0 B9R1.15 C=CC1=CC=CC=C1C CNP0569304.0 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.15 C=CC1=NC=CN=C1C CNP0133832.0 [0,0,0,0,0,0|0,0,2]=2 2 B9R1.15 CC1=CC=CC=C1C#N CNP0120357.0 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.15 CC1=CC=CC=C1C=O CNP0312869.0 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.15 CC1=CC=CC=C1CCl CNP0029564.0 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.15 CC1=CC=CC=C1CO CNP0113926.0 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.15 CC1=CC=CC=C1I=O CNP0563313.0 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.15 CC1=CC=CN=C1N=O CNP0071253.0 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.15 CC1=CC=NC=C1CO CNP0046684.0 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.15 CCC1=CC=CC=C1Br CNP0315528.0 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.15 CCC1=CC=CC=C1C CNP0106326.0 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.15 CCC1=CC=CC=C1N CNP0197081.0 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.15 CCC1=CC=CC=C1O CNP0206933.0 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.15 CCC1=CC=CC=C1S CNP0371262.0 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.15 CCC1=CN=CC=C1C CNP0308912.0 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.15 CCC1=NC=CC=C1O CNP0052915.0 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.15 CCC1=NC=CN=C1C CNP0243820.0 [0,0,0,0,0,0|0,0,0]=0 17 B9R1.15 CC[N+]1=CC=CC=C1C CNP0536214.0 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.15 COC1=CC=CC=C1C CNP0180967.0 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.15 COC1=CC=CC=C1N CNP0071243.0 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.15 COC1=CC=CC=C1O CNP0269885.0 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.15 COC1=NC=CC=C1O CNP0055948.0 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.15 COC1=NC=CN=C1C CNP0352774.0 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.15 CSC1=CC=CC=C1O CNP0318961.0 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.15 CSC1=NC=CN=C1C CNP0238636.0 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.15 NC1=CC=CC=C1CO CNP0420692.0 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.15 NCC1=CC=CC=C1O CNP0216216.0 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.15 OC1=CC=CN=C1CBr CNP0054715.0 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.15 OCC1=CC=CC=C1O CNP0104167.0 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.15 SCC1=CC=CC=C1I CNP0505108.0 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.15 [C-]#[N+]C1=CC=CC=C1C CNP0486531.0 [0,0,0,0,0,0|3,0,1]=4 31 B8R1.2 BrCC1=CN=CC=N1 CNP0076953.0 [1,0,0,0,0,0|1,0,0]=2 32 B8R1.2 C=CC1=CC=CN=C1 CNP0522857.0 [1,0,0,0,0,0|1,0,2]=4 33 B8R1.2 C=CC1=CN=CC=N1 CNP0302528.0 [1,0,0,0,0,0|0,0,2]=3 34 B8R1.2 CCC1=CC=CC=C1 CNP0245508.0 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.2 CCC1=CC=CC=N1 CNP0003463.0 [1,0,0,0,0,0|1,0,0]=2 36 B8R1.2 CCC1=CC=CN=C1 CNP0396997.0 [1,0,0,0,0,0|1,0,0]=2 37 B8R1.2 CCC1=CN=CC=N1 CNP0259600.0 [1,0,0,0,0,0|0,0,0]=1 38 B8R1.2 CC[N+]1=CC=CC=C1 CNP0507760.0 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 CNC1=CC=CC=C1 CNP0238665.0 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.2 COC1=CC=CC=C1 CNP0226394.0 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.2 COC1=CC=CC=N1 CNP0086328.0 [1,0,0,0,0,0|2,0,0]=3 42 B8R1.2 COC1=CC=CN=C1 CNP0181639.0 [1,0,0,0,0,0|2,0,0]=3 43 B8R1.2 COC1=CN=CC=N1 CNP0003478.0 [1,0,0,0,0,0|1,0,0]=2 44 B8R1.2 CSC1=CC=CC=C1 CNP0220907.0 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 CSC1=CN=CC=N1 CNP0003124.0 [1,0,0,0,0,0|1,0,0]=2 46 B8R1.2 ClCC1=CC=CC=C1 CNP0182098.0 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.2 N#CC1=CC=CC=N1 CNP0133217.0 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.2 N#CC1=CC=CN=C1 CNP0196992.0 [1,0,0,0,0,0|2,0,1]=4 49 B8R1.2 N#CC1=CN=CC=N1 CNP0023913.0 [1,0,0,0,0,0|1,0,1]=3 50 B8R1.2 NCC1=CC=CC=C1 CNP0287581.0 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.2 NCC1=CC=CC=N1 CNP0472987.0 [1,0,0,0,0,0|2,0,0]=3 52 B8R1.2 O=CC1=CC=CC=N1 CNP0343249.0 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.2 O=CC1=CC=CN=C1 CNP0275958.0 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 O=NC1=CC=CC=N1 CNP0402135.0 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.2 OCC1=CC=CC=C1 CNP0263608.0 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.2 OCC1=CC=CN=C1 CNP0208151.0 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.2 SCC1=CC=CC=C1 CNP0118345.0 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 SCC1=CC=CC=N1 CNP0105723.0 [1,0,0,0,0,0|2,0,0]=3 59 B8R1.2 SCC1=CC=CN=C1 CNP0566755.0 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.2 SCC1=CN=CC=N1 CNP0229809.0 [1,0,0,0,0,0|1,0,0]=2 61 B8R1.2 [18OH]CC1=CC=CC=C1 CNP0583905.0 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 [CH2]CC1=CC=CC=C1 CNP0592603.0 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.5 C=C1[CH]C=CC=C1C CNP0546829.0 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.5 CC1=C(CC=CC1)C CNP0076227.0 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.5 CC1=CC=CC=C1Br CNP0035566.0 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.5 CC1=CC=CC=C1C CNP0365784.0 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.5 CC1=CC=CC=C1Cl CNP0335361.0 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.5 CC1=CC=CC=C1N CNP0178803.0 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.5 CC1=CC=CC=C1O CNP0242840.0 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.5 CC1=CC=CC=C1S CNP0309831.0 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.5 CC1=CC=CC=[N+]1C CNP0553099.0 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.5 CC1=CC=CN=C1C CNP0151242.0 [1,0,0,0,0,0|1,0,0]=2 73 B8R1.5 CC1=CC=CN=C1N CNP0505128.0 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.5 CC1=CC=C[NH+]=C1N CNP0549558.0 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.5 CC1=CC=NC=C1C CNP0275303.0 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.5 CC1=NC=CC=C1O CNP0418507.0 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.5 CC1=NC=CN=C1C CNP0119963.0 [1,0,0,0,0,0|0,0,0]=1 78 B8R1.5 NC1=CC=CN=C1Cl CNP0096813.0 [1,0,0,0,0,0|3,0,0]=4 79 B8R1.5 OC1=CC=CN=C1I CNP0061816.0 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.5 OC1=CC=CN=C1O CNP0082051.0 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.5 [CH2]C1=CC=CC=C1C CNP0593977.0 [1,0,0,0,0,0|2,0,1]=4 82 B10R1.2 CCC1=C(C(=O)C=CO1)O CNP0197022.0 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.2 CCC1=CC=CC(=C1C)C CNP0183405.0 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.2 CCC1=CC=CC(=C1O)C CNP0284386.0 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.2 CCC1=CC=CC(=C1O)O CNP0002512.0 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.2 COC1=CC=CC(=C1C)C CNP0198695.0 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.4 C=CCC1=CC=CC=C1C CNP0595117.0 [0,1,0,0,0,0|2,0,1]=4 88 B10R1.4 C=CCC1=NC=CN=C1C CNP0026370.0 [0,1,0,0,0,0|0,0,1]=2 89 B10R1.4 CC1=CC=CC=C1CC#N CNP0033758.0 [0,1,0,0,0,0|2,0,1]=4 90 B10R1.4 CC=CC1=NC=CN=C1C CNP0073358.0 [0,1,0,0,0,0|0,0,1]=2 91 B10R1.4 CCCC1=CC=CC=C1C CNP0143289.0 