0 B11R1.21 C=C(C)C1=CC=C(C(=C1)O)C CNP0410462.0 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.21 CC(=O)C1=CC=C(C(=C1)C)C CNP0091143.0 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.21 CC(=O)C1=CC=C(C(=C1)C)O CNP0484144.0 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.21 CC(=O)C1=CC=C(C(=C1)O)C CNP0155281.0 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.21 CC(=O)C1=CC=C(C(=C1)O)O CNP0310121.0 [0,0,0,0,0,0|1,0,0]=1 5 B11R1.21 CC(=O)C1=CC=C(C(=O)O1)C CNP0144436.0 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.21 CC1=CC(=CC=C1Cl)[N+](=O)[O-] CNP0588810.0 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.21 CC1=CC(=CC=C1N)[N+](=O)[O-] CNP0580915.0 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.21 CC1=CC(=CC=C1O)C(=O)O CNP0305353.0 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.21 CC1=CC(=CC=C1O)C(C)C CNP0364356.0 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.21 CC1=CC=C(C=C1C)C(=O)N CNP0387935.0 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.21 CC1=CC=C(C=C1C)C(=O)O CNP0109169.0 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.21 CC1=CC=C(C=C1C)C(C)O CNP0612219.0 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.21 CC1=CC=C(C=C1O)C(=O)O CNP0262674.0 [0,0,0,0,0,0|1,0,0]=1 14 B11R1.21 CC1=CC=C(C=C1O)C(C)C CNP0210919.0 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.21 CC1=CN=C(C=[N+]1[O-])C(=O)O CNP0490875.0 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.21 CN1C=C(C=CC1=O)C(=O)N CNP0249493.0 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.21 CN1C=C(C=CC1=O)C(=O)O CNP0136116.0 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.21 NC(=O)C1=CC=C(C(=C1)N)O CNP0336966.0 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.21 NC(=O)C1=CC=C(C(=C1)O)O CNP0582162.0 [0,0,0,0,0,0|1,0,0]=1 20 B11R1.21 NC1=CC(=CC=C1Cl)[N+](=O)[O-] CNP0484931.0 [0,0,0,0,0,0|3,0,1]=4 21 B11R1.21 NC1=CC(=CC=C1O)C(=O)O CNP0343618.0 [0,0,0,0,0,0|1,0,0]=1 22 B11R1.21 NC1=CC=C(C=C1N)C(=O)O CNP0515616.0 [0,0,0,0,0,0|2,0,0]=2 23 B11R1.21 NC1=CC=C(C=C1O)C(=O)O CNP0018090.0 [0,0,0,0,0,0|1,0,0]=1 24 B11R1.21 O=C(O)C1=CC(=O)C(=CO1)O CNP0498099.0 [0,0,0,0,0,0|1,0,1]=2 25 B11R1.21 O=C(O)C1=CC=C(C(=C1)Br)O CNP0414254.0 [0,0,0,0,0,0|1,0,0]=1 26 B11R1.21 O=C(O)C1=CC=C(C(=C1)Cl)O CNP0131355.0 [0,0,0,0,0,0|1,0,0]=1 27 B11R1.21 O=C(O)C1=CC=C(C(=C1)O)O CNP0348948.0 [0,0,0,0,0,0|0,0,0]=0 28 B11R1.21 O=C(O)C1=CC[C@H](C(=C1)O)O CNP0081104.1 [0,0,0,0,0,0|0,0,2]=2 29 B11R1.21 O=C(O)C1=CC[C@H]([C@@H](C1)O)O CNP0081080.1 [0,0,0,0,0,0|0,0,4]=4 30 B11R1.21 O=C(O)C1=COC(=O)C(=C1)Br CNP0460308.0 [0,0,0,0,0,0|2,0,1]=3 31 B11R1.21 O=C(O)C1=C[C@@H]([C@H](CO1)O)O CNP0565442.1 [0,0,0,0,0,0|1,0,3]=4 32 B11R1.21 O=[N+]([O-])C1=CC=C(C(=C1)Cl)O CNP0491874.0 [0,0,0,0,0,0|2,0,1]=3 33 B11R1.21 O=[N+]([O-])C1=CC=C(C(=C1)O)O CNP0593657.0 [0,0,0,0,0,0|1,0,1]=2 34 B10R1.13 C=C(C)C1=CC=C(C=C1)C CNP0302429.0 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.13 CC(=O)C1=CC=C(C=C1)Br CNP0078494.0 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.13 CC(=O)C1=CC=C(C=C1)C CNP0415909.0 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.13 CC(=O)C1=CC=C(C=C1)I CNP0361256.0 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.13 CC(=O)C1=CC=C(C=C1)N CNP0127987.0 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.13 CC(=O)C1=CC=C(C=C1)O CNP0327993.0 [1,0,0,0,0,0|1,0,0]=2 40 B10R1.13 CC(=O)C1=CC=C(C=N1)C CNP0046782.0 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.13 CC(=O)C1=CC=C(N=C1)C CNP0135801.0 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.13 CC(C)C1=CC=C(C=C1)O CNP0127505.0 [1,0,0,0,0,0|2,0,1]=4 43 B10R1.13 CC(N)C1=CC=C(C=C1)O CNP0292009.0 [1,0,0,0,0,0|2,0,1]=4 44 B10R1.13 CC1=CC=C(C=C1)C(=O)Br CNP0248072.0 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl CNP0150539.0 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.13 CC1=CC=C(C=C1)C(=O)N CNP0158656.0 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.13 CC1=CC=C(C=C1)C(=O)O CNP0232170.0 [1,0,0,0,0,0|1,0,0]=2 48 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O CNP0154242.1 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O CNP0154242.2 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)O CNP0112149.2 [1,0,0,0,0,0|1,0,1]=3 51 B10R1.13 C[C@H](O)C1=CC=C(C=C1)O CNP0112149.1 [1,0,0,0,0,0|1,0,1]=3 52 B10R1.13 N=C(N)C1=CC=C(C=C1)N CNP0095026.0 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.13 N=C1C=CC(=CN1)C(=O)N CNP0537992.0 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.13 NC(=O)C1=CC=C(C=C1)O CNP0330477.0 [1,0,0,0,0,0|1,0,0]=2 55 B10R1.13 NC(=O)C1=CC=C(N=C1)Cl CNP0263777.0 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.13 NC(=O)C1=CC=C(N=C1)N CNP0343331.0 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.13 NC1=CC=C(C=C1)C(=O)O CNP0152805.0 [1,0,0,0,0,0|1,0,0]=2 58 B10R1.13 NC1=CC=C(C=C1)C(=O)[O-] CNP0528356.0 [1,0,0,0,0,0|1,0,1]=3 59 B10R1.13 NC1=CC=C(C=C1)C(=O)[O-] CNP0585530.0 [1,0,0,0,0,0|1,0,1]=3 60 B10R1.13 NC1=CC=C(C=C1)[N+](=O)[O-] CNP0491985.0 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl CNP0147578.0 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.13 O=C(O)C1=CC=C(C=C1)O CNP0253685.0 [1,0,0,0,0,0|0,0,0]=1 63 