]=1 267 B11R1.464 COC1=C(C=C(C=C1Cl)Cl)Cl CNP0178727.0 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.464 COC1=C(C=C(C=C1O)O)O CNP0224483.0 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.464 COC1=C(C=C(NC1=O)C)O CNP0316494.0 [0,1,0,0,0,0|2,0,0]=3 270 B9R0.5 CC=CC(=O)C=CCCC CNP0250774.0 [0,0,1,0,0,0|2,0,1]=4 271 B9R0.23 COC(=O)C(=CC(=O)O)C CNP0215692.0 [0,0,1,0,0,0|3,0,0]=4 272 B9R0.34 CC=CC(=CC(=CC)C)C CNP0404267.0 [0,0,1,0,0,0|1,0,1]=3 273 B9R0.34 CCC=C(C)C=C(C)CO CNP0110428.0 [0,0,1,0,0,0|2,0,1]=4 274 B9R0.43 CC=C(C=CC(=O)N)CC CNP0192720.0 [0,0,1,0,0,0|3,0,0]=4 275 B11R2.36 CC1=CC2=C(C=N1)ON=N2 CNP0370559.0 [0,0,0,1,0,0|3,0,0]=4 276 B11R2.36 CC1=CC=C2C=CNC2=C1 CNP0156708.0 [0,0,0,1,0,0|2,0,1]=4 277 B11R2.36 CC1=CC=C2CCCC2=C1 CNP0170611.0 [0,0,0,1,0,0|1,0,0]=2 278 B11R2.36 CC1=CC=C2CCCC2=N1 CNP0269261.0 [0,0,0,1,0,0|2,0,0]=3 279 B11R2.36 CC1=CC=C2N=CNC2=C1 CNP0512184.0 [0,0,0,1,0,0|2,0,1]=4 280 B11R2.36 CC1=CC=C2NC=CC2=C1 CNP0140015.0 [0,0,0,1,0,0|1,0,2]=4 281 B11R2.36 CC1=CC=C2ON=NC2=N1 CNP0000850.0 [0,0,0,1,0,0|3,0,0]=4 282 B11R2.36 CC1=CN=C2CCCC2=N1 CNP0296530.0 [0,0,0,1,0,0|3,0,0]=4 283 B11R2.36 CC1=CN=C2ON=NC2=C1 CNP0000926.0 [0,0,0,1,0,0|3,0,0]=4 284 B11R2.36 NC1=CC=C2ON=NC2=C1 CNP0001261.0 [0,0,0,1,0,0|3,0,0]=4 285 B11R2.36 OC1=CC=C2CCCC2=C1 CNP0188722.0 [0,0,0,1,0,0|2,0,0]=3 286 B11R2.36 OC1=CC=C2NCCC2=C1 CNP0290349.0 [0,0,0,1,0,0|2,0,0]=3 287 B11R2.36 OC1=CC=C2OC=CC2=C1 CNP0360936.0 [0,0,0,1,0,0|1,0,2]=4 288 B11R2.36 OC1=CC=C2OCCC2=C1 CNP0337793.0 [0,0,0,1,0,0|1,0,0]=2 289 B11R2.36 OC1=CC=C2OCOC2=C1 CNP0223104.0 [0,0,0,1,0,0|2,0,0]=3 290 B11R2.363 CC1=CC=C2C(=O)CC2=C1 CNP0317782.0 [0,0,0,1,0,0|2,0,0]=3 291 B11R2.610 CC1=CC(=C2CCC2=C1)C CNP0050950.0 [0,0,0,1,0,0|1,0,0]=2 292 B9R1.22 CCC1=C(N=C(O1)C)C CNP0002748.0 [0,0,0,0,1,0|3,0,0]=4 293 B9R1.22 CCC1=C(N=C(S1)C)C CNP0002546.0 [0,0,0,0,1,0|3,0,0]=4 294 B9R1.22 CCC1=C(OC(=N1)C)C CNP0331848.0 [0,0,0,0,1,0|3,0,0]=4 295 B9R1.22 CCC1=C(SC(=N1)C)C CNP0002547.0 [0,0,0,0,1,0|3,0,0]=4 296 B9R1.22 CSC1=C(OC(=C1)C)C CNP0290241.0 [0,0,0,0,1,0|1,1,0]=3 297 B9R1.132 CCC1=C(C(=CS1)C)C CNP0171065.0 [0,0,0,0,1,0|2,0,0]=3 298 B9R1.132 CCC1=CSC(=C1C)C CNP0103141.0 [0,0,0,0,1,0|2,0,0]=3 299 B8R0.8 CC=CC=C(C)C(=O)O CNP0232532.0 [1,0,1,0,0,0|2,0,0]=4 300 B8R0.15 C=C(C)C(=CCC)CC CNP0487408.0 [1,0,1,0,0,0|1,0,1]=4 301 B8R0.19 CC=C(C)C=C(C)C=O CNP0259001.0 [1,0,1,0,0,0|1,0,0]=3 302 B8R0.19 CC=C(C)C=C(C)CO CNP0307713.0 [1,0,1,0,0,0|0,0,2]=4 303 B8R1.2 C#CC1=CC=CC=C1 CNP0227628.0 [2,0,0,0,0,0|1,0,1]=4 304 B8R1.2 C=CC1=CC=CC=C1 CNP0111430.0 [2,0,0,0,0,0|1,0,1]=4 305 B8R1.2 CCC1=CC=CC=C1 CNP0245508.0 [2,0,0,0,0,0|1,0,0]=3 306 B8R1.2 CCC1=CC=CC=N1 CNP0003463.0 [2,0,0,0,0,0|2,0,0]=4 307 B8R1.2 CCC1=CC=CN=C1 CNP0396997.0 [2,0,0,0,0,0|2,0,0]=4 308 B8R1.2 CC[N+]1=CC=CC=C1 CNP0507760.0 [2,0,0,0,0,0|2,0,0]=4 309 B8R1.2 CNC1=CC=CC=C1 CNP0238665.0 [2,0,0,0,0,0|1,0,0]=3 310 B8R1.2 COC1=CC=CC=C1 CNP0226394.0 [2,0,0,0,0,0|0,0,0]=2 311 B8R1.2 COC1=CC=CC=N1 CNP0086328.0 [2,0,0,0,0,0|1,0,0]=3 312 B8R1.2 COC1=CC=CN=C1 CNP0181639.0 [2,0,0,0,0,0|1,0,0]=3 313 B8R1.2 COC1=CC=[C-]C=C1 CNP0559014.0 [2,0,0,0,0,0|0,0,1]=3 314 B8R1.2 COC1=CN=CC=N1 CNP0003478.0 [2,0,0,0,0,0|2,0,0]=4 315 B8R1.2 CSC1=CC=CC=C1 CNP0220907.0 [2,0,0,0,0,0|0,1,0]=3 316 B8R1.2 ClCC1=CC=CC=C1 CNP0182098.0 [2,0,0,0,0,0|2,0,0]=4 317 B8R1.2 N#CC1=CC=CC=C1 CNP0417536.0 [2,0,0,0,0,0|2,0,0]=4 318 B8R1.2 NCC1=CC=CC=C1 CNP0287581.0 [2,0,0,0,0,0|2,0,0]=4 319 B8R1.2 NNC1=CC=CC=C1 CNP0343489.0 [2,0,0,0,0,0|2,0,0]=4 320 B8R1.2 NOC1=CC=CC=C1 CNP0086444.0 [2,0,0,0,0,0|1,0,0]=3 321 B8R1.2 O=CC1=CC=CC=C1 CNP0105179.0 [2,0,0,0,0,0|2,0,0]=4 322 B8R1.2 O=NC1=CC=CC=C1 CNP0458645.0 [2,0,0,0,0,0|2,0,0]=4 323 B8R1.2 OCC1=CC=CC=C1 CNP0263608.0 [2,0,0,0,0,0|2,0,0]=4 324 B8R1.2 S=CC1=CC=CC=C1 CNP0390890.0 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.2 SCC1=CC=CC=C1 CNP0118345.0 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.2 [18OH]CC1=CC=CC=C1 CNP0583905.0 [2,0,0,0,0,0|2,0,0]=4 327 B8R1.2 [CH2]CC1=CC=CC=C1 CNP0592603.0 [2,0,0,0,0,0|1,0,1]=4 328 B8R1.3 BrC1=CC=C(C=C1)Br CNP0468033.0 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.3 C=C1C=CC(=O)C=C1 CNP0610154.0 [2,0,0,0,0,0|0,0,2]=4 330 B8R1.3 CC1=CC=C(C=C1)Br CNP0372052.0 [2,0,0,0,0,0|1,0,0]=3 331 B8R1.3 CC1=CC=C(C=C1)C CNP0227482.0 [2,0,0,0,0,0|0,0,0]=2 332 B8R1.3 CC1=CC=C(C=C1)Cl CNP0177290.0 [2,0,0,0,0,0|1,0,0]=3 333 B8R1.3 CC1=CC=C(C=C1)N CNP0232157.0 [2,0,0,0,0,0|1,0,0]=3 334 B8R1.3 CC1=CC=C(C=C1)O CNP0267550.0 [2,0,0,0,0,0|0,0,0]=2 335 B8R1.3 CC1=CC=C(C=C1)S CNP0315228.0 [2,0,0,0,0,0|0,1,0]=3 336 B8R1.3 CC1=CC=C(C=N1)N CNP0257052.0 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.3 CC1=CC=C(C=N1)O CNP0164492.0 [2,0,0,0,0,0|1,0,0]=3 338 B8R1.3 CC1=CC=C(N=C1)C CNP0244329.0 [2,0,0,0,0,0|1,0,0]=3 339 B8R1.3 CC1=CC=C(N=C1)N CNP0531563.0 [2,0,0,0,0,0|2,0,0]=4 340 B8R1.3 CC1=CC=C(N=C1)O CNP0541416.0 [2,0,0,0,0,0|1,0,0]=3 341 B8R1.3 CC1=CC=C([NH+]=C1)N CNP0549835.0 [2,0,0,0,0,0|2,0,0]=4 342 B8R1.3 CC1=CN=C(C=N1)C CNP0257272.0 [2,0,0,0,0,0|2,0,0]=4 343 B8R1.3 CC1=CNC(=O)C=C1 CNP0085670.0 [2,0,0,0,0,0|1,0,1]=4 344 B8R1.3 CN1C=CC(=N)C=C1 CNP0407521.0 [2,0,0,0,0,0|2,0,0]=4 345 B8R1.3 ClC1=CC=C(C=C1)Cl CNP0341270.0 [2,0,0,0,0,0|2,0,0]=4 346 B8R1.3 NC1=CC=C(C=C1)Br CNP0044742.0 [2,0,0,0,0,0|2,0,0]=4 347 B8R1.3 NC1=CC=C(C=C1)I CNP0290133.0 [2,0,0,0,0,0|2,0,0]=4 348 B8R1.3 NC1=CC=C(C=C1)N CNP0208924.0 [2,0,0,0,0,0|2,0,0]=4 349 B8R1.3 NC1=CC=C(C=C1)O CNP0149529.0 [2,0,0,0,0,0|1,0,0]=3 350 B8R1.3 O=C1C=CC(=CN1)O CNP0491283.0 [2,0,0,0,0,0|2,0,0]=4 351 B8R1.3 O=C1C=CC(=O)C=C1 CNP0164682.0 [2,0,0,0,0,0|1,0,1]=4 352 B8R1.3 OC1=CC=C(C=C1)Br CNP0085593.0 [2,0,0,0,0,0|1,0,0]=3 353 B8R1.3 OC1=CC=C(C=C1)Cl CNP0334769.0 [2,0,0,0,0,0|1,0,0]=3 354 B8R1.3 OC1=CC=C(C=C1)I