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.4 CCCC1=CC=CC=C1N CNP0601076.0 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.4 CCCC1=CC=CC=C1O CNP0092348.0 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.4 CCCC1=NC=CN=C1C CNP0076160.0 [0,1,0,0,0,0|0,0,0]=1 95 B10R1.4 CCOC1=CC=CC=C1C CNP0253397.0 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.4 CCOC1=NC=CN=C1C CNP0003338.0 [0,1,0,0,0,0|0,0,0]=1 97 B10R1.4 COCC1=CC=CC=C1N CNP0216942.0 [0,1,0,0,0,0|3,0,0]=4 98 B10R1.4 NCCC1=CC=CC=C1O CNP0611654.0 [0,1,0,0,0,0|3,0,0]=4 99 B10R1.4 OCCC1=CC=CC=C1O CNP0110289.0 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.20 CCC1=CC=CC=C1C=O CNP0565429.0 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.20 CCC1=CC=CC=C1CC CNP0132869.0 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.20 CCC1=CC=CC=C1CO CNP0418111.0 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.20 CCC1=CC=CC=C1OC CNP0246064.0 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.20 CCC1=NC=CN=C1CC CNP0079931.0 [0,1,0,0,0,0|0,0,0]=1 105 B10R1.20 CCC1=NC=CN=C1OC CNP0002552.0 [0,1,0,0,0,0|0,0,0]=1 106 B10R1.20 CNC1=CC=CC=C1CO CNP0310287.0 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.20 COC1=CC=CC=C1CCl CNP0053789.0 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.20 COC1=CC=CC=C1CN CNP0294075.0 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.20 COC1=CC=CC=C1CO CNP0047350.0 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.20 COC1=CC=CC=C1OC CNP0141393.0 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.20 SCC1=CC=CC=C1CS CNP0028178.0 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.25 C=CC1=NC=C(N=C1C)C CNP0178869.0 [0,1,0,0,0,0|0,0,2]=3 113 B10R1.25 CC1=CC=C(C(=C1)C)CCl CNP0377096.0 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.25 CC1=CC=C(C(=C1)C)CO CNP0490250.0 [0,1,0,0,0,0|3,0,0]=4 115 B10R1.25 CCC1=CC=C(C=C1C)C CNP0219596.0 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.25 CCC1=CC=C(C=C1O)C CNP0289222.0 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.25 CCC1=CC=C(C=C1O)O CNP0279225.0 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.25 CCC1=CN=C(N=C1O)O CNP0514605.0 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.25 CCC1=NC=C(N=C1C)C CNP0193103.0 [0,1,0,0,0,0|0,0,0]=1 120 B10R1.25 COC1=CC=C(C=C1C)C CNP0076750.0 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.25 COC1=CC=C(C=C1C)O CNP0142095.0 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.25 COC1=NC=C(N=C1C)C CNP0234083.0 [0,1,0,0,0,0|1,0,0]=2 123 B10R1.30 C=CC1=NC(=CN=C1C)C CNP0270709.0 [0,1,0,0,0,0|0,0,2]=3 124 B10R1.30 CC1=CC=C(C(=C1)CO)C CNP0281493.0 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.30 CCC1=CC(=CC=C1C)C CNP0220953.0 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.30 CCC1=CC(=CC=C1C)O CNP0305920.0 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.30 CCC1=CC(=CC=C1O)C CNP0329742.0 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.30 CCC1=CC(=CC=C1O)O CNP0246876.0 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.30 CCC1=CC(=O)C=CC1=O CNP0391524.0 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.30 CCC1=NC(=CC=C1O)C CNP0422716.0 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.30 CCC1=NC(=CN=C1C)C CNP0404153.0 [0,1,0,0,0,0|0,0,0]=1 132 B10R1.30 COC1=CC(=CC=C1C)C CNP0250959.0 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.30 COC1=NC(=CN=C1C)C CNP0001523.0 [0,1,0,0,0,0|1,0,0]=2 134 B10R1.30 CSC1=NC(=CN=C1C)C CNP0353191.0 [0,1,0,0,0,0|1,0,0]=2 135 B10R1.61 C=C(C)C1=CC=CC=C1C CNP0192226.0 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.61 CC(=O)C1=CC=CC=C1C