B10R1.13 O=C(O)C1=CC=C(C=C1)[Hg] CNP0481307.0 [1,0,0,0,0,0|1,0,0]=2 64 B10R1.13 O=C(O)C1=CC=C(C=C1)[O-] CNP0538591.0 [1,0,0,0,0,0|0,0,1]=2 65 B10R1.13 O=C(O)C1=CC=C(C=N1)O CNP0261665.0 [1,0,0,0,0,0|1,0,0]=2 66 B10R1.13 O=C(O)C1=CC=C(N=C1)O CNP0320055.0 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.13 O=C(O)C1=CNC(=O)C=C1 CNP0533542.0 [1,0,0,0,0,0|1,0,1]=3 68 B10R1.13 O=C(O)C1=COC(=O)C=C1 CNP0363999.0 [1,0,0,0,0,0|1,0,1]=3 69 B10R1.13 O=C(S)C1=CC=C(C=C1)Br CNP0564653.0 [1,0,0,0,0,0|1,1,0]=3 70 B10R1.13 O=C([O-])C1=CC=C(C=C1)O CNP0600449.0 [1,0,0,0,0,0|0,0,1]=2 71 B10R1.13 O=C1CC=C(C=N1)C(=O)O CNP0253562.0 [1,0,0,0,0,0|1,0,2]=4 72 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O CNP0593615.0 [1,0,0,0,0,0|1,0,1]=3 73 B10R1.113 C=C(C)C1=CC=CC(=C1)C CNP0131383.0 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.113 CC(=O)C1=CC(=CC=N1)C CNP0106773.0 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.113 CC(=O)C1=CC=CC(=C1)C CNP0320614.0 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.113 CC(=O)C1=CC=CC(=C1)O CNP0108325.0 [1,0,0,0,0,0|1,0,0]=2 77 B10R1.113 CC(=O)C1=CC=CC(=N1)C CNP0235380.0 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.113 CC(=O)C1=CC=NC(=C1)C CNP0130309.0 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.113 CC(C)C1=CC=CC(=C1)O CNP0246144.0 [1,0,0,0,0,0|2,0,1]=4 80 B10R1.113 CC(O)C1=CC=CC(=C1)O CNP0171685.0 [1,0,0,0,0,0|1,0,1]=3 81 B10R1.113 CC1=CC(=CC=N1)C(=O)O CNP0260041.0 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.113 CC1=CC=CC(=C1)C(=O)Cl CNP0329068.0 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.113 CC1=CC=CC(=C1)C(=O)N CNP0150793.0 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.113 CC1=CC=CC(=C1)C(=O)O CNP0318414.0 [1,0,0,0,0,0|1,0,0]=2 85 B10R1.113 CC1=CC=CC(=C1)I(O)O CNP0604420.0 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.113 CC1=CN=CC(=C1)C(=O)O CNP0520053.0 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.113 CN1C=CC=C(C1)C(=O)O CNP0512399.0 [1,0,0,0,0,0|2,0,1]=4 88 B10R1.113 CN1[CH]C=CC(=C1)C(=O)O CNP0480153.0 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.113 C[C@H](O)C1=CC=CC(=C1)O CNP0171685.1 [1,0,0,0,0,0|1,0,1]=3 90 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)N CNP0212015.0 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)N CNP0497456.0 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)O CNP0524507.0 [1,0,0,0,0,0|2,0,0]=3 93 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)O CNP0588667.0 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)[O-] CNP0337775.0 [1,0,0,0,0,0|2,0,1]=4 95 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)[O-] CNP0563691.0 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.113 NC(=O)C1=CC=CC(=C1)Br CNP0018100.0 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.113 NC(=O)C1=CC=CC(=C1)Cl CNP0036584.0 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.113 NC(=O)C1=CC=CC(=C1)N CNP0576660.0 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.113 NC(=O)C1=CC=CC(=C1)O CNP0113657.0 [1,0,0,0,0,0|1,0,0]=2 100 B10R1.113 NC(=O)C1=CC=C[N+](=C1)[O-] CNP0508767.0 [1,0,0,0,0,0|2,0,1]=4 101 B10R1.113 NC(=O)C1=CN=CC(=C1)Br CNP0596398.0 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.113 NC1=CC=CC(=C1)B(O)O CNP0479159.0 [1,0,0,0,0,0|2,0,1]=4 103 B10R1.113 NC1=CC=CC(=C1)C(=O)O CNP0081123.0 [1,0,0,0,0,0|1,0,0]=2 104 B10R1.113 NC1=CC=CC(=C1)[N+](=O)[O-] CNP0574552.0 [1,0,0,0,0,0|2,0,1]=4 105 B10R1.113 NC1=NC=CC(=N1)C(=O)O CNP0302261.0 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.113 N[C@@H]1C=CC=C(C1)C(=O)O CNP0312678.1 [1,0,0,0,0,0|1,0,2]=4 107 B10R1.113 N[C@H]1C=CC=C(C1)C(=O)O CNP0312678.2 [1,0,0,0,0,0|1,0,2]=4 108 B10R1.113 O=C(Cl)C1=CC=CC(=C1)Br CNP0018295.0 [1,0,0,0,0,0|2,0,0]=3 109 B10R1.113 O=C(O)C1=CC=CC(=C1)Br CNP0356258.0 [1,0,0,0,0,0|1,0,0]=2 110 B10R1.113 O=C(O)C1=CC=CC(=C1)Cl CNP0206363.0 [1,0,0,0,0,0|1,0,0]=2 111 B10R1.113 O=C(O)C1=CC=CC(=C1)O CNP0217243.0 [1,0,0,0,0,0|0,0,0]=1 112 B10R1.113 O=C(O)C1=CC=CC(C1)[Si] CNP0180659.0 [1,0,0,0,0,0|1,0,2]=4 113 B10R1.113 O=C(O)C1=CC=C[N+](=C1)[O-] CNP0486873.0 [1,0,0,0,0,0|1,0,1]=3 114 B10R1.113 O=C(O)C1=CN=CC(=C1)O CNP0573743.0 [1,0,0,0,0,0|1,0,0]=2 115 B10R1.176 C=CC1=CC=C(C(=C1)C)C CNP0083008.0 [1,0,0,0,0,0|3,0,0]=4 116 B10R1.176 C=CC1=CC=C(C(=C1)O)O CNP0218096.0 [1,0,0,0,0,0|1,0,0]=2 117 B10R1.176 CC1=CC(=CC=C1N)N=O CNP0042604.0 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.176 CC1=CC(=CC=C1O)C=O CNP0018890.0 [1,0,0,0,0,0|1,0,0]=2 119 B10R1.176 CC1=CC(=NO)C=CC1=O CNP0254335.0 [1,0,0,0,0,0|2,0,1]=4 120 B10R1.176 CC1=CC=C(C=C1C)CO CNP0515257.0 [1,0,0,0,0,0|2,0,1]=4 121 B10R1.176 CCC1=CC=C(C(=C1)C)O CNP0271974.0 [1,0,0,0,0,0|2,0,1]=4 122 B10R1.176 CCC1=CC=C(C(=C1)O)C CNP0152157.0 [1,0,0,0,0,0|2,0,1]=4 123 B10R1.176 CCC1=CC=C(C(=C1)O)O CNP0344368.0 [1,0,0,0,0,0|1,0,1]=3 124 B10R1.176 COC1=CC=C(C(=C1)C)O CNP0175131.0 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.176 COC1=CC=C(C(=C1)N)O CNP0323578.0 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.176 COC1=CC=C(C(=C1)O)O CNP0241033.0 [1,0,0,0,0,0|2,0,0]=3 127 B10R1.176 N#CC1=CC=C(C(=C1)O)O CNP0155663.0 [1,0,0,0,0,0|1,0,1]=3 128 B10R1.176 NC1=CC(=CC=C1O)C=O CNP0343365.0 [1,0,0,0,0,0|1,0,0]=2 