CNP0471533.0 [2,0,0,0,0,0|1,0,0]=3 355 B8R1.3 OC1=CC=C(C=C1)O CNP0246516.0 [2,0,0,0,0,0|1,0,0]=3 356 B8R1.3 OC1=CC=C(C=C1)S CNP0531619.0 [2,0,0,0,0,0|1,0,0]=3 357 B8R1.3 OC1=CC=C(N=C1)O CNP0381187.0 [2,0,0,0,0,0|2,0,0]=4 358 B8R1.5 C=C1[CH]C=CC=C1C CNP0546829.0 [2,0,0,0,0,0|0,0,2]=4 359 B8R1.5 CC1=C(CC=CC1)C CNP0076227.0 [2,0,0,0,0,0|0,0,2]=4 360 B8R1.5 CC1=CC=CC=C1Br CNP0035566.0 [2,0,0,0,0,0|1,0,0]=3 361 B8R1.5 CC1=CC=CC=C1C CNP0365784.0 [2,0,0,0,0,0|0,0,0]=2 362 B8R1.5 CC1=CC=CC=C1Cl CNP0335361.0 [2,0,0,0,0,0|1,0,0]=3 363 B8R1.5 CC1=CC=CC=C1N CNP0178803.0 [2,0,0,0,0,0|1,0,0]=3 364 B8R1.5 CC1=CC=CC=C1O CNP0242840.0 [2,0,0,0,0,0|0,0,0]=2 365 B8R1.5 CC1=CC=CC=C1S CNP0309831.0 [2,0,0,0,0,0|0,1,0]=3 366 B8R1.5 CC1=CC=CC=[N+]1C CNP0553099.0 [2,0,0,0,0,0|1,0,0]=3 367 B8R1.5 CC1=CC=CC=[N+]1[O-] CNP0511667.0 [2,0,0,0,0,0|1,0,1]=4 368 B8R1.5 CC1=CC=CN=C1C CNP0151242.0 [2,0,0,0,0,0|1,0,0]=3 369 B8R1.5 CC1=CC=CN=C1N CNP0505128.0 [2,0,0,0,0,0|2,0,0]=4 370 B8R1.5 CC1=CC=C[NH+]=C1N CNP0549558.0 [2,0,0,0,0,0|2,0,0]=4 371 B8R1.5 CC1=CC=NC=C1C CNP0275303.0 [2,0,0,0,0,0|1,0,0]=3 372 B8R1.5 CC1=CC=NC=C1N CNP0236716.0 [2,0,0,0,0,0|2,0,0]=4 373 B8R1.5 CC1=NC=CC=C1O CNP0418507.0 [2,0,0,0,0,0|1,0,0]=3 374 B8R1.5 CC1=NC=CN=C1C CNP0119963.0 [2,0,0,0,0,0|2,0,0]=4 375 B8R1.5 ClC1=CC=CC=C1Cl CNP0284887.0 [2,0,0,0,0,0|2,0,0]=4 376 B8R1.5 NC1=CC=CC=C1Br CNP0295031.0 [2,0,0,0,0,0|2,0,0]=4 377 B8R1.5 NC1=CC=CC=C1N CNP0232275.0 [2,0,0,0,0,0|2,0,0]=4 378 B8R1.5 NC1=CC=CC=C1O CNP0115137.0 [2,0,0,0,0,0|1,0,0]=3 379 B8R1.5 NC1=CC=CC=C1S CNP0083879.0 [2,0,0,0,0,0|1,1,0]=4 380 B8R1.5 O=C1C=CC=CC1=O CNP0309111.0 [2,0,0,0,0,0|1,0,1]=4 381 B8R1.5 O=C1C=CCC=C1O CNP0560107.0 [2,0,0,0,0,0|1,0,1]=4 382 B8R1.5 O=C1C=CNC=C1O CNP0258387.0 [2,0,0,0,0,0|2,0,0]=4 383 B8R1.5 O=C1C=COC=C1O CNP0116604.0 [2,0,0,0,0,0|2,0,0]=4 384 B8R1.5 O=C1NC=CC=C1O CNP0598897.0 [2,0,0,0,0,0|2,0,0]=4 385 B8R1.5 O=C1OC=CC=C1O CNP0103332.0 [2,0,0,0,0,0|2,0,0]=4 386 B8R1.5 OC1=CC=CC=C1Br CNP0083000.0 [2,0,0,0,0,0|1,0,0]=3 387 B8R1.5 OC1=CC=CC=C1Cl CNP0071171.0 [2,0,0,0,0,0|1,0,0]=3 388 B8R1.5 OC1=CC=CC=C1O CNP0143972.0 [2,0,0,0,0,0|1,0,0]=3 389 B8R1.5 OC1=CC=CN=C1I CNP0061816.0 [2,0,0,0,0,0|2,0,0]=4 390 B8R1.5 OC1=CC=CN=C1O CNP0082051.0 [2,0,0,0,0,0|2,0,0]=4 391 B8R1.5 OC1=CC=NC=C1O CNP0510670.0 [2,0,0,0,0,0|2,0,0]=4 392 B8R1.5 ON1C=CC=CC1=S CNP0586487.0 [2,0,0,0,0,0|2,0,0]=4 393 B8R1.5 O[14C]1=[14CH][14CH]=[14CH][14CH]=[14C]1O CNP0513395.0 [2,0,0,0,0,0|1,0,0]=3 394 B8R1.5 [CH2]C1=CC=CC=C1C CNP0593977.0 [2,0,0,0,0,0|0,0,1]=3 395 B8R1.4 CC1=CC(=CC=N1)O CNP0308761.0 [2,0,0,0,0,0|2,0,0]=4 396 B8R1.4 CC1=CC(=O)C=CN1 CNP0513735.0 [2,0,0,0,0,0|2,0,0]=4 397 B8R1.4 CC1=CC(=O)C=CO1 CNP0179458.0 [2,0,0,0,0,0|2,0,0]=4 398 B8R1.4 CC1=CC=CC(=C1)Br CNP0039148.0 [2,0,0,0,0,0|1,0,0]=3 399 B8R1.4 CC1=CC=CC(=C1)C CNP0152592.0 [2,0,0,0,0,0|0,0,0]=2 400 B8R1.4 CC1=CC=CC(=C1)Cl CNP0583031.0 [2,0,0,0,0,0|1,0,0]=3 401 B8R1.4 CC1=CC=CC(=C1)N CNP0300821.0 [2,0,0,0,0,0|1,0,0]=3 402 B8R1.4 CC1=CC=CC(=C1)O CNP0355586.0 [2,0,0,0,0,0|1,0,0]=3 403 B8R1.4 CC1=CC=CC(=N1)Br CNP0033684.0 [2,0,0,0,0,0|2,0,0]=4 404 B8R1.4 CC1=CC=CC(=N1)C CNP0246832.0 [2,0,0,0,0,0|1,0,0]=3 405 B8R1.4 CC1=CC=CC(=N1)N CNP0039742.0 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.4 CC1=CC=C[N+](=C1)[O-] CNP0579325.0 [2,0,0,0,0,0|2,0,0]=4 407 B8R1.4 CC1=CC=NC(=C1)C CNP0143367.0 [2,0,0,0,0,0|1,0,0]=3 408 B8R1.4 CC1=CC=NC(=C1)N CNP0425527.0 [2,0,0,0,0,0|2,0,0]=4 409 B8R1.4 CC1=CC=[NH+]C(=C1)N CNP0513297.0 [2,0,0,0,0,0|2,0,0]=4 410 B8R1.4 CC1=CCCC(=C1)C CNP0118398.0 [2,0,0,0,0,0|0,0,2]=4 411 B8R1.4 CC1=CN=CC(=C1)C CNP0366505.0 [2,0,0,0,0,0|1,0,0]=3 412 B8R1.4 CC1=CN=CC(=C1)O CNP0135310.0 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.4 CC1=CN=CC(=N1)C CNP0296461.0 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.4 ClC1=CC=CC(=C1)Cl CNP0080171.0 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.4 NC1=CC=CC(=C1)Cl CNP0066965.0 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.4 NC1=CC=CC(=C1)N CNP0033147.0 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.4 NC1=CC=CC(=C1)O CNP0172517.0 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.4 OC1=CC=CC(=C1)Cl CNP0109649.0 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.4 OC1=CC=CC(=C1)O CNP0414137.0 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.4 [O-]C1=CC=CC(=C1)[O-] CNP0552554.0 [2,0,0,0,0,0|2,0,0]=4 421 B10R0.3 CC(=CC=CC(=CC=O)C)C CNP0319558.0 [0,1,1,0,0,0|2,0,0]=4 422 B10R0.46 COC(=O)C=C(C)C(=O)OC CNP0198897.0 [0,1,1,0,0,0|2,0,0]=4 423 B10R0.44 C=CC(=CC(=O)C=C(C)C)C CNP0174615.0 [0,1,1,0,0,0|2,0,0]=4 424 B10R1.1 C=CCC1=CC=C(C=C1)C CNP0192313.0 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.1 CC1=CC=C(C=C1)C=NO CNP0256781.0 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.1 CC1=CC=C(C=C1)CC=O CNP0003643.0 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.1 CC1=CC=C(C=C1)SC#N CNP0533747.0 [1,1,0,0,0,0|0,1,1]=4 428 B10R1.1 CC=CC1=CC=C(C=C1)C CNP0487359.0 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.1 CC=CC1=CC=C(C=C1)O CNP0186527.0 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.1 CCCC1=CC=C(C=C1)O CNP0049862.0 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.1 CCNC1=CC=C(C=C1)C CNP0218913.0 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.1 CCOC1=CC=C(C=C1)C CNP0163796.0 [1,1,0,0,0,0|0,0,0]=2 433 B10R1.1 CCOC1=CC=C(C=C1)N CNP0071165.0 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.1 CCOC1=CC=C(C=C1)O CNP0003327.0 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.1 CCOC1=CN=C(C=N1)C CNP0144720.0 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.1 COCC1=CC=C(C=C1)O CNP0145249.0 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.1 NCCC1=CC=C(C=C1)O CNP0111205.0 