CNP0416088.0 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.61 CC(=O)C1=CC=CN=C1C CNP0150212.0 [0,1,0,0,0,0|1,0,1]=3 138 B10R1.61 CC(=O)C1=NC=CN=C1C CNP0253592.0 [0,1,0,0,0,0|0,0,1]=2 139 B10R1.61 CC(C)C1=CC=CC=C1O CNP0332801.0 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.61 CC(S)C1=CC=CC=C1S CNP0245318.0 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.61 CC1=C(C=COC1)C(C)C CNP0183194.0 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.61 CC1=C(OCC=C1)C(C)C CNP0344214.0 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.61 CC1=CC=CC=C1C(C)C CNP0093801.0 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.61 CC1=NC=CC=C1C(=O)O CNP0576614.0 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.245 CC1=CC=CC(=C1CO)O CNP0321165.0 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.245 CCC1=C(C=CC=C1C)C CNP0182931.0 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.245 CCN1C(=CC=NC1=O)N CNP0527262.0 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.245 CNC1=C(C=CC=C1C)C CNP0282095.0 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.245 COC1=C(C=CC=C1C)C CNP0308029.0 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.245 COC1=C(NC=CC1=O)C CNP0226695.0 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.245 COC1=C(OC=CC1=O)C CNP0167853.0 [0,1,0,0,0,0|3,0,0]=4 152 B8R0.3 C=CCC(C)C(=O)CC CNP0611593.0 [0,0,1,0,0,0|2,0,1]=4 153 B10R2.7 C1=CC2=C(C=N1)CCC2 CNP0185623.0 [0,0,0,1,0,0|3,0,0]=4 154 B10R2.7 C1=CC2=NC=CC=C2C1 CNP0512703.0 [0,0,0,1,0,0|1,0,2]=4 155 B10R2.7 C1=CC2=NC=CN=C2C1 CNP0002558.0 [0,0,0,1,0,0|0,0,2]=3 156 B10R2.7 C1=CC=C2CCCC2=C1 CNP0252618.0 [0,0,0,1,0,0|2,0,0]=3 157 B10R2.7 C1=CC=C2COCC2=C1 CNP0243831.0 [0,0,0,1,0,0|3,0,0]=4 158 B10R2.7 C1=CC=C2NCCC2=C1 CNP0077169.0 [0,0,0,1,0,0|3,0,0]=4 159 B10R2.7 C1=CC=C2OCCC2=C1 CNP0256577.0 [0,0,0,1,0,0|3,0,0]=4 160 B10R2.7 C1=CCC2=C(C1)CCC2 CNP0572732.0 [0,0,0,1,0,0|2,0,0]=3 161 B10R2.7 C1=CN=C2CCCC2=C1 CNP0189817.0 [0,0,0,1,0,0|1,0,0]=2 162 B10R2.7 C1=CN=C2NC=NC2=N1 CNP0404111.0 [0,0,0,1,0,0|2,0,1]=4 163 B10R2.7 C1=CN=C2NN=CC2=N1 CNP0367897.0 [0,0,0,1,0,0|2,0,1]=4 164 B10R2.320 C[C@@H]1CC2=CC=CC=C12 CNP0061060.1 [0,0,0,1,0,0|2,0,0]=3 165 B10R2.320 C[C@H]1CC2=CC=CC=C12 CNP0061060.2 [0,0,0,1,0,0|2,0,0]=3 166 B10R2.320 Cl[C@@H]1CC2=CC=CC=C12 CNP0059667.1 [0,0,0,1,0,0|3,0,0]=4 167 B10R2.320 Cl[C@H]1CC2=CC=CC=C12 CNP0059667.2 [0,0,0,1,0,0|3,0,0]=4 168 B10R2.320 N[C@@H]1CC2=CC=CC=C12 CNP0460995.2 [0,0,0,1,0,0|3,0,0]=4 169 B10R2.320 N[C@H]1CC2=CC=CC=C12 CNP0460995.1 [0,0,0,1,0,0|3,0,0]=4 170 B10R2.320 O[C@@H]1CC2=CC=CC=C12 CNP0043883.1 [0,0,0,1,0,0|3,0,0]=4 171 B10R2.320 O[C@H]1CC2=CC=CC=C12 CNP0043883.2 [0,0,0,1,0,0|3,0,0]=4 172 B8R1.11 C=CC1=C(N=CS1)C CNP0003337.0 [0,0,0,0,1,0|1,0,2]=4 173 B8R1.11 CC1=C(OC=N1)C#N CNP0043637.0 [0,0,0,0,1,0|2,0,1]=4 174 B8R1.11 CC1=C(SC=C1)C=O CNP0610341.0 [0,0,0,0,1,0|2,0,1]=4 175 B8R1.11 CCC1=C(CCC1)C CNP0488475.0 [0,0,0,0,1,0|1,0,2]=4 176 B8R1.11 CCC1=C(N=CO1)C CNP0117733.0 [0,0,0,0,1,0|1,0,0]=2 177 B8R1.11 CCC1=C(SC=N1)C CNP0079920.0 [0,0,0,0,1,0|1,0,0]=2 178 B8R1.11 CCC1=CCCC1=O CNP0033334.0 [0,0,0,0,1,0|2,0,1]=4 179 B8R1.11 CC[C@@H]1CC=CC1=O CNP0060906.1 [0,0,0,0,1,0|2,0,1]=4 180 B8R1.11 CC[C@H]1CC=CC1=O CNP0060906.2 [0,0,0,0,1,0|2,0,1]=4 181 B8R1.11 CSC1=C(OC=C1)C CNP0148789.0 [0,0,0,0,1,0|2,0,0]=3 182 B8R1.11 NCC1=CON=C1O CNP0204327.0 [0,0,0,0,1,0|3,0,0]=4 183 B7R0.1 C=CC=CC=CCC CNP0261432.0 [1,0,1,0,0,0|1,0,1]=4 184 B7R0.1 CC=CC=CC=CC CNP0185443.0 [1,0,1,0,0,0|1,0,1]=4 185 B7R0.1 CC=CC=CCCC CNP0275494.0 [1,0,1,0,0,0|1,0,1]=4 186 B7R0.1 CCC=CC=CC=O CNP0276667.0 [1,0,1,0,0,0|2,0,0]=4 187 B7R0.1 CCC=CC=CCC CNP0546897.0 [1,0,1,0,0,0|1,0,1]=4 188 B7R0.3 CC[C@@H](C)/N=C/C=S CNP0247636.1 [1,0,1,0,0,0|1,0,1]=4 189 B7R0.7 C=CCC(=CCC)C CNP0076324.0 [1,0,1,0,0,0|1,0,0]=3 190 B7R0.7 CC=CC(=CC=O)C CNP0360026.0 [1,0,1,0,0,0|1,0,1]=4 191 B7R0.10 CC(=NO)C(=NO)C CNP0126463.0 [1,0,1,0,0,0|2,0,0]=4 192 B7R0.10 CC=C(C)C(=O)CC CNP0305910.0 [1,0,1,0,0,0|1,0,1]=4 193 B7R0.10 CCC(=O)C(=CN)C CNP0051930.0 [1,0,1,0,0,0|2,0,0]=4 194 B7R0.12 C=NC(=COC)CC CNP0213287.0 [1,0,1,0,0,0|1,0,1]=4 195 B7R1.3 CC1=CC=CC=C1 CNP0156985.0 [2,0,0,0,0,0|2,0,0]=4 196 B7R1.3 CC1=CC=CC=N1 CNP0137947.0 [2,0,0,0,0,0|1,0,0]=3 197 B7R1.3 CC1=CC=CN=C1 CNP0206932.0 [2,0,0,0,0,0|1,0,0]=3 198 B7R1.3 CC1=CC=NC=N1 CNP0609107.0 [2,0,0,0,0,0|2,0,0]=4 199 B7R1.3 CC1=CCC=CC1 CNP0481094.0 [2,0,0,0,0,0|2,0,0]=4 200 B7R1.3 CC1=CN=CC=N1 CNP0285763.0 [2,0,0,0,0,0|0,0,0]=2 201 B7R1.3 NC1=CC=CC=N1 CNP0140161.0 [2,0,0,0,0,0|2,0,0]=4 202 B7R1.3 NC1=CC=CN=C1 CNP0113226.0 [2,0,0,0,0,0|2,0,0]=4 203 B7R1.3 O=C1C=NC=CN1 CNP0318297.0 [2,0,0,0,0,0|1,0,1]=4 204 B7R1.3 OC1=CC=CC=N1 CNP0105400.0 [2,0,0,0,0,0|2,0,0]=4 205 B7R1.3 OC1=CC=CN=C1 CNP0191812.0 [2,0,0,0,0,0|2,0,0]=4 206 B7R1.3 SC1=CC=CC=N1 CNP0567350.0 [2,0,0,0,0,0|2,0,0]=4 207 B9R0.43 CC=C(C=CC(=O)N)CC CNP0192720.0 [0,1,1,0,0,0|1,0,1]=4 208 B9R1.1 C=CC1=CN=C(C=N1)C CNP0137155.0 [1,1,0,0,0,0|0,0,2]=4 209 B9R1.1 CC1=CN=C(C=N1)CO CNP0207768.0 [1,1,0,0,0,0|1,0,0]=3 210 B9R1.1 CCC1=CC=C(C=C1)Br CNP0211844.0 [1,1,0,0,0,0|2,0,0]=4 211 B9R1.1 CCC1=CC=C(C=C1)C CNP0119285.0 [1,1,0,0,0,0|2,0,0]=4 212 B9R1.1 CCC1=CC=C(C=C1)N CNP0166611.0 [1,1,0,0,0,0|2,0,0]=4 213 B9R1.1 CCC1=CC=C(C=C1)O CNP0299375.0 [1,1,0,0,0,0|2,0,0]=4 214 B9R1.1 CCC1=CC=C(C=N1)C CNP0185750.0 [1,1,0,0,0,0|1,0,0]=3 215 B9R1.1 CCC1=CC=C(N=C1)C CNP0341471.0 [1,1,0,0,0,0|1,0,0]=3 216 B9R1.1 CCC1=CN=C(C=N1)C CNP0183380.0 [1,1,0,0,0,0|0,0,0]=2 217 B9R1.1 COC1=CN=C(C=N1)C CNP0002521.0 [1,1,0,0,0,0|1,0,0]=3 218 B9R1.1 CSC1=CN=C(C=N1)C CNP0168152.0 [1,1,0,0,0,0|1,0,0]=3 219 B9R1.1 OCC1=CC=C(C=N1)O CNP0288074.0 [1,1,0,0,0,0|2,0,0]=4 220 B9R1.2 C=CC1=CN=CC(=N1)C CNP0169633.0 [1,1,0,0,0,0|0,0,2]=4 221 B9R1.2 CCC1=CC(=CC=N1)C CNP0220065.0 [1,1,0,0,0,0|1,0,0]=3 222 B9R1.2 CCC1=CC=CC(=C1)C CNP0313685.0 [1,1,0,0,0,0|2,0,0]=4 223 B9R1.2 CCC1=CC=CC(=C1)O CNP0135916.0 [1,1,0,0,0,0|2,0,0]=4 224 B9R1.2 CCC1=CC=CC(=N1)C CNP0315271.0 [1,1,0,0,0,0|1,0,0]=3 225 B9R1.2 CCC1=CC=C[N+](=C1)[O-] CNP0497622.0 [1,1,0,0,0,0|1,0,1]=4 226 B9R1.2 CCC1=CN=CC(=C1)C CNP0150046.0 [1,1,0,0,0,0|1,0,0]=3 227 B9R1.2 CCC1=CN=CC(=N1)C CNP0156975.0 [1,1,0,0,0,0|0,0,0]=2 228 B9R1.2 COC1=CN=CC(=N1)C CNP0002520.0 [1,1,0,0,0,0|1,0,0]=3 229 B9R1.2 CSC1=CN=CC(=N1)C CNP0081006.0 [1,1,0,0,0,0|1,0,0]=3 230 B9R1.6 C=C(C)C1=CN=CC=N1 CNP0251085.0 [1,1,0,0,0,0|0,0,1]=3 231 B9R1.6 CC(=O)C1=CC=CC=N1 CNP0224376.0 [1,1,0,0,0,0|1,0,1]=4 232 B9R1.6 CC(=O)C1=CC=CN=C1 CNP0239193.0 [1,1,0,0,0,0|1,0,1]=4 233 B9R1.6 CC(=O)C1=CN=CC=N1 CNP0114026.0 [1,1,0,0,0,0|0,0,1]=3 234 B9R1.6 CC(C)C1=CC=CC=C1 CNP0123409.0 [1,1,0,0,0,0|2,0,0]=4 235 B9R1.6 CC(C)C1=CC=CN=C1 CNP0157310.0 [1,1,0,0,0,0|1,0,0]=3 236 B9R1.6 CC(C)C1=CCC=CC1 CNP0531274.0 [1,1,0,0,0,0|2,0,0]=4 237 B9R1.6 CC(C)C1=CN=CC=N1 CNP0293152.0 [1,1,0,0,0,0|0,0,0]=2 238 B9R1.6 CC(O)C1=CN=CC=N1 CNP0588053.0 [1,1,0,0,0,0|0,0,0]=2 239 B9R1.6 C[C@@H](N)C1=CC=CC=C1 CNP0079805.1 [1,1,0,0,0,0|2,0,0]=4 240 B9R1.6 C[C@@H](O)C1=CC=CC=C1 CNP0207239.2 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.6 C[C@H](N)C1=CC=CC=C1 CNP0079805.2 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.6 C[C@H](O)C1=CC=CC=C1 CNP0207239.1 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.6 