129 B10R1.176 NCC1=CC=C(C(=C1)O)O CNP0353669.0 [1,0,0,0,0,0|1,0,1]=3 130 B10R1.176 O=C1C=C(OC=C1O)CO CNP0328434.0 [1,0,0,0,0,0|1,0,2]=4 131 B10R1.176 O=CC1=CC=C(C(=C1)Br)O CNP0212461.0 [1,0,0,0,0,0|1,0,0]=2 132 B10R1.176 O=CC1=CC=C(C(=C1)Cl)Cl CNP0066778.0 [1,0,0,0,0,0|2,0,0]=3 133 B10R1.176 O=CC1=CC=C(C(=C1)O)O CNP0203672.0 [1,0,0,0,0,0|0,0,0]=1 134 B10R1.176 OCC1=CC=C(C(=C1)Br)O CNP0161139.0 [1,0,0,0,0,0|1,0,1]=3 135 B10R1.176 OCC1=CC=C(C(=C1)O)O CNP0262481.0 [1,0,0,0,0,0|0,0,1]=2 136 B12R1.23 CC(C)(C)C1=CC=C(C(=C1)O)O CNP0201724.0 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.23 CC1=CC=C(C=C1O)C(C)(C)O CNP0181250.0 [0,1,0,0,0,0|2,0,1]=4 138 B12R1.23 NC1=CC=C(C=C1N)S(=O)(=O)O CNP0444643.0 [0,1,0,0,0,0|3,0,0]=4 139 B12R1.48 CC(=O)C1=CC=C(C(=O)O1)CO CNP0139436.0 [0,1,0,0,0,0|2,0,1]=4 140 B12R1.48 COC1=CC=C(C=C1Br)C(=O)O CNP0097136.0 [0,1,0,0,0,0|1,0,0]=2 141 B12R1.48 COC1=CC=C(C=C1Cl)C(=O)O CNP0343437.0 [0,1,0,0,0,0|1,0,0]=2 142 B12R1.48 COC1=CC=C(C=C1N)C(=O)N CNP0070991.0 [0,1,0,0,0,0|2,0,0]=3 143 B12R1.48 COC1=CC=C(C=C1O)C(=O)C CNP0215048.0 [0,1,0,0,0,0|1,0,0]=2 144 B12R1.48 COC1=CC=C(C=C1O)C(=O)N CNP0428552.0 [0,1,0,0,0,0|1,0,0]=2 145 B12R1.48 COC1=CC=C(C=C1O)C(=O)O CNP0220341.0 [0,1,0,0,0,0|0,0,0]=1 146 B12R1.48 COC1=CC=C(C=C1O)[N+](=O)[O-] CNP0599616.0 [0,1,0,0,0,0|1,0,1]=3 147 B12R1.48 COC1=COC(=CC1=O)C(=O)O CNP0349359.0 [0,1,0,0,0,0|1,0,1]=3 148 B12R1.48 O=C(O)C1=CC=C(C(=C1)O)CO CNP0123838.0 [0,1,0,0,0,0|0,0,0]=1 149 B12R1.56 C=C(C)C1=CC=C(C(=C1)OC)C CNP0254908.0 [0,1,0,0,0,0|3,0,0]=4 150 B12R1.56 C=C(C)C1=CC=C(C(=C1)OC)O CNP0208361.0 [0,1,0,0,0,0|2,0,0]=3 151 B12R1.56 CC(=O)C1=CC=C(C(=C1)C=O)O CNP0387842.0 [0,1,0,0,0,0|1,0,1]=3 152 B12R1.56 CC1=CC=C(C=C1CO)[N+](=O)[O-] CNP0531354.0 [0,1,0,0,0,0|2,0,1]=4 153 B12R1.56 CCC1=CC(=CC=C1O)C(=O)O CNP0121187.0 [0,1,0,0,0,0|1,0,0]=2 154 B12R1.56 COC1=CC(=CC=C1C)C(=O)C CNP0017950.0 [0,1,0,0,0,0|2,0,0]=3 155 B12R1.56 COC1=CC(=CC=C1C)C(=O)O CNP0497367.0 [0,1,0,0,0,0|1,0,0]=2 156 B12R1.56 COC1=CC(=CC=C1N)C(=O)O CNP0018066.0 [0,1,0,0,0,0|1,0,0]=2 157 B12R1.56 COC1=CC(=CC=C1O)C(=O)C CNP0219031.0 [0,1,0,0,0,0|1,0,0]=2 158 B12R1.56 COC1=CC(=CC=C1O)C(=O)N CNP0200127.0 [0,1,0,0,0,0|1,0,0]=2 159 B12R1.56 COC1=CC(=CC=C1O)C(=O)O CNP0122021.0 [0,1,0,0,0,0|0,0,0]=1 160 B12R1.56 COC1=CC(=CC=C1O)C(=O)[O-] CNP0564199.0 [0,1,0,0,0,0|0,0,1]=2 161 B12R1.56 COC1=CC(=CC=C1O)C(C)O CNP0582143.0 [0,1,0,0,0,0|1,0,1]=3 162 B12R1.56 COC1=CC(=CC=C1[O-])C(=O)O CNP0511962.0 [0,1,0,0,0,0|0,0,1]=2 163 B12R1.56 NC(=O)C1=CC=C(C(=C1)N=O)O CNP0314124.0 [0,1,0,0,0,0|1,0,1]=3 164 B12R1.56 O=NC1=CC(=CC=C1O)C(=O)O CNP0511255.0 [0,1,0,0,0,0|0,0,1]=2 165 B12R1.56 O=NC1=CC(=CC=C1[O-])C(=O)[O-] CNP0591454.0 [0,1,0,0,0,0|0,0,3]=4 166 B12R1.56 O=[N+]([O-])C1=CC=C(C(=C1)CO)Cl CNP0495840.0 [0,1,0,0,0,0|2,0,1]=4 167 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)C CNP0579678.0 [0,1,0,0,0,0|3,0,0]=4 168 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)O CNP0136455.0 [0,1,0,0,0,0|2,0,0]=3 169 B12R1.232 CC(=O)C1=CC(=C(C=C1O)O)C CNP0284124.0 [0,1,0,0,0,0|2,0,0]=3 170 B12R1.232 CC(=O)C1=CC(=C(C=C1O)O)O CNP0243066.0 [0,1,0,0,0,0|1,0,0]=2 171 B12R1.232 CC1=CC(=C(C=C1Br)C)C(=O)O CNP0462913.0 [0,1,0,0,0,0|2,0,0]=3 172 B12R1.232 CC1=CC(=C(C=C1C)C(=O)O)C CNP0171746.0 [0,1,0,0,0,0|2,0,0]=3 173 B12R1.232 CC1=CC(=C(C=C1[N+](=O)[O-])O)O CNP0541795.0 [0,1,0,0,0,0|1,0,1]=3 174 B12R1.232 NC1=CC(=C(C=C1C(=O)O)O)O CNP0323910.0 [0,1,0,0,0,0|0,0,0]=1 175 B12R1.232 O=C(O)C1=CC(=C(C=C1O)O)O CNP0129962.0 [0,1,0,0,0,0|0,0,0]=1 176 B12R1.367 CC1=CC=C(C=C1O)[C@@H](C)CO CNP0591150.1 [0,1,0,0,0,0|2,0,1]=4 177 B12R1.367 CCC(=O)C1=CC=C(C(=C1)O)O CNP0313770.0 [0,1,0,0,0,0|1,0,0]=2 178 B12R1.367 COC(=O)C1=CC(=O)C(=CO1)O CNP0491895.0 [0,1,0,0,0,0|1,0,1]=3 179 B12R1.367 COC(=O)C1=CC=C(C(=C1)Cl)Cl CNP0533621.0 [0,1,0,0,0,0|2,0,0]=3 180 B12R1.367 COC(=O)C1=CC=C(C(=C1)N)O CNP0023118.0 [0,1,0,0,0,0|1,0,0]=2 181 B12R1.367 COC(=O)C1=CC=C(C(=C1)O)N CNP0083419.0 [0,1,0,0,0,0|1,0,0]=2 182 B12R1.367 COC(=O)C1=CC=C(C(=C1)O)O CNP0279680.0 [0,1,0,0,0,0|0,0,0]=1 183 B12R1.367 COC(=O)C1=CN(C(=O)C=C1)C CNP0334743.0 [0,1,0,0,0,0|2,0,1]=4 184 B12R1.367 COC(=O)C1=COC(=O)C(=C1)Br CNP0152101.0 [0,1,0,0,0,0|2,0,1]=4 185 B12R1.367 N#CC(O)C1=CC=C(C(=C1)O)O CNP0085424.0 [0,1,0,0,0,0|1,0,1]=3 186 B12R1.367 NCC(=O)C1=CC=C(C(=C1)O)O CNP0133774.0 [0,1,0,0,0,0|1,0,0]=2 187 B12R1.367 NC[C@@H](O)C1=CC=C(C(=C1)O)O CNP0214798.3 [0,1,0,0,0,0|1,0,1]=3 188 B12R1.367 NC[C@H](O)C1=CC=C(C(=C1)O)O CNP0214798.2 [0,1,0,0,0,0|1,0,1]=3 189 B12R1.367 O=C(CO)C1=CC=C(C(=C1)O)O CNP0281749.0 [0,1,0,0,0,0|0,0,0]=1 190 B12R1.367 O=C(NO)C1=CC=C(C(=C1)O)O CNP0501868.0 [0,1,0,0,0,0|0,0,0]=1 191 B12R1.367 O=CC(O)C1=CC=C(C(=C1)O)O CNP0280132.0 [0,1,0,0,0,0|0,0,1]=2 192 B12R1.367 OC[C@H](O)C1=CC=C(C(=C1)O)O CNP0188951.1 [0,1,0,0,0,0|0,0,2]=3 193 B12R1.893 CC(=O)C1=CC=C(C(=C1C)C)C CNP0584174.0 [0,1,0,0,0,0|3,0,0]=4 194 B12R1.893 CC(=O)C1=CC=C(C(=C1O)C)O CNP0289312.0 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.893 CC(=O)C1=CC=C(C(=C1O)O)O CNP0213966.0 [0,1,0,0,0,0|1,0,0]=2 196 B12R1.893 CC1=C(C=CC(=C1O)O)C(=O)O CNP0481433.0 [0,1,0,0,0,0|0,0,0]=1 197 B12R1.893 CC1=C(C=CC(=C1O)[N+](=O)[O-])O CNP0487415.0 [0,1,0,0,0,0|2,0,1]=4 198 