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.1 OCCC1=CC=C(C=C1)O CNP0160217.0 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.3 BrCC1=CC=C(C=C1)CBr CNP0025281.0 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.3 C=CC1=CC=C(C=C1)CC CNP0084147.0 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.3 C=CC1=CC=C(C=C1)CO CNP0018712.0 [1,1,0,0,0,0|1,0,1]=4 442 B10R1.3 C=CC1=CC=C(C=C1)OC CNP0327301.0 [1,1,0,0,0,0|0,0,1]=3 443 B10R1.3 CCC1=CC=C(C=C1)C#N CNP0223506.0 [1,1,0,0,0,0|1,0,1]=4 444 B10R1.3 CCC1=CC=C(C=C1)C=O CNP0279142.0 [1,1,0,0,0,0|1,0,1]=4 445 B10R1.3 CCC1=CC=C(C=C1)CC CNP0158802.0 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.3 CCC1=CC=C(C=C1)OC CNP0330277.0 [1,1,0,0,0,0|0,0,0]=2 447 B10R1.3 CNC1=CC=C(C=C1)C=O CNP0246789.0 [1,1,0,0,0,0|1,0,1]=4 448 B10R1.3 COC1=CC=C(C=C1)C#N CNP0311472.0 [1,1,0,0,0,0|0,0,1]=3 449 B10R1.3 COC1=CC=C(C=C1)C=O CNP0234469.0 [1,1,0,0,0,0|0,0,1]=3 450 B10R1.3 COC1=CC=C(C=C1)C=S CNP0185667.0 [1,1,0,0,0,0|0,0,1]=3 451 B10R1.3 COC1=CC=C(C=C1)CN CNP0143724.0 [1,1,0,0,0,0|0,0,0]=2 452 B10R1.3 COC1=CC=C(C=C1)CO CNP0301946.0 [1,1,0,0,0,0|0,0,0]=2 453 B10R1.3 COC1=CC=C(C=C1)OC CNP0161668.0 [1,1,0,0,0,0|0,0,0]=2 454 B10R1.3 N#[N+]C1=CC=C(C=C1)CO CNP0355335.0 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.3 O=CC1=CC=C(C=C1)CBr CNP0064464.0 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.13 C=C(C)C1=CC=C(C=C1)C CNP0302429.0 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.13 C=C(C)C1=CC=C(N=C1)C CNP0550241.0 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.13 CC(=O)C1=CC=C(C=C1)Br CNP0078494.0 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.13 CC(=O)C1=CC=C(C=C1)C CNP0415909.0 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.13 CC(=O)C1=CC=C(C=C1)I CNP0361256.0 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.13 CC(=O)C1=CC=C(C=C1)N CNP0127987.0 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.13 CC(=O)C1=CC=C(C=C1)O CNP0327993.0 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.13 CC(=O)C1=CC=C(C=N1)C CNP0046782.0 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.13 CC(=O)C1=CC=C(N=C1)C CNP0135801.0 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.13 CC(C)C1=CC=C(C=C1)N CNP0455541.0 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.13 CC(C)C1=CC=C(C=C1)O CNP0127505.0 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.13 CC(N)C1=CC=C(C=C1)O CNP0292009.0 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.13 CC1=CC=C(C=C1)C(=O)Br CNP0248072.0 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl CNP0150539.0 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.13 CC1=CC=C(C=C1)C(=O)N CNP0158656.0 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.13 CC1=CC=C(C=C1)C(=O)O CNP0232170.0 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.13 CC1=CC=C(C=C1)C(C)C CNP0145577.0 [1,1,0,0,0,0|1,0,0]=3 473 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O CNP0154242.1 [1,1,0,0,0,0|1,0,0]=3 474 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O CNP0154242.2 [1,1,0,0,0,0|1,0,0]=3 475 B10R1.13 CC1=CC=C(C=N1)[C@H](C)N CNP0243226.1 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.13 CN(C)C1=CC=C(C=C1)N CNP0581368.0 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)O CNP0112149.2 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.13 C[C@H](O)C1=CC=C(C=C1)O CNP0112149.1 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.176 C=CC1=CC=C(C(=C1)C)C CNP0083008.0 [1,1,0,0,0,0|1,0,1]=4 480 B10R1.176 CC1=CC=C(C=C1C)C#N CNP0181583.0 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.176 CC1=CC=C(C=C1C)CO CNP0515257.0 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.176 CCC1=CC=C(C(=C1)C)C CNP0111798.0 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.176 CCC1=CC=C(C(=C1)C)O CNP0271974.0 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.176 CCC1=CC=C(C(=C1)O)C CNP0152157.0 [1,1,0,0,0,0|1,0,0]=3 485 B10R1.176 CCC1=CC=C(C(=C1)O)O CNP0344368.0 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.176 CCC1=CC=C(C(=N1)C)C CNP0105764.0 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.176 COC1=CC=C(C(=C1)C)Br CNP0334567.0 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.176 COC1=CC=C(C(=C1)C)Cl CNP0187648.0 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.176 COC1=CC=C(C(=C1)C)O CNP0175131.0 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.176 COC1=CC=C(C(=C1)Cl)Cl CNP0369428.0 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.176 COC1=CC=C(C(=C1)N)O CNP0323578.0 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.176 COC1=CC=C(C(=C1)O)O CNP0241033.0 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.2 CC1=CC=CC(=C1C)C#N CNP0139053.0 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.2 CC1=CC=CC(=C1C)C=O CNP0501818.0 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.2 CCC1=CC=CC(=C1C)C CNP0183405.0 [1,1,0,0,0,0|1,0,0]=3 496 B10R1.2 CCC1=CC=CC(=C1O)C CNP0284386.0 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.2 CCC1=CC=CC(=C1O)O CNP0002512.0 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.2 COC1=CC=CC(=C1C)C CNP0198695.0 [1,1,0,0,0,0|0,0,0]=2 499 B10R1.2 COC1=CC=CC(=C1N)C CNP0448107.0 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.2 COC1=CC=CC(=C1O)I CNP0386670.0 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.2 COC1=CC=CC(=C1O)O CNP0330888.0 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.2 COC1=CC=CC(=O)C1=O CNP0358042.0 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.2 COC1=COC=C(C1=O)O CNP0275843.0 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.2 [2H]C1=CC=CC(=C1O)OC CNP0538068.0 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.4 C=CCC1=CC=CC=C1C CNP0595117.0 [1,1,0,0,0,0|1,0,1]=4 