NC(=O)C1=CN=CC=N1 CNP0559029.0 [1,1,0,0,0,0|1,0,1]=4 244 B9R1.6 O=C(O)C1=CN=CC=N1 CNP0274739.0 [1,1,0,0,0,0|1,0,1]=4 245 B9R1.8 CC=CC1=CC=CN=C1 CNP0609915.0 [1,1,0,0,0,0|1,0,1]=4 246 B9R1.8 CC=CC1=CN=CC=N1 CNP0232849.0 [1,1,0,0,0,0|0,0,1]=3 247 B9R1.8 CCCC1=CC=CC=C1 CNP0279045.0 [1,1,0,0,0,0|2,0,0]=4 248 B9R1.8 CCCC1=CC=CC=N1 CNP0611670.0 [1,1,0,0,0,0|1,0,0]=3 249 B9R1.8 CCCC1=CC=CN=C1 CNP0003440.0 [1,1,0,0,0,0|1,0,0]=3 250 B9R1.8 CCCC1=CN=CC=N1 CNP0247099.0 [1,1,0,0,0,0|0,0,0]=2 251 B9R1.8 CCNC1=CC=CC=C1 CNP0144333.0 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.8 CCOC1=CC=CC=C1 CNP0163447.0 [1,1,0,0,0,0|2,0,0]=4 253 B9R1.8 CCOC1=CC=CN=C1 CNP0263904.0 [1,1,0,0,0,0|1,0,0]=3 254 B9R1.8 CNCC1=CC=CC=C1 CNP0335341.0 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.8 COCC1=CC=CC=C1 CNP0244920.0 [1,1,0,0,0,0|2,0,0]=4 256 B9R1.8 CSCC1=CC=CC=C1 CNP0188452.0 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.8 CSSC1=CC=CC=N1 CNP0352994.0 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.8 NCCC1=CC=CC=C1 CNP0141127.0 [1,1,0,0,0,0|2,0,0]=4 259 B9R1.8 OCCC1=CC=CC=C1 CNP0402269.0 [1,1,0,0,0,0|2,0,0]=4 260 B9R1.8 SCCC1=CC=CC=C1 CNP0611698.0 [1,1,0,0,0,0|2,0,0]=4 261 B9R1.8 SCCC1=CN=CC=N1 CNP0194292.0 [1,1,0,0,0,0|0,0,0]=2 262 B9R1.3 CC1=CC=CC(=C1C)C CNP0219925.0 [1,1,0,0,0,0|2,0,0]=4 263 B9R1.3 CC1=CC=CC(=C1C)N CNP0330285.0 [1,1,0,0,0,0|2,0,0]=4 264 B9R1.3 CC1=CC=CC(=C1C)O CNP0282533.0 [1,1,0,0,0,0|2,0,0]=4 265 B9R1.3 CC1=CC=NC(=C1C)C CNP0326800.0 [1,1,0,0,0,0|1,0,0]=3 266 B9R1.69 CC1=CC=C(C(=C1)C)C CNP0110255.0 [1,1,0,0,0,0|2,0,0]=4 267 B9R1.69 CC1=CC=C(C(=N1)C)C CNP0390721.0 [1,1,0,0,0,0|1,0,0]=3 268 B9R1.69 CC1=CC=C(C(=N1)C)O CNP0056515.0 [1,1,0,0,0,0|2,0,0]=4 269 B9R1.69 CC1=CC=C(C=C1C)Br CNP0125395.0 [1,1,0,0,0,0|2,0,0]=4 270 B9R1.69 CC1=CC=C(C=C1C)Cl CNP0482651.0 [1,1,0,0,0,0|2,0,0]=4 271 B9R1.69 CC1=CC=C(C=C1C)N CNP0171920.0 [1,1,0,0,0,0|2,0,0]=4 272 B9R1.69 CC1=CC=C(C=C1C)O CNP0160429.0 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.69 CC1=CN=C(C(=C1)C)C CNP0331632.0 [1,1,0,0,0,0|1,0,0]=3 274 B9R1.69 CC1=CN=C(C(=N1)C)C CNP0313440.0 [1,1,0,0,0,0|0,0,0]=2 275 B9R1.69 CC1=CN=C(C(=O)N1)C CNP0598520.0 [1,1,0,0,0,0|1,0,1]=4 276 B9R1.14 CCC1=CSC=C1CC CNP0002506.0 [0,1,0,0,1,0|2,0,0]=4 277 B9R1.22 CCC1=C(N=C(O1)C)C CNP0002748.0 [0,1,0,0,1,0|1,0,0]=3 278 B9R1.22 CCC1=C(N=C(S1)C)C CNP0002546.0 [0,1,0,0,1,0|1,0,0]=3 279 B9R1.22 CCC1=C(OC(=N1)C)C CNP0331848.0 [0,1,0,0,1,0|1,0,0]=3 280 B9R1.22 CCC1=C(SC(=N1)C)C CNP0002547.0 [0,1,0,0,1,0|1,0,0]=3 281 B9R1.22 CSC1=C(OC(=C1)C)C CNP0290241.0 [0,1,0,0,1,0|2,0,0]=4 282 B9R1.24 CCC1=CC=CC1(C)C CNP0109712.0 [0,1,0,0,1,0|1,0,1]=4 283 B9R1.27 CCC1=C(CCC1=O)C CNP0197955.0 [0,1,0,0,1,0|1,0,1]=4 284 B9R1.27 CCC1=C(SC=C1C)C CNP0290870.0 [0,1,0,0,1,0|1,0,0]=3 285 B9R1.33 CC1=C(N=CO1)CCO CNP0137493.0 [0,1,0,0,1,0|1,0,0]=3 286 B9R1.33 CC1=C(SC=N1)CCCl CNP0572414.0 [0,1,0,0,1,0|1,0,0]=3 287 B9R1.33 CC1=C(SC=N1)CCO CNP0408975.0 [0,1,0,0,1,0|1,0,0]=3 288 B9R1.33 CSSC1=C(OC=C1)C CNP0370281.0 [0,1,0,0,1,0|2,0,0]=4 289 B9R1.41 CC(=O)C1=C(C=CO1)C CNP0146307.0 [0,1,0,0,1,0|1,0,1]=4 290 B9R1.41 CC(=O)C1=C(C=CS1)C CNP0290372.0 [0,1,0,0,1,0|1,0,1]=4 291 B9R1.132 CCC1=C(C(=CS1)C)C CNP0171065.0 [0,1,0,0,1,0|1,0,0]=3 292 B9R1.132 CCC1=CSC(=C1C)C CNP0103141.0 [0,1,0,0,1,0|2,0,0]=4 293 B11R1.8 CCC1=NC(=NC(=C1C)Cl)N CNP0041941.0 [0,2,0,0,0,0|2,0,0]=4 294 B11R1.13 CCCC1=CC=CC(=C1C)C CNP0310285.0 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.13 CCOC1=CC=CC(=C1C)C CNP0186598.0 [0,2,0,0,0,0|2,0,0]=4 296 B11R1.13 CCOC1=CC=CC(=C1C)O CNP0350443.0 [0,2,0,0,0,0|2,0,0]=4 