B12R1.893 CC1=CC=C(C(=C1C)C)C(=O)O CNP0133340.0 [0,1,0,0,0,0|2,0,0]=3 199 B12R1.893 CC1=CC=C(C(=C1O)N)C(=O)O CNP0239974.0 [0,1,0,0,0,0|1,0,0]=2 200 B12R1.893 NC1=C(C=CC(=C1O)Cl)C(=O)O CNP0571729.0 [0,1,0,0,0,0|1,0,0]=2 201 B12R1.893 O=C(O)C1=C(C(=O)C(=CO1)O)O CNP0274161.0 [0,1,0,0,0,0|1,0,1]=3 202 B12R1.893 O=C(O)C1=CC=C(C(=C1O)O)O CNP0165116.0 [0,1,0,0,0,0|0,0,0]=1 203 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)C)O)C CNP0169307.0 [0,1,0,0,0,0|2,0,0]=3 204 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)O)O)O CNP0139788.0 [0,1,0,0,0,0|1,0,0]=2 205 B12R1.1005 CC1=C(C=C(C=C1O)C(=O)O)O CNP0453501.0 [0,1,0,0,0,0|1,0,0]=2 206 B12R1.1005 CC1=CC(=CC(=C1O)C)C(=O)O CNP0192461.0 [0,1,0,0,0,0|1,0,0]=2 207 B12R1.1005 NC(=O)C1=CC(=C(C(=C1)O)O)O CNP0198006.0 [0,1,0,0,0,0|1,0,0]=2 208 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)Br)O)Br CNP0425607.0 [0,1,0,0,0,0|1,0,0]=2 209 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)Br)O)O CNP0081695.0 [0,1,0,0,0,0|0,0,0]=1 210 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)Cl)O)Cl CNP0185897.0 [0,1,0,0,0,0|1,0,0]=2 211 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)O)O)O CNP0133244.0 [0,1,0,0,0,0|0,0,0]=1 212 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)O)[O-])[O-] CNP0576349.0 [0,1,0,0,0,0|0,0,1]=2 213 B12R1.1005 O=C(O)C1=CC(=O)[C@H]([C@@H](C1)O)O CNP0230164.1 [0,1,0,0,0,0|0,0,3]=4 214 B12R1.1005 O=C(O)C1=C[C@@H]([C@H](C(=O)C1)O)O CNP0177762.1 [0,1,0,0,0,0|0,0,3]=4 215 B12R1.1005 O=C(O)C1=C[C@H]([C@@H](C(=O)C1)O)O CNP0177762.2 [0,1,0,0,0,0|0,0,3]=4 216 B10R0.93 C=C(CC(=O)C(=O)O)C(=O)O CNP0158198.0 [0,0,1,0,0,0|1,0,2]=4 217 B10R0.98 CC(=O)C=CC=C(C)C(=O)O CNP0156753.0 [0,0,1,0,0,0|3,0,0]=4 218 B10R0.98 CC(=O)C=CC=C(O)C(=O)O CNP0374205.0 [0,0,1,0,0,0|2,0,0]=3 219 B10R0.98 NC(=CC=CC(=O)O)C(=O)O CNP0360097.0 [0,0,1,0,0,0|2,0,0]=3 220 B10R0.98 O=C(O)C=CCC(=O)C(=O)O CNP0359492.0 [0,0,1,0,0,0|1,0,2]=4 221 B10R1.58 O=C(O)C1=CC(=C(N1)Br)Br CNP0157165.0 [0,0,0,0,1,0|3,0,0]=4 222 B10R1.58 O=C(O)C1=CC(=C(O1)Br)Br CNP0394723.0 [0,0,0,0,1,0|3,0,0]=4 223 B10R1.194 CC1=C(C(=CO1)C(=O)O)O CNP0507263.0 [0,0,0,0,1,0|2,0,0]=3 224 B10R1.194 O=C(O)C1=C(C(=CN1)Br)Br CNP0430934.0 [0,0,0,0,1,0|3,0,0]=4 225 B10R1.194 O=C(O)C1=CSC(=C1Cl)Cl CNP0440279.0 [0,0,0,0,1,0|3,0,0]=4 226 B12R1.19 CC(=O)CC1=CC=C(C(=C1)O)O CNP0097636.0 [0,0,0,0,0,1|1,0,0]=2 227 B12R1.19 CC(=O)NC1=CC=C(C(=C1)Cl)C CNP0024410.0 [0,0,0,0,0,1|3,0,0]=4 228 B12R1.19 CC(=O)NC1=CC=C(C(=C1)Cl)Cl CNP0068960.0 [0,0,0,0,0,1|3,0,0]=4 229 B12R1.19 CC(=O)OC1=CC=C(C(=C1)C)O CNP0297817.0 [0,0,0,0,0,1|2,0,0]=3 230 B12R1.19 CC(=O)OC1=CC=C(C(=C1)Cl)Cl CNP0018261.0 [0,0,0,0,0,1|3,0,0]=4 231 B12R1.19 CC(=O)OC1=CC=C(C(=C1)O)O CNP0238472.0 [0,0,0,0,0,1|1,0,0]=2 232 B12R1.19 CC1=CC(=CC=C1O)CC(=O)O CNP0116223.0 [0,0,0,0,0,1|1,0,0]=2 233 B12R1.19 CC1=CC=C(C=C1C)CC(=O)O CNP0579791.0 [0,0,0,0,0,1|2,0,0]=3 234 B12R1.19 C[C@H](N)CC1=CC=C(C(=C1)O)O CNP0397624.1 [0,0,0,0,0,1|2,0,1]=4 235 B12R1.19 NC(=O)CC1=CC=C(C(=C1)Cl)O CNP0313048.0 [0,0,0,0,0,1|2,0,0]=3 236 B12R1.19 NC(=O)CC1=CC=C(C(=C1)O)O CNP0087042.0 [0,0,0,0,0,1|1,0,0]=2 237 B12R1.19 NC(=O)NC1=CC=C(C(=C1)Cl)Cl CNP0299483.0 [0,0,0,0,0,1|3,0,0]=4 238 B12R1.19 O=C(O)CC1=CC=C(C(=C1)Br)O CNP0127310.0 [0,0,0,0,0,1|1,0,0]=2 239 B12R1.19 O=C(O)CC1=CC=C(C(=C1)Cl)O CNP0326831.0 [0,0,0,0,0,1|1,0,0]=2 240 B12R1.19 O=C(O)CC1=CC=C(C(=C1)O)O CNP0276169.0 [0,0,0,0,0,1|0,0,0]=1 241 B12R1.892 O=C1C=CC(=CC=C1O)[N+](=O)[O-] CNP0508315.0 [0,0,0,0,0,1|1,0,2]=4 242 B12R1.1021 C=C(C)C1=CC(=O)C(=CC=C1)O CNP0494305.0 [0,0,0,0,0,1|2,0,1]=4 243 B12R1.1021 C=C(C)C1=CC=CC(=O)C(=C1)O CNP0310811.0 [0,0,0,0,0,1|2,0,1]=4 244 B12R1.1021 CC(=O)C1=CC(=O)C(=CC=C1)O CNP0612012.0 [0,0,0,0,0,1|1,0,1]=3 245 B12R1.1021 CC(=O)C1=CC=CC(=O)C(=C1)O CNP0339263.0 [0,0,0,0,0,1|1,0,1]=3 246 B9R0.47 NC(=CC=CC=O)C(=O)O CNP0152302.0 [1,0,1,0,0,0|1,0,1]=4 247 B9R0.55 O=C(O)C=CC=CC(=O)O CNP0248591.0 [1,0,1,0,0,0|1,0,0]=3 248 B9R1.1 C=CC1=CC=C(C=C1)C CNP0003402.0 [2,0,0,0,0,0|2,0,0]=4 249 B9R1.1 C=CC1=CC=C(C=C1)O CNP0119518.0 [2,0,0,0,0,0|1,0,0]=3 250 B9R1.1 CC1=CC=C(C=C1)C=O CNP0234694.0 [2,0,0,0,0,0|1,0,0]=3 251 B9R1.1 CC1=CC=C(C=C1)CO CNP0002396.0 [2,0,0,0,0,0|1,0,1]=4 252 B9R1.1 CC1=CC=C(C=C1)I=O CNP0508059.0 [2,0,0,0,0,0|2,0,0]=4 253 B9R1.1 CC1=CC=C(C=C1)N=O CNP0522636.0 [2,0,0,0,0,0|2,0,0]=4 254 B9R1.1 CCC1=CC=C(C=C1)O CNP0299375.0 [2,0,0,0,0,0|1,0,1]=4 255 B9R1.1 CNC1=CC=C(C=C1)O CNP0036253.0 [2,0,0,0,0,0|2,0,0]=4 256 B9R1.1 COC1=CC=C(C=C1)O CNP0236213.0 [2,0,0,0,0,0|2,0,0]=4 257 B9R1.1 N#CC1=CC=C(C=C1)O CNP0148599.0 [2,0,0,0,0,0|1,0,1]=4 258 B9R1.1 N#[N+]C1=CC=C(C=C1)O CNP0595965.0 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.1 NC1=CC=C(C=C1)C=O CNP0263657.0 [2,0,0,0,0,0|1,0,0]=3 260 B9R1.1 NCC1=CC=C(C=C1)O CNP0106686.0 [2,0,0,0,0,0|1,0,1]=4 261 B9R1.1 O=CC1=CC=C(C=C1)O CNP0230702.0 [2,0,0,0,0,0|0,0,0]=2 262 B9R1.1 O=CC1=CC=C(OC1)O CNP0334419.0 [2,0,0,0,0,0|1,0,1]=4 263 B9R1.1 O=NC1=CC=C(C=C1)Br CNP0452912.0 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.1 OCC1=CC=C(C=C1)Br CNP0519580.0 [2,0,0,0,0,0|1,0,1]=4 265 B9R1.1 OCC1=CC=C(C=C1)O CNP0103281.0 [2,0,0,0,0,0|0,0,1]=3 266 B9R1.1 OCC1=CC=C(C=N1)O CNP0288074.0 [2,0,0,0,0,0|1,0,1]=4 267 B9R1.6 C=C(C)C1=CC=CC=C1 