506 B10R1.4 C=COC1=CC=CC=C1C CNP0434355.0 [1,1,0,0,0,0|0,0,1]=3 507 B10R1.4 CC1=CC=CC=C1CC#N CNP0033758.0 [1,1,0,0,0,0|1,0,1]=4 508 B10R1.4 CC1=CC=CC=C1NC=O CNP0055612.0 [1,1,0,0,0,0|1,0,1]=4 509 B10R1.4 CCCC1=CC=CC=C1C CNP0143289.0 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.4 CCCC1=CC=CC=C1N CNP0601076.0 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.4 CCCC1=CC=CC=C1O CNP0092348.0 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.4 CCOC1=CC=CC=C1C CNP0253397.0 [1,1,0,0,0,0|0,0,0]=2 513 B10R1.4 CCOC1=NC=CN=C1C CNP0003338.0 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.4 COCC1=CC=CC=C1N CNP0216942.0 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.4 NCCC1=CC=CC=C1O CNP0611654.0 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.4 OCCC1=CC=CC=C1O CNP0110289.0 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.20 C=CC1=CC=CC=C1OC CNP0201512.0 [1,1,0,0,0,0|0,0,1]=3 518 B10R1.20 CCC1=CC=CC=C1C=O CNP0565429.0 [1,1,0,0,0,0|1,0,1]=4 519 B10R1.20 CCC1=CC=CC=C1CC CNP0132869.0 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.20 CCC1=CC=CC=C1CO CNP0418111.0 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.20 CCC1=CC=CC=C1OC CNP0246064.0 [1,1,0,0,0,0|0,0,0]=2 522 B10R1.20 CCC1=NC=CN=C1OC CNP0002552.0 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.20 CNC1=CC=CC=C1C=O CNP0169354.0 [1,1,0,0,0,0|1,0,1]=4 524 B10R1.20 CNC1=CC=CC=C1CO CNP0310287.0 [1,1,0,0,0,0|1,0,0]=3 525 B10R1.20 COC1=CC=CC=C1C=O CNP0183883.0 [1,1,0,0,0,0|0,0,1]=3 526 B10R1.20 COC1=CC=CC=C1CCl CNP0053789.0 [1,1,0,0,0,0|0,0,0]=2 527 B10R1.20 COC1=CC=CC=C1CN CNP0294075.0 [1,1,0,0,0,0|0,0,0]=2 528 B10R1.20 COC1=CC=CC=C1CO CNP0047350.0 [1,1,0,0,0,0|0,0,0]=2 529 B10R1.20 COC1=CC=CC=C1OC CNP0141393.0 [1,1,0,0,0,0|0,0,0]=2 530 B10R1.20 COC1=CC=NC=C1C#N CNP0112876.0 [1,1,0,0,0,0|1,0,1]=4 531 B10R1.20 N#CC1=CC=CC=C1CBr CNP0046063.0 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.20 SCC1=CC=CC=C1CS CNP0028178.0 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.30 C=CC1=CC(=CC=C1C)C CNP0027363.0 [1,1,0,0,0,0|1,0,1]=4 534 B10R1.30 CC1=CC=C(C(=C1)C#N)C CNP0233289.0 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.30 CC1=CC=C(C(=C1)C=O)C CNP0076382.0 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.30 CC1=CC=C(C(=C1)CO)C CNP0281493.0 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.30 CCC1=CC(=CC=C1C)C CNP0220953.0 [1,1,0,0,0,0|1,0,0]=3 538 B10R1.30 CCC1=CC(=CC=C1C)O CNP0305920.0 [1,1,0,0,0,0|1,0,0]=3 539 B10R1.30 CCC1=CC(=CC=C1O)C CNP0329742.0 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.30 CCC1=CC(=CC=C1O)O CNP0246876.0 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.30 CCC1=CC(=O)C=CC1=O CNP0391524.0 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.30 COC1=CC(=CC=C1C)C CNP0250959.0 [1,1,0,0,0,0|0,0,0]=2 543 B10R1.30 COC1=CC(=CC=C1N)O CNP0304667.0 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.30 COC1=CC(=CC=C1O)C CNP0264266.0 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.30 COC1=CC(=CC=C1O)O CNP0204166.0 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.30 COC1=CC(=N)C=CC1=O CNP0141181.0 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.30 COC1=CC(=O)C=CC1=O CNP0221542.0 [1,1,0,0,0,0|1,0,0]=3 548 B10R1.30 COC1=NC(=CN=C1C)C CNP0001523.0 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.61 C=C(C)C1=CC=CC=C1C CNP0192226.0 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.61 CC(=O)C1=CC=CC=C1C CNP0416088.0 [1,1,0,0,0,0|1,0,0]=3 551 B10R1.61 CC(=O)C1=CC=CC=C1N CNP0264435.0 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.61 CC(=O)C1=CC=CC=C1O CNP0264178.0 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.61 CC(=O)C1=CC=CN=C1C CNP0150212.0 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.61 CC(=O)C1=CC=NC=C1C CNP0324619.0 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.61 CC(=O)C1=CN=CC=C1C CNP0220710.0 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.61 CC(C)C1=CC=CC=C1O CNP0332801.0 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.61 CC(S)C1=CC=CC=C1S CNP0245318.0 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.61 CC1=CC=CC=C1C(=O)Br CNP0054176.0 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.61 CC1=CC=CC=C1C(=O)O CNP0280538.0 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.61 CC1=CC=CC=C1C(C)C CNP0093801.0 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.61 CN(C)C1=CC=CC=C1O CNP0396984.0 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.245 CC1=CC=CC(=C1C#N)C CNP0139271.0 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.245 CC1=CC=CC(=C1C=O)C CNP0561651.0 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.245 CC1=CC=CC(=C1C=O)O CNP0298218.0 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.245 CC1=CC=CC(=C1CO)O CNP0321165.0 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.245 CCC1=C(C=CC=C1C)C CNP0182931.0 [1,1,0,0,0,0|1,0,0]=3 567 B10R1.245 CNC1=C(C=CC=C1C)C CNP0282095.0 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.245 COC1=C(C=CC=C1Br)Br CNP0017925.0 [1,1,0,0,0,0|1,0,0]=3 569 B10R1.245 COC1=C(C=CC=C1C)C CNP0308029.0 [1,1,0,0,0,0|0,0,0]=2 570 B10R1.245 COC1=C(C=CC=C1Cl)Cl CNP0143389.0 [1,1,0,0,0,0|1,0,0]=3 571 B10R1.245 COC1=C(C=CC=C1O)O CNP0193285.0 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.245 COC1=C(NC=CC1=O)C CNP0226695.0 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.245 COC1=C(OC=CC1=O)C CNP0167853.0 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.22 CC1=C(C=C(C=C1Cl)S)Cl CNP0108382.0 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.22 CC1=C(C=C(C=C1O)O)O CNP0270802.0 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.22 CC1=CC(=C(C(=C1)Br)I)Cl CNP0179139.0 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.22 