297 B11R1.72 CCC1=C(C(=O)C=CC1=O)C CNP0115905.0 [0,2,0,0,0,0|2,0,0]=4 298 B11R1.72 CCC1=C(C=CC(=C1C)O)O CNP0216521.0 [0,2,0,0,0,0|2,0,0]=4 299 B11R1.159 CC1=C(C=CC=C1C(C)C)O CNP0487698.0 [0,2,0,0,0,0|2,0,0]=4 300 B11R1.17 CCCCC1=NC=CN=C1C CNP0504443.0 [0,2,0,0,0,0|0,0,0]=2 301 B11R1.41 CCOC1=CC=CC=C1OC CNP0003445.0 [0,2,0,0,0,0|2,0,0]=4 302 B11R1.41 COC1=CC=CC=C1CCO CNP0135812.0 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.81 C=CCC1=NC=C(N=C1C)C CNP0134147.0 [0,2,0,0,0,0|0,0,1]=3 304 B11R1.81 CC=CC1=NC=C(N=C1C)C CNP0185639.0 [0,2,0,0,0,0|0,0,1]=3 305 B11R1.81 CCCC1=CC=C(C=C1C)C CNP0112480.0 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.81 CCCC1=NC=C(N=C1C)C CNP0325666.0 [0,2,0,0,0,0|0,0,0]=2 307 B11R1.86 CC1=NC=CN=C1CC(C)C CNP0076943.0 [0,2,0,0,0,0|0,0,0]=2 308 B11R1.182 C=CCC1=NC(=CN=C1C)C CNP0014529.0 [0,2,0,0,0,0|0,0,1]=3 309 B11R1.182 CC=CC1=NC(=CN=C1C)C CNP0002579.0 [0,2,0,0,0,0|0,0,1]=3 310 B11R1.182 CCCC1=CC(=CC=C1C)C CNP0284162.0 [0,2,0,0,0,0|2,0,0]=4 311 B11R1.182 CCCC1=NC(=CN=C1C)C CNP0203627.0 [0,2,0,0,0,0|0,0,0]=2 312 B11R1.182 CCOC1=CC(=CC=C1C)C CNP0288250.0 [0,2,0,0,0,0|2,0,0]=4 313 B11R1.222 CCC(C)C1=NN=CC=C1C CNP0391366.0 [0,2,0,0,0,0|2,0,0]=4 314 B11R1.222 COC(=O)C1=CC=CN=C1C CNP0485999.0 [0,2,0,0,0,0|1,0,1]=4 315 B11R1.605 CCCC1=C(C=CC=C1C)C CNP0181300.0 [0,2,0,0,0,0|2,0,0]=4 316 B11R1.605 CCCC1=C(C=CC=C1O)C CNP0602938.0 [0,2,0,0,0,0|2,0,0]=4 317 B11R1.605 CCOC1=C(C=CC=C1C)C CNP0305995.0 [0,2,0,0,0,0|2,0,0]=4 318 B11R1.37 C=CC1=NC=C(N=C1CC)C CNP0003041.0 [0,2,0,0,0,0|0,0,1]=3 319 B11R1.37 CCC1=CC=C(C=C1CC)C CNP0183897.0 [0,2,0,0,0,0|2,0,0]=4 320 B11R1.37 CCC1=CC=C(C=C1CC)O CNP0155765.0 [0,2,0,0,0,0|2,0,0]=4 321 B11R1.37 CCC1=CC=C(C=C1CO)C CNP0299444.0 [0,2,0,0,0,0|2,0,0]=4 322 B11R1.37 CCC1=NC=C(N=C1CC)C CNP0079896.0 [0,2,0,0,0,0|0,0,0]=2 323 B11R1.53 CC(O)C1=CC=CC=C1CO CNP0540507.0 [0,2,0,0,0,0|2,0,0]=4 324 B11R1.53 CCC1=NC=CC=C1C(=O)N CNP0233596.0 [0,2,0,0,0,0|1,0,1]=4 325 B11R1.53 CCC1=NC=CN=C1C(=O)C CNP0402270.0 [0,2,0,0,0,0|0,0,0]=2 326 B11R1.53 COC1=CC=CC=C1C(C)C CNP0578061.0 [0,2,0,0,0,0|2,0,0]=4 327 B11R1.53 COC1=NC=CN=C1C(C)C CNP0108389.0 [0,2,0,0,0,0|0,0,0]=2 328 B11R1.53 CSC1=NC=CN=C1C(C)C CNP0083248.0 [0,2,0,0,0,0|0,0,0]=2 329 B11R1.166 CC(=O)C1=NC=C(N=C1C)C CNP0361229.0 [0,2,0,0,0,0|0,0,1]=3 330 B11R1.166 CC1=CC(=CC=C1C(C)C)O CNP0343687.0 [0,2,0,0,0,0|2,0,0]=4 331 B11R1.166 CC1=CC=C(C(=C1)C)C(C)C CNP0278893.0 [0,2,0,0,0,0|2,0,0]=4 332 B11R1.277 CC1=NC(=C(N=C1C)CO)C CNP0075676.0 [0,2,0,0,0,0|1,0,0]=3 333 B11R1.277 CCC1=CC(=C(C=C1C)C)C CNP0561211.0 [0,2,0,0,0,0|2,0,0]=4 334 B11R1.277 CCC1=NC(=C(N=C1C)C)C CNP0342125.0 [0,2,0,0,0,0|0,0,0]=2 335 B11R1.279 CCC1=CC=C(C(=C1)C)CC CNP0174684.0 [0,2,0,0,0,0|2,0,0]=4 336 B11R1.279 CCC1=CN=C(C(=N1)C)CC CNP0165721.0 [0,2,0,0,0,0|0,0,0]=2 337 B11R1.464 CCC1=C(C=C(C=C1C)C)C CNP0246344.0 [0,2,0,0,0,0|2,0,0]=4 338 B11R1.464 CCC1=C(C=C(C=C1C)O)C CNP0365832.0 [0,2,0,0,0,0|2,0,0]=4 339 B11R1.464 CCC1=C(C=C(C=C1Cl)C)C CNP0233565.0 [0,2,0,0,0,0|2,0,0]=4 340 B11R1.464 CCC1=C(C=C(N=C1Cl)C)Cl CNP0188033.0 [0,2,0,0,0,0|2,0,0]=4 341 B11R1.464 CCC1=C(N=C(N=C1Cl)N)C CNP0150883.0 [0,2,0,0,0,0|2,0,0]=4 342 B11R1.464 CCN1C(=NC(=CC1=O)C)C CNP0482502.0 [0,2,0,0,0,0|2,0,0]=4 343 B11R1.167 CC(=O)C1=NC(=CN=C1C)C CNP0205737.0 [0,2,0,0,0,0|0,0,1]=3 344 B11R1.167 CC1=CC=C(C(=C1)C(C)C)C CNP0319974.0 [0,2,0,0,0,0|2,0,0]=4 345 B11R1.280 CCC1=CC=C(C(=C1)CC)C CNP0134602.0 [0,2,0,0,0,0|2,0,0]=4 346 B11R1.280 CCC1=CN=C(C(=N1)CC)C CNP0421668.0 [0,2,0,0,0,0|0,0,0]=2 347 B11R1.87 CC(C)(C)C1=NC=CC=C1O CNP0517568.0 [0,2,0,0,0,0|2,0,0]=4 348 B9R1.11 