CNP0080169.0 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.6 CC(=O)C1=CC=CC=C1 CNP0296349.0 [2,0,0,0,0,0|1,0,0]=3 269 B9R1.6 CC(=O)C1=CC=CC=N1 CNP0224376.0 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.6 CC(=O)C1=CC=CN=C1 CNP0239193.0 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.6 CC(=O)C1=CC=NC=C1 CNP0611691.0 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.6 C[C@@H](O)C1=CC=CC=C1 CNP0207239.2 [2,0,0,0,0,0|1,0,1]=4 273 B9R1.6 C[C@H](O)C1=CC=CC=C1 CNP0207239.1 [2,0,0,0,0,0|1,0,1]=4 274 B9R1.6 N=C(N)C1=CC=CC=C1 CNP0158884.0 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.6 NC(=O)C1=CC=CC=C1 CNP0225623.0 [2,0,0,0,0,0|1,0,0]=3 276 B9R1.6 NC(=O)C1=CC=CC=N1 CNP0108671.0 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.6 NC(=O)C1=CC=CN=C1 CNP0150794.0 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.6 NC(=O)C1=CC=NC=C1 CNP0029893.0 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.6 O=C(Cl)C1=CC=CC=N1 CNP0286385.0 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.6 O=C(Cl)C1=CC=CN=C1 CNP0165890.0 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.6 O=C(Cl)C1=CC=NC=C1 CNP0030473.0 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.6 O=C(O)C1=CC=CC=C1 CNP0136227.0 [2,0,0,0,0,0|0,0,0]=2 283 B9R1.6 O=C(O)C1=CC=CC=N1 CNP0288286.0 [2,0,0,0,0,0|1,0,0]=3 284 B9R1.6 O=C(O)C1=CC=CN=C1 CNP0319168.0 [2,0,0,0,0,0|1,0,0]=3 285 B9R1.6 O=C(O)C1=CC=NC=C1 CNP0196648.0 [2,0,0,0,0,0|1,0,0]=3 286 B9R1.6 O=C(O)C1=CN=CC=N1 CNP0274739.0 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.6 O=C(S)C1=CC=CC=C1 CNP0611694.0 [2,0,0,0,0,0|0,1,0]=3 288 B9R1.6 O=C([O-])C1=CC=CC=C1 CNP0496576.0 [2,0,0,0,0,0|0,0,1]=3 289 B9R1.6 O=C([O-])C1=CC=CC=C1 CNP0511525.0 [2,0,0,0,0,0|0,0,1]=3 290 B9R1.6 O=C([O-])C1=CC=CC=C1 CNP0577403.0 [2,0,0,0,0,0|0,0,1]=3 291 B9R1.6 O=C([O-])C1=CC=CC=N1 CNP0520974.0 [2,0,0,0,0,0|1,0,1]=4 292 B9R1.6 O=C([O-])C1=CC=CN=C1 CNP0546767.0 [2,0,0,0,0,0|1,0,1]=4 293 B9R1.6 O=[14C](O)C1=CC=CN=C1 CNP0495425.0 [2,0,0,0,0,0|1,0,0]=3 294 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 CNP0515942.0 [2,0,0,0,0,0|1,0,1]=4 295 B9R1.6 O=[S@@](O)C1=CC=CC=C1 CNP0216430.1 [2,0,0,0,0,0|1,0,0]=3 296 B9R1.6 O=[S@](O)C1=CC=CC=C1 CNP0216430.2 [2,0,0,0,0,0|1,0,0]=3 297 B9R1.6 O=[SH](O)C1=CC=CC=C1 CNP0547392.0 [2,0,0,0,0,0|1,0,0]=3 298 B9R1.6 OB(O)C1=CC=CC=C1 CNP0209672.0 [2,0,0,0,0,0|1,0,1]=4 299 B9R1.2 CC1=CC=CC(=C1)C=O CNP0352234.0 [2,0,0,0,0,0|1,0,0]=3 300 B9R1.2 CCC1=CC=CC(=C1)O CNP0135916.0 [2,0,0,0,0,0|1,0,1]=4 301 B9R1.2 COC1=CC=CC(=C1)O CNP0268248.0 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.2 N#CC1=CC=CC(=C1)O CNP0104146.0 [2,0,0,0,0,0|1,0,1]=4 303 B9R1.2 NCC1=CC=CC(=C1)O CNP0366572.0 [2,0,0,0,0,0|1,0,1]=4 304 B9R1.2 O=CC1=CC=CC(=C1)Cl CNP0001454.0 [2,0,0,0,0,0|1,0,0]=3 305 B9R1.2 O=CC1=CC=CC(=C1)O CNP0106037.0 [2,0,0,0,0,0|0,0,0]=2 306 B9R1.2 OCC1=CC=CC(=C1)I CNP0564021.0 [2,0,0,0,0,0|1,0,1]=4 307 B9R1.2 OCC1=CC=CC(=C1)O CNP0315716.0 [2,0,0,0,0,0|0,0,1]=3 308 B9R1.69 CC1=CC(=CC=C1Br)O CNP0025703.0 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.69 CC1=CC(=CC=C1Cl)O CNP0329015.0 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.69 CC1=CC(=CC=C1O)O CNP0324010.0 [2,0,0,0,0,0|1,0,0]=3 311 B9R1.69 CC1=CC(=O)C=CC1=O CNP0221358.0 [2,0,0,0,0,0|1,0,1]=4 312 B9R1.69 CC1=CC=C(C(=C1)C)O CNP0080029.0 [2,0,0,0,0,0|1,0,1]=4 313 B9R1.69 CC1=CC=C(C(=C1)Cl)O CNP0145784.0 [2,0,0,0,0,0|1,0,1]=4 314 B9R1.69 CC1=CC=C(C(=C1)N)O CNP0421546.0 [2,0,0,0,0,0|1,0,1]=4 315 B9R1.69 CC1=CC=C(C(=C1)O)C CNP0172791.0 [2,0,0,0,0,0|1,0,1]=4 316 B9R1.69 CC1=CC=C(C(=C1)O)O CNP0114802.0 [2,0,0,0,0,0|0,0,1]=3 317 B9R1.69 CC1=CC=C(C=C1C)O CNP0160429.0 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.69 CC1=CC=C(C=C1O)O CNP0256040.0 [2,0,0,0,0,0|1,0,0]=3 319 B9R1.69 CC1=CNC(=O)C=C1O CNP0017901.0 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.69 N=C1C=CC(=O)C(=C1)O CNP0274436.0 [2,0,0,0,0,0|1,0,1]=4 321 B9R1.69 NC1=CC(=CC=C1O)O CNP0176630.0 [2,0,0,0,0,0|1,0,0]=3 322 B9R1.69 NC1=CC=C(C(=C1)N)O CNP0003471.0 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.69 O=C1C=C(C(=CN1)Cl)O CNP0569686.0 [2,0,0,0,0,0|2,0,0]=4 324 B9R1.69 O=C1C=CC(=O)C(=C1)O CNP0230039.0 [2,0,0,0,0,0|0,0,1]=3 325 B9R1.69 OC1=CC(=CC=C1Cl)Cl CNP0236901.0 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.69 OC1=CC=C(C(=C1)Br)O CNP0161760.0 [2,0,0,0,0,0|1,0,0]=3 327 B9R1.69 OC1=CC=C(C(=C1)Cl)Cl CNP0386646.0 [2,0,0,0,0,0|2,0,0]=4 328 B9R1.69 OC1=CC=C(C(=C1)Cl)O CNP0331365.0 [2,0,0,0,0,0|1,0,0]=3 329 B9R1.69 OC1=CC=C(C(=C1)O)O CNP0187325.0 [2,0,0,0,0,0|0,0,0]=2 330 B9R1.69 OC1=CC=C(C=C1Br)Br CNP0216116.0 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.69 OC1=CC=C(C=C1Cl)Cl CNP0401033.0 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.69 OC1=NC=C(C(=N1)O)O CNP0090439.0 [2,0,0,0,0,0|2,0,0]=4 333 B11R0.117 CC(=C(O)C=C(O)C(=O)O)C=O CNP0082326.0 [0,1,1,0,0,0|2,0,0]=4 334 B11R0.150 O=C(O)C(=CC=C(Cl)C(=O)O)Cl CNP0447669.0 [0,1,1,0,0,0|2,0,0]=4 335 B11R1.3 C=CC1=CC=C(C=C1)C(=O)O CNP0513206.0 [1,1,0,0,0,0|1,0,0]=3 336 B11R1.3 CCC1=CC=C(C=C1)C(=O)C CNP0409725.0 [1,1,0,0,0,0|2,0,0]=4 337 B11R1.3 CCC1=CC=C(C=C1)C(=O)Cl CNP0268451.0 [1,1,0,0,0,0|2,0,0]=4 338 B11R1.3 CCC1=CC=C(C=C1)C(=O)O