CC1=CC(=C(C(=C1)Br)N)Cl CNP0063027.0 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.22 CC1=CC(=C(C(=C1)Br)N)N CNP0039347.0 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.22 CC1=CC(=C(C(=C1)Br)O)Br CNP0242146.0 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.22 CC1=CC(=C(C(=C1)C)C)C CNP0375454.0 [1,1,0,0,0,0|0,0,0]=2 581 B10R1.22 CC1=CC(=C(C(=C1)C)N)C CNP0072418.0 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.22 CC1=CC(=C(C(=C1)C)O)C CNP0321032.0 [1,1,0,0,0,0|0,0,0]=2 583 B10R1.22 CC1=CC(=C(C(=C1)Cl)Br)Cl CNP0296853.0 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.22 CC1=CC(=C(C(=C1)Cl)N)N CNP0097451.0 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.22 CC1=CC(=C(C(=C1)N)C)C CNP0027884.0 [1,1,0,0,0,0|0,0,0]=2 586 B10R1.22 CC1=CC(=C(C(=C1)O)C)C CNP0281157.0 [1,1,0,0,0,0|0,0,0]=2 587 B10R1.22 CC1=CC(=C(C(=C1)O)C)O CNP0156178.0 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.22 CC1=CC(=C(C(=C1)O)Cl)O CNP0171455.0 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.22 CC1=CC(=C(C(=C1)O)O)C CNP0386654.0 [1,1,0,0,0,0|0,0,0]=2 590 B10R1.22 CC1=CC(=C(C(=C1)O)O)O CNP0266425.0 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.22 CC1=CC(=C(C(=N1)C)C)C CNP0182494.0 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.22 CC1=CC(=C(C(=O)O1)C)O CNP0371588.0 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.22 CC1=CC(=CC(=C1C)C)N CNP0214882.0 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.22 CC1=CC(=CC(=C1C)C)O CNP0208232.0 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.22 CC1=CC(=CC(=C1C)O)O CNP0138651.0 [1,1,0,0,0,0|1,0,0]=3 596 B10R1.22 CC1=CC(=CC(=C1Cl)C)O CNP0229378.0 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.22 CC1=CC(=CC(=C1Cl)O)O CNP0283107.0 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.22 CC1=CC(=CC(=C1N)C)I CNP0086270.0 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.22 CC1=CC(=CC(=C1O)C)O CNP0107250.0 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.22 CC1=CC(=CC(=C1O)O)O CNP0249116.0 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.22 CC1=CC(=O)C=C(C1=O)C CNP0081563.0 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.22 CC1=CC(=O)C=C(C1=O)O CNP0106705.0 [1,1,0,0,0,0|1,0,1]=4 603 B10R1.22 CC1=CC(=[N+](C(=C1)C)[O-])C CNP0516353.0 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.22 NC1=CC(=C(C(=C1)O)O)N CNP0223457.0 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.22 OC1=C(C=C(C=C1Br)Br)Br CNP0415243.0 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.22 OC1=C(C=C(C=C1Br)Br)Cl CNP0017890.0 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.22 OC1=C(C=C(C=C1Br)Cl)Br CNP0371629.0 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.22 OC1=C(C=C(C=C1Br)Cl)Cl CNP0322036.0 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.22 OC1=C(C=C(C=C1Cl)I)Cl CNP0173173.0 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.22 OC1=CC(=C(C(=C1)Br)O)Br CNP0113606.0 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.22 OC1=CC(=C(C(=C1)Cl)O)Cl CNP0083796.0 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.22 OC1=CC(=C(C(=C1)I)O)I CNP0313558.0 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.22 OC1=CC(=C(C(=C1)O)O)O CNP0134222.0 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.22 OC1=CC(=CC(=C1O)Br)Br CNP0081702.0 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.22 OC1=CC(=CC(=C1O)Cl)Cl CNP0598413.0 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.118 CC1=C(C=C(C(=C1)C)C)C CNP0218764.0 [1,1,0,0,0,0|0,0,0]=2 617 B10R1.118 CC1=C(N=C(C(=N1)C)C)C CNP0327107.0 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.118 CC1=CC(=C(C=C1Br)C)Br CNP0024349.0 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.118 CC1=CC(=C(C=C1C)N)N CNP0106845.0 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.118 CC1=CC(=C(C=C1C)O)C CNP0242109.0 [1,1,0,0,0,0|0,0,0]=2 621 B10R1.118 CC1=CC(=C(C=C1Cl)C)Cl CNP0062326.0 [1,1,0,0,0,0|1,0,0]=3 622 B10R1.118 CC1=CC(=C(C=C1O)C)O CNP0533659.0 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.118 CC1=CC(=C(N=C1C)C)C CNP0272756.0 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.118 CC1=CC(=O)C(=CC1=O)C CNP0221747.0 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.118 CC1=CC(=O)C(=CC1=O)O CNP0288982.0 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.118 CC1=CN(C(=O)N=C1O)C CNP0516273.0 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.118 O=C1C=C(C(=O)C=C1O)O CNP0327645.0 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.118 OC1=C(C=C(C(=C1)O)O)O CNP0611719.0 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.118 OC1=CC(=C(C=C1Cl)O)Cl CNP0067457.0 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.118 OC1=CC(=C(C=C1O)Br)Br CNP0556999.0 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.119 CC1=C(C(=O)C(=CO1)C)O CNP0126465.0 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.119 CC1=C(C(=O)C(=CO1)O)O CNP0249032.0 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.119 CC1=C(C(=O)C=CC1=O)C CNP0252044.0 [1,1,0,0,0,0|1,0,1]=4 634 B10R1.119 CC1=C(C(=O)C=CC1=O)O CNP0304817.0 [1,1,0,0,0,0|1,0,1]=4 635 B10R1.119 CC1=C(C(=O)C=CN1C)O CNP0409474.0 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.119 CC1=C(C=CC(=C1C)O)N CNP0562106.0 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.119 CC1=C(C=CC(=C1C)O)O CNP0119775.0 [1,1,0,0,0,0|1,0,0]=3 638 B10R1.119 CC1=C(C=CC(=C1O)O)O CNP0354287.0 [1,1,0,0,0,0|1,0,0]=3 639 B10R1.119 CC1=CC=C(C(=C1C)C)C CNP0376974.0 [1,1,0,0,0,0|0,0,0]=2 640 B10R1.119 CC1=CC=C(C(=C1C)O)C CNP0224100.0 [1,1,0,0,0,0|0,0,0]=2 641 B10R1.119 CC1=CC=C(C(=C1C)O)O CNP0352924.0 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.119 CC1=CC=C(C(=C1Cl)C)S CNP0345116.0 [1,1,0,0,0,0|0,1,0]=3 643 B10R1.119 CC1=CC=C(C(=C1O)C)O CNP0142427.0 [1,1,0,0,0,0|0,0,0]=2 644 B10R1.119 CC1=CC=C(C(=C1O)O)C CNP0183636.0 [1,1,0,0,0,0|1,0,0]=3 645 B10R1.119 CC1=CN=C(C(=C1C)C)C CNP0265742.0 [1,1,0,0,0,0|1,0,0]=3 646 B10R1.119 CC1=CN=C(N(C1=O)C)O CNP0559149.0 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.119 OC1=CC=C(C(=C1Br)Br)Br CNP0133044.0 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.119 OC1=CC=C(C(=C1Br)O)Br CNP0192123.0 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.119 OC1=CC=C(C(=C1O)O)O CNP0189021.0 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.59 CC(=O)C1=C(OC(=C1)C)C CNP0003652.0 [0,1,0,0,1,0|2,0,0]=4 651 B10R1.59 CC(=O)C1=C(SC(=C1)C)C CNP0002469.0 [0,1,0,0,1,0|2,0,0]=4 652 B10R1.130 CSSC1=C(OC(=C1)C)C CNP0237474.0 [0,1,0,0,1,0|1,1,0]=4 653 B10R1.256 CCC1=C(NC(=C1C)C)C CNP0244315.0 [0,1,0,0,1,0|2,0,0]=4 654 B10R1.256 COC1=C(O[C@@H](C1=O)C)C CNP0239878.1 [0,1,0,0,1,0|1,0,1]=4 655 B12R1.46 COC1=CC=C(C=C1C(=O)O)O CNP0241896.0 [0,2,0,0,0,0|1,0,1]=4 656 B12R1.46 COC1=CC=C(C=C1C(C)C)C CNP0102635.0 [0,2,0,0,0,0|0,0,0]=2 657 B12R1.46 COC1=NC=C(N=C1C(C)C)C CNP0379235.0 [0,2,0,0,0,0|2,0,0]=4 658 B12R1.57 C=C(C)C1=CC=C(C=C1OC)C CNP0333087.0 [0,2,0,0,0,0|1,0,0]=3 659 B12R1.57 COC1=CC(=CC=C1C(=O)C)C CNP0305290.0 [0,2,0,0,0,0|1,0,0]=3 660 B12R1.57 COC1=CC(=CC=C1C(=O)C)O CNP0146399.0 [0,2,0,0,0,0|2,0,0]=4 661 B12R1.57 COC1=CC(=CC=C1C(C)C)C CNP0280563.0 [0,2,0,0,0,0|1,0,0]=3 662 B12R1.78 C=CC1=CC=C(C(=C1)OC)OC CNP0198714.0 [0,2,0,0,0,0|0,0,1]=3 663 B12R1.78 C=CC1=CC=C(C=C1OC)OC CNP0270983.0 [0,2,0,0,0,0|1,0,1]=4 664 B12R1.78 CCC1=CC=C(C(=C1)CC)CC CNP0612118.0 [0,2,0,0,0,0|1,0,0]=3 665 B12R1.78 CCC1=CC=C(C(=C1)OC)OC CNP0104859.0 [0,2,0,0,0,0|0,0,0]=2 666 B12R1.78 COC1=CC=C(C(=C1)CN)OC CNP0470145.0 [0,2,0,0,0,0|0,0,0]=2 667 B12R1.78 COC1=CC=C(C(=C1)OC)C#N CNP0189009.0 [0,2,0,0,0,0|2,0,0]=4 668 B12R1.78 COC1=CC=C(C(=C1)OC)C=O CNP0303686.0 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.78 COC1=CC=C(C(=C1)OC)OC CNP0327068.0 [0,2,0,0,0,0|0,0,0]=2 670 B12R1.78 COC1=CC=C(C=C1C=O)C=O CNP0350650.0 [0,2,0,0,0,0|0,0,2]=4 671 B12R1.78 COC1=CC=C(C=C1OC)C=O CNP0216130.0 [0,2,0,0,0,0|0,0,1]=3 672 B12R1.78 COC1=CC=C(C=C1OC)CCl CNP0479327.0 [0,2,0,0,0,0|0,0,0]=2 673 B12R1.78 COC1=CC=C(C=C1OC)CO CNP0202849.0 [0,2,0,0,0,0|0,0,0]=2 674 B12R1.112 CCOC1=CC=C(C=C1CO)O CNP0181724.0 [0,2,0,0,0,0|1,0,0]=3 675 B12R1.234 COC1=C(C=C(C=C1C=O)Br)Br CNP0017776.0 [0,2,0,0,0,0|1,0,1]=4 676 B12R1.448 COC1=CC(=C(C=C1OC)Br)N CNP0287472.0 [0,2,0,0,0,0|1,0,0]=3 677 B12R1.448 COC1=CC(=C(C=C1OC)Cl)Cl CNP0045278.0 [0,2,0,0,0,0|1,0,0]=3 678 B12R1.448 COC1=CC(=C(C=C1OC)O)C CNP0611541.0 [0,2,0,0,0,0|0,0,0]=2 679 B12R1.652 CCC1=CC=C(C(=C1CC)C)C CNP0108226.0 [0,2,0,0,0,0|1,0,0]=3 680 B12R1.652 COC1=C(C(=O)N(C=C1)C)C#N CNP0318450.0 [0,2,0,0,0,0|1,0,1]=4 681 B12R1.69 CNC=NC1=CC=C(C=C1C)Cl CNP0202100.0 [0,2,0,0,0,0|2,0,0]=4 682 B12R1.69 NC1=CC=C(C(=C1)N)OCCO CNP0611677.0 [0,2,0,0,0,0|2,0,0]=4 683 B12R1.114 CC=CC1=CC=C(C=C1O)OC CNP0526472.0 [0,2,0,0,0,0|2,0,0]=4 684 B12R1.114 CCCC1=CC=C(C=C1C)CC CNP0216673.0 [0,2,0,0,0,0|1,0,0]=3 685 B12R1.114 CCOC1=CC=C(C=C1O)CO CNP0221615.0 [0,2,0,0,0,0|1,0,0]=3 686 B12R1.233 CC(=O)NC1=CC=C(C=C1C)C CNP0024058.0 [0,2,0,0,0,0|1,0,0]=3 687 B12R1.233 CC(=O)NC1=CC=C(C=C1C)Cl CNP0052006.0 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.233 CC(=O)NC1=CC=C(C=C1O)C CNP0038952.0 [0,2,0,0,0,0|2,0,0]=4 689 B12R1.233 CC(=O)OC1=CC=C(C=C1Br)Br CNP0200680.0 [0,2,0,0,0,0|2,0,0]=4 690 B12R1.233 CC(=O)OC1=CC=C(C=C1C)O CNP0077014.0 [0,2,0,0,0,0|1,0,0]=3 691 B12R1.1095 CCOC1=C(C=C(C=C1Br)Br)Br CNP0289706.0 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.1123 CCOC1=CC(=O)C(=CC1=O)C CNP0330602.0 [0,2,0,0,0,0|1,0,0]=3 693 B12R1.1703 C=C(CO)C1=CC=C(C=C1O)C CNP0106917.0 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.1703 CC(=NO)C1=CC=C(C=C1O)C CNP0366379.0 [0,2,0,0,0,0|2,0,0]=4 695 B12R1.1703 CC1=CC=C(C(=C1)O)[C@H](C)CO CNP0160693.1 [0,2,0,0,0,0|2,0,0]=4 696 B12R1.1703 CCC(=O)C1=CC=C(C=C1C)C CNP0099963.0 [0,2,0,0,0,0|1,0,0]=3 697 B12R1.1703 COC(=O)C1=CC=C(C=C1C)O CNP0298795.0 [0,2,0,0,0,0|1,0,0]=3 698 B12R1.1703 COC(=O)C1=CC=C(C=C1N)Cl CNP0168201.0 [0,2,0,0,0,0|2,0,0]=4 699 B12R1.1703 COC(=O)C1=CC=C(C=C1O)N CNP0026548.0 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.1703 COC(=O)C1=CC=C(C=C1O)O CNP0316033.0 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.126 CC1=CC=C(C(=C1)O)C(C)(C)C CNP0173144.0 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.126 CC1=CC=C(C(=C1)O)C(C)(C)O CNP0116220.0 [0,2,0,0,0,0|2,0,0]=4 703 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)C CNP0579678.0 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)O CNP0136455.0 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.232 CC1=CC(=C(C=C1C)C(=O)O)C CNP0171746.0 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.232 CC1=CC(=C(C=C1C)C(C)C)C CNP0164128.0 [0,2,0,0,0,0|1,0,0]=3 707 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)O CNP0224526.0 [0,2,0,0,0,0|2,0,0]=4 708 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)C CNP0158912.0 [0,2,0,0,0,0|2,0,0]=4 709 B12R1.452 CC(=O)C1=CC=C(C=C1O)CO CNP0111501.0 [0,2,0,0,0,0|2,0,0]=4 710 B12R1.452 CC(C)C1=CC=C(C=C1O)CO CNP0290057.0 [0,2,0,0,0,0|2,0,0]=4 711 B12R1.452 COC1=CC=C(C(=C1)C)C(=O)O CNP0457363.0 [0,2,0,0,0,0|2,0,0]=4 712 B12R1.452 COC1=CC=C(C(=C1)C)[N+](=O)[O-] CNP0580280.0 [0,2,0,0,0,0|2,0,0]=4 713 B12R1.452 COC1=CC=C(C(=C1)O)C(=O)C CNP0324617.0 [0,2,0,0,0,0|2,0,0]=4 714 B12R1.893 CC(=O)C1=CC=C(C(=C1C)C)C CNP0584174.0 [0,2,0,0,0,0|1,0,0]=3 715 B12R1.893 CC1=CC=C(C(=C1C)C)C(=O)O CNP0133340.0 [0,2,0,0,0,0|2,0,0]=4 716 B12R1.893 CC1=CC=C(C(=C1O)C)C(C)C CNP0526701.0 [0,2,0,0,0,0|1,0,0]=3 717 B12R1.893 