CCC(=O)C1=NC=CS1 CNP0135536.0 [0,0,1,1,0,0|2,0,0]=4 349 B9R2.50 C1=CC=C2CCC2=C1 CNP0344536.0 [1,0,0,1,0,0|2,0,0]=4 350 B9R2.50 C1=CCC2=C(C1)CC2 CNP0258047.0 [1,0,0,1,0,0|2,0,0]=4 351 B11R2.106 CC1=CC=CC2=C1CCC2 CNP0306723.0 [0,1,0,1,0,0|2,0,0]=4 352 B11R2.106 NC1=NC=NC2=C1CCC2 CNP0358774.0 [0,1,0,1,0,0|2,0,0]=4 353 B11R2.106 OC1=CC=CC2=C1CCC2 CNP0204315.0 [0,1,0,1,0,0|2,0,0]=4 354 B11R2.10 CC1=NC2=NC=CN=C2O1 CNP0001199.0 [0,1,0,1,0,0|1,0,1]=4 355 B11R2.10 C[C@@H]1CC2=CC=CC=C2N1 CNP0247446.2 [0,1,0,1,0,0|2,0,0]=4 356 B11R2.10 C[C@H]1CC2=CC=CC=C2N1 CNP0247446.1 [0,1,0,1,0,0|2,0,0]=4 357 B11R2.20 C1=CC=C2CCCCC2=C1 CNP0326274.0 [0,1,0,1,0,0|2,0,0]=4 358 B11R2.20 C1=CC=C2CNCCC2=C1 CNP0371971.0 [0,1,0,1,0,0|2,0,0]=4 359 B11R2.20 C1=CC=C2NCCCC2=C1 CNP0160283.0 [0,1,0,1,0,0|2,0,0]=4 360 B11R2.20 C1=CCC2=C(C1)CCCC2 CNP0252547.0 [0,1,0,1,0,0|2,0,0]=4 361 B11R2.20 C1=CN=C2CCCCC2=C1 CNP0031411.0 [0,1,0,1,0,0|1,0,0]=3 362 B11R2.20 C1=CN=C2CCCCC2=N1 CNP0281907.0 [0,1,0,1,0,0|0,0,0]=2 363 B11R2.55 CC1=CC=CC=C1C2CO2 CNP0595816.0 [0,1,0,1,0,0|2,0,0]=4 364 B11R2.1 CC1=C2N=CC=NC2=NO1 CNP0000955.0 [0,1,0,1,0,0|1,0,1]=4 365 B11R2.1 CC1=NOC2=NC=CN=C12 CNP0004082.0 [0,1,0,1,0,0|1,0,1]=4 366 B11R2.1 CC1C=CC2=NC=CN=C12 CNP0348713.0 [0,1,0,1,0,0|0,0,1]=3 367 B11R2.1 C[C@@H]1CCC2=NC=CN=C12 CNP0291703.1 [0,1,0,1,0,0|0,0,0]=2 368 B11R2.1 C[C@H]1CCC2=CC=CC=C12 CNP0102551.1 [0,1,0,1,0,0|2,0,0]=4 369 B11R2.36 CC1=CC=C2CCCC2=C1 CNP0170611.0 [0,1,0,1,0,0|2,0,0]=4 370 B11R2.36 CC1=CC=C2CCCC2=N1 CNP0269261.0 [0,1,0,1,0,0|1,0,0]=3 371 B11R2.36 CC1=CN=C2CCCC2=N1 CNP0296530.0 [0,1,0,1,0,0|0,0,0]=2 372 B11R2.36 O=C1C=C2CCCC2=NN1 CNP0571558.0 [0,1,0,1,0,0|2,0,0]=4 373 B11R2.36 OC1=CC=C2CCCC2=C1 CNP0188722.0 [0,1,0,1,0,0|2,0,0]=4 374 B11R2.610 CC1=CC(=C2CCC2=C1)C CNP0050950.0 [0,1,0,1,0,0|2,0,0]=4 375 B11R2.59 CC1(CC2=CC=CC=C12)C CNP0056719.0 [0,1,0,1,0,0|2,0,0]=4 376 B11R2.59 C[C@@]1(CC2=CC=CC=C12)O CNP0029617.2 [0,1,0,1,0,0|2,0,0]=4 377 B11R2.59 C[C@]1(CC2=CC=CC=C12)O CNP0029617.1 [0,1,0,1,0,0|2,0,0]=4 378 B7R1.1 CCC1=CC=CO1 CNP0402547.0 [1,0,0,0,1,0|1,0,0]=3 379 B7R1.1 CCC1=CC=CS1 CNP0405107.0 [1,0,0,0,1,0|1,0,0]=3 380 B7R1.1 CCC1=COC=C1 CNP0136418.0 [1,0,0,0,1,0|1,0,0]=3 381 B7R1.1 CCC1=CSC=C1 CNP0267198.0 [1,0,0,0,1,0|1,0,0]=3 382 B7R1.1 CCC1=NC=CS1 CNP0206637.0 [1,0,0,0,1,0|1,0,0]=3 383 B7R1.1 CCN1C=CC=C1 CNP0076212.0 [1,0,0,0,1,0|2,0,0]=4 384 B7R1.1 CCN1C=NN=C1 CNP0611862.0 [1,0,0,0,1,0|2,0,0]=4 385 B7R1.1 COC1=CC=CN1 CNP0098587.0 [1,0,0,0,1,0|1,0,1]=4 386 B7R1.1 COC1=COC=C1 CNP0503708.0 [1,0,0,0,1,0|2,0,0]=4 387 B7R1.1 COC1=NC=CC1 CNP0549754.0 [1,0,0,0,1,0|1,0,1]=4 388 B7R1.1 CSC1=CSC=C1 CNP0003154.0 [1,0,0,0,1,0|2,0,0]=4 389 B7R1.1 OCC1=CC=CO1 CNP0152361.0 [1,0,0,0,1,0|2,0,0]=4 390 B7R1.1 OCC1=CC=CS1 CNP0037393.0 [1,0,0,0,1,0|2,0,0]=4 391 B7R1.1 OCC1=COC=C1 CNP0248845.0 [1,0,0,0,1,0|2,0,0]=4 392 B7R1.1 OCC1=CSC=C1 CNP0002403.0 [1,0,0,0,1,0|2,0,0]=4 393 B7R1.1 SCC1=CC=CO1 CNP0246335.0 [1,0,0,0,1,0|2,0,0]=4 394 B7R1.1 SCC1=CC=CS1 CNP0040483.0 [1,0,0,0,1,0|2,0,0]=4 395 B7R1.4 CC1=C(C=CO1)S CNP0164644.0 [1,0,0,0,1,0|2,0,0]=4 396 B7R1.4 CC1=C(C=CS1)S CNP0337340.0 [1,0,0,0,1,0|2,0,0]=4 397 B7R1.4 CC1=C(OC=C1)C CNP0003373.0 [1,0,0,0,1,0|1,0,0]=3 398 B7R1.4 CC1=C(OC=N1)C CNP0381146.0 [1,0,0,0,1,0|1,0,0]=3 399 B7R1.4 CC1=C(SC=C1)C CNP0003149.0 [1,0,0,0,1,0|1,0,0]=3 400 B7R1.4 CC1=C(SC=N1)C CNP0003150.0 [1,0,0,0,1,0|1,0,0]=3 401 B7R1.4 CC1=CSC=C1C CNP0084292.0 [1,0,0,0,1,0|2,0,0]=4 402 B7R1.4 CC1=NC=CN1C CNP0511652.0 [1,0,0,0,1,0|1,0,0]=3 403 B7R1.4 CN1C=CN=C1N CNP0308541.0 [1,0,0,0,1,0|2,0,0]=4 404 B7R1.4 CN1C=CN=C1S CNP0605467.0 [1,0,0,0,1,0|2,0,0]=4