CNP0225284.0 [1,1,0,0,0,0|1,0,0]=3 339 B11R1.3 CNC1=CC=C(C=C1)C(=O)N CNP0151690.0 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.3 CNC1=CC=C(C=C1)C(=O)O CNP0384043.0 [1,1,0,0,0,0|1,0,0]=3 341 B11R1.3 COC1=CC=C(C=C1)C(=O)C CNP0278778.0 [1,1,0,0,0,0|1,0,0]=3 342 B11R1.3 COC1=CC=C(C=C1)C(=O)Cl CNP0132459.0 [1,1,0,0,0,0|1,0,0]=3 343 B11R1.3 COC1=CC=C(C=C1)C(=O)N CNP0301578.0 [1,1,0,0,0,0|1,0,0]=3 344 B11R1.3 COC1=CC=C(C=C1)C(=O)O CNP0249583.0 [1,1,0,0,0,0|0,0,0]=2 345 B11R1.3 COC1=CC=C(C=C1)S(=O)=O CNP0546840.0 [1,1,0,0,0,0|1,0,1]=4 346 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O CNP0137067.1 [1,1,0,0,0,0|1,0,1]=4 347 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O CNP0137067.2 [1,1,0,0,0,0|1,0,1]=4 348 B11R1.3 COC1=CC=C(C=C1)[N+](=O)[O-] CNP0529321.0 [1,1,0,0,0,0|1,0,1]=4 349 B11R1.3 COC1=CC=C(C=N1)C(=O)O CNP0193366.0 [1,1,0,0,0,0|1,0,0]=3 350 B11R1.3 N=C(N)C1=CC=C(C=C1)CO CNP0538399.0 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.3 NC(=O)C1=CC=C(C=C1)C=O CNP0575281.0 [1,1,0,0,0,0|1,0,1]=4 352 B11R1.3 NNC1=CC=C(C=C1)C(=O)O CNP0496695.0 [1,1,0,0,0,0|1,0,0]=3 353 B11R1.3 O=C(Cl)C1=CC=C(C=C1)CBr CNP0050291.0 [1,1,0,0,0,0|2,0,0]=4 354 B11R1.3 O=C(O)C1=CC=C(C=C1)CO CNP0163373.0 [1,1,0,0,0,0|0,0,0]=2 355 B11R1.3 O=C(O)C1=CC=C(C=C1)[Hg]O CNP0547098.0 [1,1,0,0,0,0|0,0,0]=2 356 B11R1.3 O=C(O)C1=CN=C(C=N1)CO CNP0383390.0 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.3 O=CC1=CC=C(C=C1)C(=O)O CNP0158402.0 [1,1,0,0,0,0|0,0,1]=3 358 B11R1.3 O=NC1=CC=C(C=C1)C(=O)O CNP0442117.0 [1,1,0,0,0,0|0,0,1]=3 359 B11R1.3 [2H]C(=O)C1=CC=C(C=C1)OC CNP0490657.0 [1,1,0,0,0,0|1,0,0]=3 360 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O CNP0341593.0 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.19 NC1=CC=C(C=C1)S(=O)(=O)O CNP0300837.0 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.19 NC1=CC=C(C=C1)[As](=O)(O)O CNP0474348.0 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.19 O=P(O)(O)C1=CC=C(C=C1)O CNP0475877.0 [1,1,0,0,0,0|1,0,0]=3 364 B11R1.19 O=S(=O)(O)C1=CC=C(C=C1)O CNP0102094.0 [1,1,0,0,0,0|1,0,0]=3 365 B11R1.19 O=S(=O)(O)C1=CC=C(C=C1)[Hg] CNP0505241.0 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.22 C=C[C@@H](O)C1=CC=C(C=C1)O CNP0280373.2 [1,1,0,0,0,0|1,0,1]=4 367 B11R1.22 C=C[C@H](O)C1=CC=C(C=C1)O CNP0280373.1 [1,1,0,0,0,0|1,0,1]=4 368 B11R1.22 CC1=CC=C(C=C1)C(=NO)N CNP0330819.0 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.22 CC1=CC=C(C=C1)C(=O)NO CNP0029154.0 [1,1,0,0,0,0|1,0,0]=3 370 B11R1.22 CCC(=O)C1=CC=C(C=C1)N CNP0245250.0 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.22 CCC(=O)C1=CC=C(C=C1)O CNP0353024.0 [1,1,0,0,0,0|1,0,0]=3 372 B11R1.22 CCC(O)C1=CC=C(C=C1)O CNP0386254.0 [1,1,0,0,0,0|1,0,1]=4 373 B11R1.22 CNC(=O)C1=CC=C(C=C1)C CNP0126468.0 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.22 COC(=O)C1=CC=C(C=C1)C CNP0137727.0 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.22 COC(=O)C1=CC=C(C=C1)N CNP0162858.0 [1,1,0,0,0,0|1,0,0]=3 376 B11R1.22 COC(=O)C1=CC=C(C=C1)O CNP0259416.0 [1,1,0,0,0,0|0,0,0]=2 377 B11R1.22 COC(=O)C1=COC(=O)C=C1 CNP0038303.0 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.22 CO[C@H](C)C1=CC=C(C=C1)O CNP0294754.1 [1,1,0,0,0,0|1,0,1]=4 379 B11R1.22 N#C[C@@H](O)C1=CC=C(C=C1)O CNP0245965.1 [1,1,0,0,0,0|1,0,1]=4 380 B11R1.22 N#C[C@H](O)C1=CC=C(C=C1)O CNP0245965.2 [1,1,0,0,0,0|1,0,1]=4 381 B11R1.22 NC[C@@H](O)C1=CC=C(C=C1)O CNP0139359.1 [1,1,0,0,0,0|1,0,1]=4 382 B11R1.22 NC[C@H](O)C1=CC=C(C=C1)O CNP0139359.2 [1,1,0,0,0,0|1,0,1]=4 383 B11R1.22 NNC(=O)C1=CC=C(C=C1)Cl CNP0071039.0 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.22 NNC(=O)C1=CC=C(C=C1)O CNP0382573.0 [1,1,0,0,0,0|1,0,0]=3 385 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Br CNP0077206.0 [1,1,0,0,0,0|2,0,0]=4 386 B11R1.22 O=C(CO)C1=CC=C(C=C1)O CNP0183122.0 [1,1,0,0,0,0|0,0,0]=2 387 B11R1.22 O=C(NO)C1=CC=C(C=C1)Br CNP0218698.0 [1,1,0,0,0,0|1,0,0]=3 388 B11R1.22 O=CC(=O)C1=CC=C(C=C1)O CNP0271271.0 [1,1,0,0,0,0|0,0,1]=3 389 B11R1.22 OC[C@@H](O)C1=CC=C(C=C1)O CNP0398619.1 [1,1,0,0,0,0|0,0,2]=4 390 B11R1.22 OC[C@H](O)C1=CC=C(C=C1)O CNP0398619.2 [1,1,0,0,0,0|0,0,2]=4 391 B11R1.22 ON=C(Cl)C1=CC=C(C=C1)Cl CNP0052470.0 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.166 CC(=O)C1=CC=C(C=C1C)C CNP0090387.0 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.166 CC(=O)C1=CC=C(C=C1C)O CNP0234659.0 [1,1,0,0,0,0|1,0,0]=3 394 B11R1.166 CC(=O)C1=CC=C(C=C1O)C CNP0265619.0 [1,1,0,0,0,0|2,0,0]=4 395 B11R1.166 CC(=O)C1=CC=C(C=C1O)N CNP0529513.0 [1,1,0,0,0,0|2,0,0]=4 396 B11R1.166 CC(=O)C1=CC=C(C=C1O)O CNP0230310.0 [1,1,0,0,0,0|1,0,0]=3 397 B11R1.166 CC1=CC(=CC=C1C(=O)O)O CNP0075319.0 [1,1,0,0,0,0|0,0,0]=2 398 B11R1.166 CC1=CC(=O)C(=CN1)C(=O)O CNP0491726.0 [1,1,0,0,0,0|2,0,0]=4 399 B11R1.166 CC1=CC=C(C(=C1)C)C(=O)Cl CNP0035950.0 [1,1,0,0,0,0|2,0,0]=4 400 B11R1.166 CC1=CC=C(C(=C1)C)C(=O)O CNP0439432.0 [1,1,0,0,0,0|1,0,0]=3 401 B11R1.166 CC1=CC=C(C(=C1)O)C(=O)N CNP0081106.0 [1,1,0,0,0,0|2,0,0]=4 402 B11R1.166 NC(=O)C1=CC=C(C=C1N)Cl CNP0526880.0 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.166 NC(=O)C1=CC=C(C=C1O)O CNP0268339.0 [1,1,0,0,0,0|1,0,0]=3 404 B11R1.166 NC1=CC=C(C(=C1)N)C(=O)O CNP0400011.0 [1,1,0,0,0,0|1,0,0]=3 405 B11R1.166 NC1=CC=C(C(=C1)O)C(=O)O CNP0313106.0 [1,1,0,0,0,0|1,0,0]=3 406 B11R1.166 O=C(Cl)C1=CC=C(C=C1O)O CNP0210532.0 [1,1,0,0,0,0|1,0,0]=3 407 B11R1.166 O=C(O)C1=CC=C(C=C1Cl)Cl CNP0175601.0 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.166 O=C(O)C1=CC=C(C=C1O)O CNP0285956.0 [1,1,0,0,0,0|0,0,0]=2 409 B11R1.166 O=C(O)C1=CC=C(N=C1Cl)Cl CNP0609125.0 [1,1,0,0,0,0|2,0,0]=4 410 B11R1.166 O=C(O)C1=CN=C(N=C1O)O CNP0502839.0 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.166 O=[N+]([O-])C1=CC=C(C=C1O)O CNP0564391.0 [1,1,0,0,0,0|1,0,1]=4 412 B11R1.23 CNC(=O)C1=CC=CC(=C1)N CNP0065493.0 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.23 COC(=O)C1=CC=CC(=C1)Br CNP0260377.0 [1,1,0,0,0,0|1,0,0]=3 414 B11R1.23 COC(=O)C1=CC=CC(=C1)C CNP0189828.0 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.23 COC(=O)C1=CC=CC(=C1)N CNP0145729.0 [1,1,0,0,0,0|1,0,0]=3 416 B11R1.23 COC(=O)C1=CC=CC(=C1)O CNP0301417.0 [1,1,0,0,0,0|0,0,0]=2 417 B11R1.23 N#C[C@@H](O)C1=CC=CC(=C1)O CNP0135364.1 [1,1,0,0,0,0|1,0,1]=4 418 B11R1.23 NNC(=O)C1=CC=CC(=C1)Br CNP0017923.0 [1,1,0,0,0,0|2,0,0]=4 419 B11R1.23 NNC(=O)C1=CC=CC(=C1)N CNP0088265.0 [1,1,0,0,0,0|2,0,0]=4 420 B11R1.23 NNC(=O)C1=CC=CC(=C1)O CNP0218227.0 [1,1,0,0,0,0|1,0,0]=3 421 B11R1.74 CC(=O)C1=CC(=CC(=C1)O)O CNP0352952.0 [1,1,0,0,0,0|1,0,0]=3 422 B11R1.74 CC(=O)C1=CC(=NC(=C1)O)C CNP0546674.0 [1,1,0,0,0,0|2,0,0]=4 423 B11R1.74 CC1=CC(=CC(=C1)C(=O)Cl)C CNP0063069.0 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.74 CC1=CC(=CC(=C1)C(=O)O)C CNP0469512.0 [1,1,0,0,0,0|1,0,0]=3 425 B11R1.74 CC1=CC(=CC(=C1)C(=O)O)N CNP0441939.0 [1,1,0,0,0,0|1,0,0]=3 426 B11R1.74 CC1=CC(=CC(=O)N1)C(=O)O CNP0398097.0 [1,1,0,0,0,0|1,0,1]=4 427 B11R1.74 NC(=O)C1=CC(=CC(=C1)O)O CNP0282728.0 [1,1,0,0,0,0|1,0,0]=3 428 B11R1.74 NC1=CC(=CC(=C1)C(=O)O)O CNP0285554.0 [1,1,0,0,0,0|0,0,0]=2 429 B11R1.74 O=C(O)C1=CC(=CC(=C1)O)O CNP0151632.0 [1,1,0,0,0,0|0,0,0]=2 430 B11R1.74 O=C(O)C1=CC(=NC(=C1)Cl)Cl CNP0611630.0 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.74 O=C(O)C1=CC(=NC(=N1)O)O CNP0569904.0 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.74 O=C(O)C1=CC(=NC(=N1)O)[O-] CNP0579704.0 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.74 O=[N+]([O-])C1=CC(=CC(=C1)O)O CNP0561927.0 [1,1,0,0,0,0|1,0,1]=4 434 B11R1.155 NC1=CC=CC(=C1)S(=O)(=O)O CNP0197644.0 [1,1,0,0,0,0|2,0,0]=4 435 B11R1.155 O=P(O)(O)C1=CC=CC(=C1)O CNP0441003.0 [1,1,0,0,0,0|1,0,0]=3 436 B11R1.155 O=S(=O)(O)C1=CC=CC(=C1)O CNP0166325.0 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.159 C=C(C)C1=CC=CC(=C1C)O CNP0547009.0 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.159 CC(=O)C1=CC=CC(=C1O)O CNP0306897.0 [1,1,0,0,0,0|1,0,0]=3 439 B11R1.159 CC1=CC=CC(=C1N)C(=O)O CNP0472872.0 [1,1,0,0,0,0|1,0,0]=3 440 B11R1.159 CC1=CC=CC(=C1O)C(=O)O CNP0134592.0 [1,1,0,0,0,0|1,0,0]=3 441 B11R1.159 NC(=O)C1=CC=CC(=C1N)O CNP0129939.0 [1,1,0,0,0,0|1,0,0]=3 442 B11R1.159 NC(=O)C1=CC=CC(=C1O)O CNP0115939.0 [1,1,0,0,0,0|1,0,0]=3 443 B11R1.159 NC1=C(C=CC=C1C(=O)O)Cl CNP0150804.0 [1,1,0,0,0,0|1,0,0]=3 444 B11R1.159 NC1=C(C=CC=C1C(=O)O)O CNP0324729.0 [1,1,0,0,0,0|0,0,0]=2 445 B11R1.159 NC1=CC=CC(=C1N)C(=O)O CNP0140316.0 [1,1,0,0,0,0|1,0,0]=3 446 B11R1.159 NC1=CC=CC(=C1O)C(=O)O CNP0299279.0 [1,1,0,0,0,0|1,0,0]=3 447 B11R1.159 N[C@@H]1C(=CC=C[C@H]1O)C(=O)O CNP0161245.1 [1,1,0,0,0,0|0,0,2]=4 448 B11R1.159 N[C@H]1C(=CC=C[C@@H]1O)C(=O)O CNP0161245.2 [1,1,0,0,0,0|0,0,2]=4 449 B11R1.159 O=C(O)C1=C(C(=O)C=CN1)O CNP0608712.0 [1,1,0,0,0,0|1,0,1]=4 450 B11R1.159 O=C(O)C1=CC=CC(=C1O)O CNP0283277.0 [1,1,0,0,0,0|0,0,0]=2 451 B11R1.159 O=C(O)C1=CC=CC(=O)C1=O CNP0189448.0 [1,1,0,0,0,0|0,0,1]=3 452 B11R1.159 O=C(O)C1=CC=C[C@@H]([C@H]1O)O CNP0176375.1 [1,1,0,0,0,0|0,0,2]=4 453 B11R1.159 O=C(O)C1=NC=CC(=C1O)O CNP0146283.0 [1,1,0,0,0,0|1,0,0]=3 454 B11R1.159 O=C([O-])C1=CC=CC(=C1O)O CNP0535153.0 [1,1,0,0,0,0|0,0,1]=3 455 B11R1.167 CC(=O)C1=CC(=CC=C1N)O CNP0207419.0 [1,1,0,0,0,0|1,0,0]=3 456 B11R1.167 CC(=O)C1=CC(=CC=C1O)C CNP0189333.0 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.167 CC(=O)C1=CC(=CC=C1O)O CNP0226762.0 [1,1,0,0,0,0|1,0,0]=3 458 B11R1.167 CC1=CC=C(C(=C1)C(=O)N)C CNP0373420.0 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.167 CC1=CC=C(C(=C1)C(=O)O)C CNP0331077.0 [1,1,0,0,0,0|1,0,0]=3 460 B11R1.167 CC1=CC=C(C=C1C(=O)O)O CNP0535211.0 [1,1,0,0,0,0|0,0,0]=2 461 B11R1.167 CC1=CC=[N+](C=C1C(=O)O)[O-] CNP0577851.0 [1,1,0,0,0,0|1,0,1]=4 462 B11R1.167 NC1=CC=C(C(=C1)C(=O)O)O CNP0079833.0 [1,1,0,0,0,0|1,0,0]=3 463 B11R1.167 NC1=CC=C(C=C1C(=O)O)O CNP0213879.0 [1,1,0,0,0,0|0,0,0]=2 464 B11R1.167 O=C(O)C1=CC(=CC=C1O)O CNP0187458.0 [1,1,0,0,0,0|0,0,0]=2 465 B11R1.167 O=C(O)C1=NC(=CC=C1Cl)Cl CNP0350104.0 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.167 O=[N+]([O-])C1=CC(=CC=C1O)O CNP0527393.0 [1,1,0,0,0,0|1,0,1]=4 467 B11R1.167 OC1=CC=C(C(=C1)C(O)Cl)O CNP0519910.0 [1,1,0,0,0,0|1,0,1]=4 468 B11R1.266 CC(=O)C1=CC=CC(=C1)C=O CNP0357224.0 [1,1,0,0,0,0|1,0,1]=4 469 B11R1.266 CCC1=CC=CC(=C1)C(=O)C CNP0129791.0 [1,1,0,0,0,0|2,0,0]=4 470 B11R1.266 COC1=CC=CC(=C1)C(=O)C CNP0402576.0 [1,1,0,0,0,0|1,0,0]=3 471 B11R1.266 COC1=CC=CC(=C1)C(=O)Cl CNP0325095.0 [1,1,0,0,0,0|1,0,0]=3 