CC1=CC=C(C(=C1O)O)C(C)C CNP0298407.0 [0,2,0,0,0,0|2,0,0]=4 718 B12R1.1000 CC(=O)C1=C(C=C(C=C1O)C)O CNP0488335.0 [0,2,0,0,0,0|2,0,0]=4 719 B12R1.1000 CC(=O)C1=C(C=C(C=C1O)O)C CNP0142841.0 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.1000 CC1=CC(=C(C(=C1)C)C(=O)Cl)C CNP0037744.0 [0,2,0,0,0,0|2,0,0]=4 721 B12R1.1000 CC1=CC(=C(C(=C1)C)C(=O)O)C CNP0444261.0 [0,2,0,0,0,0|2,0,0]=4 722 B12R1.1000 CC1=CC(=C(C(=C1)C)C(C)O)C CNP0230604.0 [0,2,0,0,0,0|1,0,0]=3 723 B12R1.14 CC1=CC(=C(C(=C1C)C)C)C=O CNP0609155.0 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.14 CC1=CC(=C(C(=C1C)C)C)CCl CNP0291313.0 [0,2,0,0,0,0|2,0,0]=4 725 B12R1.14 CCC1=C(C(=C(C(=O)O1)C)O)C CNP0147337.0 [0,2,0,0,0,0|2,0,0]=4 726 B12R1.14 COC1=C(C(=O)N(C(=C1)O)C)O CNP0278685.0 [0,2,0,0,0,0|2,0,0]=4 727 B12R1.14 COC1=CC(=C(C(=C1C)C)O)C CNP0572680.0 [0,2,0,0,0,0|1,0,0]=3 728 B12R1.14 COC1=CC(=C(C(=C1Cl)C)Cl)O CNP0130539.0 [0,2,0,0,0,0|2,0,0]=4 729 B12R1.14 COC1=CC(=C(C(=C1Cl)O)Cl)C CNP0513062.0 [0,2,0,0,0,0|2,0,0]=4 730 B12R1.14 COC1=CC(=C(C(=C1O)Cl)Cl)Cl CNP0263801.0 [0,2,0,0,0,0|2,0,0]=4 731 B12R1.14 COC1=CC(=C(C(=C1O)O)C)O CNP0250808.0 [0,2,0,0,0,0|1,0,0]=3 732 B12R1.14 COC1=CC(=O)C(=C(C1=O)C)Cl CNP0348389.0 [0,2,0,0,0,0|2,0,0]=4 733 B12R1.14 COC1=CC(=O)C(=C(C1=O)C)O CNP0164479.0 [0,2,0,0,0,0|2,0,0]=4 734 B12R1.14 COC1=CC(=O)C(=C(C1=O)O)C CNP0188138.0 [0,2,0,0,0,0|1,0,0]=3 735 B12R1.14 COC1=CC(=O)N(C(=C1O)[O])C CNP0537826.0 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.98 CC1=CC(=C(C(=C1C)C)CCl)C CNP0059344.0 [0,2,0,0,0,0|2,0,0]=4 737 B12R1.98 COC1=C(C(=O)C(=CC1=O)C)O CNP0304377.0 [0,2,0,0,0,0|1,0,0]=3 738 B12R1.98 COC1=C(C=C(C(=C1Cl)Cl)Cl)O CNP0329532.0 [0,2,0,0,0,0|2,0,0]=4 739 B12R1.98 COC1=C(C=C(C(=C1Cl)O)Cl)Cl CNP0234871.0 [0,2,0,0,0,0|2,0,0]=4 740 B12R1.98 COC1=C(C=C(C(=C1O)O)C)O CNP0170903.0 [0,2,0,0,0,0|1,0,0]=3 741 B12R1.449 CC1=CC(=C(C=C1C#N)C#N)C CNP0133100.0 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.449 CC1=CC(=C(C=C1CCl)CCl)C CNP0033826.0 [0,2,0,0,0,0|2,0,0]=4 743 B12R1.449 COC1=CC(=C(C=C1Br)Br)OC CNP0032286.0 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.449 COC1=CC(=C(C=C1O)Br)C=O CNP0403804.0 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.449 COC1=CC(=C(C=C1O)Cl)C=O CNP0154420.0 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.450 CC1=CC(=C(C=C1CCl)C)CCl CNP0193633.0 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.450 COC1=CC(=C(C=C1C)C=O)C CNP0330103.0 [0,2,0,0,0,0|0,0,1]=3 748 B12R1.450 COC1=CC(=C(C=C1Cl)OC)Cl CNP0157378.0 [0,2,0,0,0,0|1,0,0]=3 749 B12R1.450 COC1=CC(=C(C=C1O)C=O)O CNP0579091.0 [0,2,0,0,0,0|1,0,1]=4 750 B12R1.450 COC1=CC(=C(C=C1O)OC)O CNP0571520.0 [0,2,0,0,0,0|1,0,0]=3 751 B12R1.450 COC1=CC(=O)C(=CC1=O)OC CNP0323230.0 [0,2,0,0,0,0|1,0,0]=3 752 B12R1.653 C=CC1=CC=C(C(=C1O)O)OC CNP0422952.0 [0,2,0,0,0,0|1,0,1]=4 753 B12R1.653 COC1=CC=C(C(=C1C)C)C=O CNP0026563.0 [0,2,0,0,0,0|0,0,1]=3 754 B12R1.653 COC1=CC=C(C(=C1O)O)C=O CNP0224833.0 [0,2,0,0,0,0|1,0,1]=4 755 B12R1.653 COC1=CC=C(C(=C1O)O)OC CNP0075796.0 [0,2,0,0,0,0|1,0,0]=3 756 B12R1.654 COC1=COC(=C(C1=O)OC)C CNP0194493.0 [0,2,0,0,0,0|2,0,0]=4 757 B12R1.48 COC1=CC=C(C=C1Br)C(=O)O CNP0097136.0 [0,2,0,0,0,0|1,0,1]=4 758 B12R1.48 COC1=CC=C(C=C1Cl)C(=O)O CNP0343437.0 [0,2,0,0,0,0|1,0,1]=4 759 B12R1.48 COC1=CC=C(C=C1N)C(=O)N CNP0070991.0 [0,2,0,0,0,0|1,0,1]=4 760 B12R1.48 COC1=CC=C(C=C1O)C(=O)C CNP0215048.0 [0,2,0,0,0,0|1,0,0]=3 761 B12R1.48 COC1=CC=C(C=C1O)C(=O)N CNP0428552.0 [0,2,0,0,0,0|1,0,1]=4 762 B12R1.48 COC1=CC=C(C=C1O)C(=O)O CNP0220341.0 [0,2,0,0,0,0|1,0,1]=4 763 B12R1.48 COC1=CC=C(C=C1O)[N+](=O)[O-] CNP0599616.0 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.288 C=CCC1=CC=C(C(=C1)O)OC CNP0181536.0 [0,2,0,0,0,0|1,0,0]=3 765 B12R1.288 CC=CC1=CC=C(C(=C1)O)OC CNP0299210.0 [0,2,0,0,0,0|1,0,0]=3 766 B12R1.288 CCCC1=CC=C(C(=C1)O)OC CNP0214353.0 [0,2,0,0,0,0|1,0,0]=3 767 B12R1.288 COC1=CC=C(C=C1Br)CC#N CNP0197630.0 [0,2,0,0,0,0|1,0,0]=3 768 B12R1.288 COC1=CC=C(C=C1O)CCN CNP0246187.0 [0,2,0,0,0,0|1,0,0]=3 769 B12R1.288 COC1=CC=C(C=C1O)CCO CNP0076040.0 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.288 COCC1=CC(=O)C(=CO1)OC CNP0145153.0 [0,2,0,0,0,0|2,0,0]=4 771 B12R1.301 C=CC1=CC(=C(C(=C1)O)OC)O CNP0344299.0 [0,2,0,0,0,0|1,0,1]=4 772 B12R1.301 CC1=CC(=CC(=C1C=O)O)CO CNP0539021.0 [0,2,0,0,0,0|2,0,0]=4 773 B12R1.301 CCC1=C(C=C(N=C1C)OC)C CNP0611558.0 [0,2,0,0,0,0|2,0,0]=4 774 B12R1.301 COC1=C(C=C(C=C1Br)C=O)Br CNP0266347.0 [0,2,0,0,0,0|1,0,1]=4 775 B12R1.301 COC1=C(C=C(C=C1Br)C=O)Cl CNP0421884.0 [0,2,0,0,0,0|1,0,1]=4 776 B12R1.301 COC1=C(C=C(C=C1Br)C=O)O CNP0158043.0 [0,2,0,0,0,0|1,0,1]=4 777 B12R1.301 COC1=C(C=C(C=C1Br)CO)O CNP0134246.0 [0,2,0,0,0,0|1,0,0]=3 778 B12R1.301 COC1=C(C=C(C=C1Cl)C=O)Cl CNP0389372.0 [0,2,0,0,0,0|1,0,1]=4 779 B12R1.301 COC1=C(C=C(C=C1Cl)CO)Cl CNP0365104.0 [0,2,0,0,0,0|1,0,0]=3 780 B12R1.301 COC1=C(C=C(C=C1O)C=O)O CNP0109385.0 [0,2,0,0,0,0|1,0,1]=4 781 B12R1.301 COC1=C(C=C(C=C1O)CO)O CNP0164196.0 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.301 COC1=CC(=C(C(=C1)Br)OC)Br CNP0222506.0 [0,2,0,0,0,0|1,0,0]=3 783 B12R1.301 COC1=CC(=C(C(=C1)O)C=O)C CNP0205790.0 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.301 COC1=CC(=C(C(=C1)O)OC)O CNP0238336.0 [0,2,0,0,0,0|1,0,0]=3 785 B10R1.377 CC=CC1(C=CC=CC1)C CNP0535246.0 [0,0,1,1,0,0|1,0,1]=4 786 B10R1.14 COC(=O)C1=CC(=CN1)C CNP0393568.0 [0,0,1,1,0,0|2,0,0]=4 787 B10R1.8 C=CC1=CC(=CC(=C1)C)C CNP0039391.0 [0,0,1,1,0,0|1,0,1]=4 788 B10R2.7 B1OC2=CC=CC=C2O1 CNP0578277.0 [1,0,0,1,0,0|2,0,0]=4 789 B10R2.7 C1=CC2=C(C=N1)CCC2 CNP0185623.0 [1,0,0,1,0,0|2,0,0]=4 790 B10R2.7 C1=CC2=CC=CC=C2C1 CNP0274708.0 [1,0,0,1,0,0|1,0,1]=4 791 B10R2.7 C1=CC=C2CCCC2=C1 CNP0252618.0 [1,0,0,1,0,0|1,0,0]=3 792 B10R2.7 C1=CC=C2COCC2=C1 CNP0243831.0 [1,0,0,1,0,0|2,0,0]=4 793 B10R2.7 C1=CC=C2NCCC2=C1 CNP0077169.0 [1,0,0,1,0,0|1,0,0]=3 794 B10R2.7 C1=CC=C2OC=CC2=C1 CNP0281508.0 [1,0,0,1,0,0|0,0,2]=4 795 B10R2.7 C1=CC=C2OC=NC2=C1 CNP0417737.0 [1,0,0,1,0,0|1,0,1]=4 796 B10R2.7 C1=CC=C2OCCC2=C1 CNP0256577.0 [1,0,0,1,0,0|0,0,0]=2 797 B10R2.7 C1=CC=C2OCOC2=C1 CNP0530999.0 [1,0,0,1,0,0|1,0,0]=3 798 B10R2.7 C1=CC=C2SCSC2=C1 CNP0075064.0 [1,0,0,1,0,0|1,1,0]=4 799 B10R2.7 C1=CN=C2CCCC2=C1 CNP0189817.0 [1,0,0,1,0,0|2,0,0]=4 800 B10R2.7 C1=NC2=CC=CC=C2C1 CNP0265847.0 [1,0,0,1,0,0|1,0,1]=4 801 B10R2.320 C[C@@H]1CC2=CC=CC=C12 CNP0061060.1 [1,0,0,1,0,0|1,0,0]=3 802 B10R2.320 C[C@H]1CC2=CC=CC=C12 CNP0061060.2 [1,0,0,1,0,0|1,0,0]=3 803 B10R2.320 Cl[C@@H]1CC2=CC=CC=C12 CNP0059667.1 [1,0,0,1,0,0|2,0,0]=4 804 B10R2.320 Cl[C@H]1CC2=CC=CC=C12 CNP0059667.2 [1,0,0,1,0,0|2,0,0]=4 805 B10R2.320 N[C@@H]1CC2=CC=CC=C12 CNP0460995.2 [1,0,0,1,0,0|2,0,0]=4 806 B10R2.320 N[C@H]1CC2=CC=CC=C12 CNP0460995.1 [1,0,0,1,0,0|2,0,0]=4 807 B10R2.320 O=C1CC2=CC=CC=C12 CNP0099578.0 [1,0,0,1,0,0|2,0,0]=4 808 B10R2.320 O[C@@H]1CC2=CC=CC=C12 CNP0043883.1 [1,0,0,1,0,0|2,0,0]=4 809 B10R2.320 O[C@H]1CC2=CC=CC=C12 CNP0043883.2 [1,0,0,1,0,0|2,0,0]=4 810 B12R2.24 CC1=CC2=C(C=N1)CCCC2 CNP0203215.0 [0,1,0,1,0,0|2,0,0]=4 811 B12R2.24 CC1=CC=C2CCCCC2=C1 CNP0289026.0 [0,1,0,1,0,0|1,0,0]=3 812 B12R2.24 IC1=CC=C2CCNCC2=C1 CNP0494703.0 [0,1,0,1,0,0|2,0,0]=4 813 B12R2.24 OC1=CC=C2CCCCC2=C1 CNP0031078.0 [0,1,0,1,0,0|2,0,0]=4 814 B12R2.24 OC1=CC=C2CCNCC2=C1 CNP0284580.0 [0,1,0,1,0,0|2,0,0]=4 815 B12R2.24 OC1=CC=C2CNCCC2=C1 CNP0194768.0 [0,1,0,1,0,0|2,0,0]=4 816 B12R2.24 OC1=CC=C2OCC=CC2=C1 CNP0535758.0 [0,1,0,1,0,0|1,0,1]=4 817 B12R2.132 CC1=CC=C2C=NN(C2=C1)C CNP0609157.0 [0,1,0,1,0,0|2,0,0]=4 818 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 CNP0107236.0 [0,1,0,1,0,0|1,0,1]=4 819 B12R2.132 C[C@H]1CCC2=CC=C(C=C12)O CNP0247617.1 [0,1,0,1,0,0|2,0,0]=4 820 B12R2.132 O=C1COC2=CC=C(C=C12)O CNP0168548.0 [0,1,0,1,0,0|1,0,1]=4 821 B12R2.132 O[C@@H]1CCC2=CC=C(C=C12)Br CNP0369911.2 [0,1,0,1,0,0|2,0,0]=4 822 B12R2.132 O[C@H]1CCC2=CC=C(C=C12)Br CNP0369911.1 [0,1,0,1,0,0|2,0,0]=4 823 B12R2.600 CC1C2=CC=C(C=C2C1C)Cl CNP0345606.0 [0,1,0,1,0,0|2,0,0]=4 824 B12R2.612 CC1=CC2=NNC(=C2C=C1)C CNP0075999.0 [0,1,0,1,0,0|2,0,0]=4 825 B12R2.612 CC1=CC=C2C(=C1)OC[C@H]2C CNP0185437.1 [0,1,0,1,0,0|1,0,0]=3 826 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 CNP0313972.0 [0,1,0,1,0,0|1,0,0]=3 827 B12R2.612 CC1=CC=C2C(=O)OCC2=C1 CNP0525702.0 [0,1,0,1,0,0|2,0,0]=4 828 B12R2.612 C[C@H]1CCC2=CC(=CC=C12)O CNP0200024.1 [0,1,0,1,0,0|2,0,0]=4 829 B12R2.612 O=C1CCC2=CC(=CC=C12)O CNP0499088.0 [0,1,0,1,0,0|2,0,0]=4 830 B12R2.246 CC1=CC(=C2CCCC2=C1)C CNP0332105.0 [0,1,0,1,0,0|1,0,0]=3 831 B12R2.246 CC1=CC(=C2CCCC2=C1)O CNP0201391.0 [0,1,0,1,0,0|1,0,0]=3 832 B12R2.246 CC1=CC(=C2NN=CC2=C1)C CNP0176125.0 [0,1,0,1,0,0|1,0,1]=4 833 B12R2.246 CC1=CC(=C2OC=CC2=C1)C CNP0283975.0 [0,1,0,1,0,0|0,0,1]=3 834 B12R2.606 O=C1CC2=CC(=CC=C2O1)O CNP0197068.0 [0,1,0,1,0,0|1,0,1]=4 835 B12R2.3028 CC1=CC(=C2C(=C1)C[C@@H]2Cl)C CNP0059933.2 [0,1,0,1,0,0|1,0,0]=3 836 B12R2.3028 CC1=CC(=C2C(=C1)C[C@H]2Cl)C CNP0059933.1 [0,1,0,1,0,0|1,0,0]=3 837 B12R2.3028 CC1=CC(=C2C(=O)CC2=C1)C CNP0342183.0 [0,1,0,1,0,0|1,0,0]=3 838 B12R2.100 CC1=CC2=C(C=C1C)OC=C2 CNP0161352.0 [0,1,0,1,0,0|0,0,2]=4 839 B12R2.100 CC1=CC2=C(C=C1O)CCC2 CNP0233345.0 [0,1,0,1,0,0|1,0,0]=3 840 B12R2.100 O=C1C=C2OCOC2=CC1=O CNP0358335.0 [0,1,0,1,0,0|2,0,0]=4 841 B12R2.100 OC1=CC2=C(C=C1O)NCC2 CNP0258485.0 [0,1,0,1,0,0|2,0,0]=4 842 B12R2.782 CC1=CC(=C2CCC2=C1C)C CNP0055253.0 [0,1,0,1,0,0|1,0,0]=3 843 B12R2.82 CC1=C(C=CC2=C1CCC2)O CNP0145755.0 [0,1,0,1,0,0|2,0,0]=4 844 B12R2.82 CC1=CC=C2CCCC2=C1O CNP0311243.0 [0,1,0,1,0,0|1,0,0]=3 845 B12R2.82 CC1=CC=C2OC=CC2=C1C CNP0353341.0 [0,1,0,1,0,0|0,0,2]=4 846 B12R2.1134 CC1=CC2=C(CC2)C(=C1C)C CNP0057619.0 [0,1,0,1,0,0|1,0,0]=3 847 B12R2.44 C=CC1=CC=C2OCOC2=C1 CNP0179510.0 [0,1,0,1,0,0|1,0,1]=4 848 B12R2.44 COC1=CC=C2OC=CC2=C1 CNP0295160.0 [0,1,0,1,0,0|0,0,2]=4 849 B12R2.44 N#CC1=CC=C2OCOC2=C1 CNP0231839.0 [0,1,0,1,0,0|1,0,1]=4 850 B12R2.44 O=CC1=CC=C2CCCC2=C1 CNP0186232.0 [0,1,0,1,0,0|1,0,1]=4 851 B12R2.44 O=CC1=CC=C2OCOC2=C1 CNP0179491.0 [0,1,0,1,0,0|1,0,1]=4 852 B12R2.44 O=[14CH]C1=CC=C2OCOC2=C1 CNP0519930.0 [0,1,0,1,0,0|1,0,1]=4 853 B12R2.44 OCC1=CC=C2OC=CC2=C1 CNP0151111.0 [0,1,0,1,0,0|0,0,2]=4 854 B12R2.44 OCC1=CC=C2OCOC2=C1 CNP0392701.0 [0,1,0,1,0,0|1,0,0]=3 855 B12R2.2107 COC1=CC=C2C(=C1)C[C@@H]2O CNP0048694.1 [0,1,0,1,0,0|2,0,0]=4 856 B12R2.2107 COC1=CC=C2C(=C1)C[C@H]2O CNP0048694.2 [0,1,0,1,0,0|2,0,0]=4 857 B12R2.2107 COC1=CC=C2C(=O)CC2=C1 CNP0182366.0 [0,1,0,1,0,0|2,0,0]=4 858 B8R0.2 C=C(C)C(=C(Cl)CC)C CNP0076708.0 [0,0,1,0,1,0|2,0,0]=4 859 B8R1.1 CCC1=CC=C(O1)C CNP0251701.0 [1,0,0,0,1,0|2,0,0]=4 860 B8R1.1 CCC1=CC=C(S1)C CNP0003636.0 [1,0,0,0,1,0|2,0,0]=4 861 B8R1.1 COC1=CN=C(S1)C CNP0335219.0 [1,0,0,0,1,0|2,0,0]=4 862 B8R1.1 CSC1=CC=C(O1)C CNP0304917.0 [1,0,0,0,1,0|1,1,0]=4 863 B8R1.1 CSC1=CC=C(S1)C CNP0231852.0 [1,0,0,0,1,0|1,1,0]=4 864 B8R1.11 CSC1=C(OC=C1)C CNP0148789.0 [1,0,0,0,1,0|1,1,0]=4 865 B8R1.18 CC1=CC(=C(N1)C)C CNP0194129.0 [1,0,0,0,1,0|1,0,0]=3 866 B8R1.18 CC1=CC(=C(O1)C)C CNP0302629.0 [1,0,0,0,1,0|1,0,0]=3 867 B8R1.18 CC1=CC(=C(O1)C)S CNP0277106.0 [1,0,0,0,1,0|1,1,0]=4 868 B8R1.18 CC1=NC(=C(O1)C)C CNP0297316.0 [1,0,0,0,1,0|2,0,0]=4 869 B8R1.18 CC1=NC(=C(S1)C)C CNP0077136.0 [1,0,0,0,1,0|2,0,0]=4 870 B8R1.50 CC1=CCC(=C1C)C CNP0578082.0 [1,0,0,0,1,0|0,0,1]=3 871 B8R1.50 O=C1C=CC(=C1O)O CNP0105932.0 [1,0,0,0,1,0|2,0,0]=4 872 B8R1.46 COC1=CC(=O)C1=O CNP0248390.0 [0,0,0,0,2,0|2,0,0]=4 873 B10R0.57 COC(=O)C(=COC(=O)C)C CNP0073278.0 [0,0,1,0,0,1|2,0,0]=4 874 B10R1.332 CC1=C(C=CC(=O)C=C1)Cl CNP0070609.0 [1,0,0,0,0,1|2,0,0]=4