472 B11R1.266 COC1=CC=CC(=C1)C(=O)N CNP0107427.0 [1,1,0,0,0,0|1,0,0]=3 473 B11R1.266 COC1=CC=CC(=C1)C(=O)O CNP0251972.0 [1,1,0,0,0,0|0,0,0]=2 474 B11R1.266 O=C(O)C1=CC=CC(=C1)CBr CNP0445236.0 [1,1,0,0,0,0|1,0,0]=3 475 B11R1.266 O=CC1=CC=CC(=C1)C(=O)O CNP0507166.0 [1,1,0,0,0,0|0,0,1]=3 476 B11R1.14 C=CC1=CC(=C(C(=C1)Br)O)O CNP0580129.0 [1,1,0,0,0,0|1,0,0]=3 477 B11R1.14 CC1=CC(=CC(=C1O)C)C=O CNP0331607.0 [1,1,0,0,0,0|1,0,0]=3 478 B11R1.14 N#CC1=CC(=C(C(=C1)O)O)O CNP0123806.0 [1,1,0,0,0,0|1,0,1]=4 479 B11R1.14 O=CC1=CC(=C(C(=C1)Br)O)Br CNP0188044.0 [1,1,0,0,0,0|1,0,0]=3 480 B11R1.14 O=CC1=CC(=C(C(=C1)Br)O)O CNP0146798.0 [1,1,0,0,0,0|0,0,0]=2 481 B11R1.14 O=CC1=CC(=C(C(=C1)O)O)O CNP0306277.0 [1,1,0,0,0,0|0,0,0]=2 482 B11R1.14 OCC1=CC(=C(C(=C1)Br)O)Br CNP0322070.0 [1,1,0,0,0,0|1,0,1]=4 483 B11R1.14 OCC1=CC(=C(C(=C1)Br)O)O CNP0347203.0 [1,1,0,0,0,0|0,0,1]=3 484 B11R1.14 OCC1=CC(=C(C(=C1)Cl)O)O CNP0147248.0 [1,1,0,0,0,0|0,0,1]=3 485 B11R1.14 OCC1=CC(=C(C(=C1)O)O)O CNP0196506.0 [1,1,0,0,0,0|0,0,1]=3 486 B11R1.192 C=CCC1=CC=C(C(=C1)C)O CNP0539736.0 [1,1,0,0,0,0|2,0,0]=4 487 B11R1.192 C=CCC1=CC=C(C(=C1)O)O CNP0278721.0 [1,1,0,0,0,0|1,0,0]=3 488 B11R1.192 CC=CC1=CC=C(C(=C1)O)O CNP0370461.0 [1,1,0,0,0,0|1,0,0]=3 489 B11R1.192 COCC1=CC=C(C(=C1)Br)O CNP0105261.0 [1,1,0,0,0,0|1,0,1]=4 490 B11R1.192 COCC1=CC=C(C(=C1)O)O CNP0408139.0 [1,1,0,0,0,0|0,0,1]=3 491 B11R1.192 NCCC1=CC=C(C(=C1)O)O CNP0254743.0 [1,1,0,0,0,0|1,0,1]=4 492 B11R1.192 O=CCC1=CC=C(C(=C1)O)O CNP0123574.0 [1,1,0,0,0,0|0,0,0]=2 493 B11R1.192 OC=CC1=CC=C(C(=C1)O)O CNP0157779.0 [1,1,0,0,0,0|0,0,0]=2 494 B11R1.192 OCCC1=CC=C(C(=C1)Cl)O CNP0294538.0 [1,1,0,0,0,0|1,0,1]=4 495 B11R1.192 OCCC1=CC=C(C(=C1)O)O CNP0275287.0 [1,1,0,0,0,0|0,0,1]=3 496 B11R1.192 ON=CC1=CC=C(C(=C1)Cl)Cl CNP0052096.0 [1,1,0,0,0,0|2,0,0]=4 497 B11R1.192 ON=CC1=CC=C(C(=C1)O)O CNP0372159.0 [1,1,0,0,0,0|0,0,0]=2 498 B11R1.277 CC1=CC(=C(C=C1C)C=O)C CNP0085942.0 [1,1,0,0,0,0|2,0,0]=4 499 B11R1.277 CC1=CC(=C(C=C1O)C)N=O CNP0314907.0 [1,1,0,0,0,0|2,0,0]=4 500 B11R1.277 O=CC1=CC(=C(C=C1Br)O)O CNP0158213.0 [1,1,0,0,0,0|0,0,0]=2 501 B11R1.277 O=CC1=CC(=C(C=C1O)O)O CNP0294137.0 [1,1,0,0,0,0|0,0,0]=2 502 B11R1.277 OCC1=CC(=C(C=C1O)Cl)O CNP0329388.0 [1,1,0,0,0,0|1,0,1]=4 503 B11R1.278 CC1=C(C=CC(=C1O)N=O)O CNP0064746.0 [1,1,0,0,0,0|2,0,0]=4 504 B11R1.278 CC1=C(C=CC(=C1O)O)C=O CNP0202109.0 [1,1,0,0,0,0|0,0,0]=2 505 B11R1.278 CC1=CC=C(C(=C1C)C)C=O CNP0307883.0 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.278 O=CC1=CC=C(C(=C1O)O)O CNP0080275.0 [1,1,0,0,0,0|0,0,0]=2 507 B11R1.279 C=CC1=CC=C(C(=C1)O)OC CNP0342720.0 [1,1,0,0,0,0|1,0,0]=3 508 B11R1.279 CC1=CC(=CC=C1C=O)C=O CNP0301871.0 [1,1,0,0,0,0|1,0,1]=4 509 B11R1.279 CC1=CC(=CC=C1OP)C=O CNP0344714.0 [1,1,0,0,0,0|1,0,0]=3 510 B11R1.279 CC1=CC(=NO)C=CC1=NO CNP0317320.0 [1,1,0,0,0,0|2,0,0]=4 511 B11R1.279 CCC1=CC=C(C(=C1)O)OC CNP0241141.0 [1,1,0,0,0,0|1,0,1]=4 512 B11R1.279 COC1=CC=C(C(=C1)O)OC CNP0373176.0 [1,1,0,0,0,0|2,0,0]=4 513 B11R1.279 COC1=CC=C(C=C1Br)C=O CNP0185743.0 [1,1,0,0,0,0|1,0,0]=3 514 B11R1.279 COC1=CC=C(C=C1Br)CO CNP0163543.0 [1,1,0,0,0,0|1,0,1]=4 515 B11R1.279 COC1=CC=C(C=C1C)C=O CNP0009035.0 [1,1,0,0,0,0|1,0,0]=3 516 B11R1.279 COC1=CC=C(C=C1Cl)C=O CNP0247895.0 [1,1,0,0,0,0|1,0,0]=3 517 B11R1.279 COC1=CC=C(C=C1Cl)CO CNP0187706.0 [1,1,0,0,0,0|1,0,1]=4 518 B11R1.279 COC1=CC=C(C=C1O)C=O CNP0420166.0 [1,1,0,0,0,0|0,0,0]=2 519 B11R1.279 COC1=CC=C(C=C1O)CN CNP0009082.0 [1,1,0,0,0,0|1,0,1]=4 520 B11R1.279 COC1=CC=C(C=C1O)CO CNP0153100.0 [1,1,0,0,0,0|0,0,1]=3 521 B11R1.279 NCC1=CC=C(C(=C1)O)CO CNP0119562.0 [1,1,0,0,0,0|1,0,1]=4 522 B11R1.280 C=CC1=CC=C(C(=C1)OC)O CNP0357819.0 [1,1,0,0,0,0|1,0,0]=3 523 B11R1.280 CCC1=CC=C(C(=C1)OC)O CNP0401902.0 [1,1,0,0,0,0|1,0,1]=4 524 B11R1.280 COC1=CC(=CC=C1Cl)C=O CNP0146169.0 [1,1,0,0,0,0|1,0,0]=3 525 B11R1.280 COC1=CC(=CC=C1O)C#N CNP0252520.0 [1,1,0,0,0,0|1,0,1]=4 526 B11R1.280 COC1=CC(=CC=C1O)C=O CNP0270199.0 [1,1,0,0,0,0|0,0,0]=2 527 B11R1.280 COC1=CC(=CC=C1O)CN CNP0052909.0 [1,1,0,0,0,0|1,0,1]=4 528 B11R1.280 COC1=CC(=CC=C1O)CO CNP0268270.0 [1,1,0,0,0,0|0,0,1]=3 529 B11R1.280 COC1=CC(=CC=C1O)OO CNP0508207.0 [1,1,0,0,0,0|1,0,0]=3 530 B11R1.280 COC1=CC=C(C(=C1)OC)O CNP0124974.0 [1,1,0,0,0,0|2,0,0]=4 531 B11R1.280 O=C1C=CC(=CC1=NO)CO CNP0510804.0 [1,1,0,0,0,0|0,0,2]=4 532 B11R1.280 O=CC1=C/C(=N/O)/[C@H](C=C1)O CNP0566241.1 [1,1,0,0,0,0|0,0,1]=3 533 B11R1.280 O=CC1=CC(=NO)C(C=C1)O CNP0535658.0 [1,1,0,0,0,0|0,0,1]=3 534 B11R1.280 O=CC1=CC=C(C(=C1)C=O)O CNP0277701.0 [1,1,0,0,0,0|0,0,1]=3 535 B11R1.280 O=CC1=CC=C(C(=C1)N=O)O CNP0283266.0 [1,1,0,0,0,0|0,0,1]=3 536 B11R1.280 O=CC1=CC=C(C(=C1)N=O)[O-] CNP0482903.0 [1,1,0,0,0,0|0,0,2]=4 537 B11R1.280 O=CC1=CC=C(C(=C1)N=O)[O-] CNP0565531.0 [1,1,0,0,0,0|0,0,2]=4 538 B11R1.280 OCC1=CC(=NO)C(C=C1)O CNP0608822.0 [1,1,0,0,0,0|0,0,2]=4 539 B13R1.35 COC1=CC=C(C=C1Br)CC(=O)O CNP0165426.0 [0,1,0,0,0,1|1,0,0]=3 540 B13R1.35 COC1=CC=C(C=C1O)CC(=O)O CNP0071040.0 [0,1,0,0,0,1|0,0,0]=2 541 B13R1.52 COC1=CC(=CC=C1Br)CC(=O)O CNP0473704.0 [0,1,0,0,0,1|1,0,0]=3 542 B13R1.52 COC1=CC(=CC=C1O)CC(=O)C CNP0185438.0 [0,1,0,0,0,1|1,0,0]=3 543 B13R1.52 COC1=CC(=CC=C1O)CC(=O)O CNP0188137.0 [0,1,0,0,0,1|0,0,0]=2 544 B13R1.52 COC1=CC(=CC=C1O)C[C@H](C)O CNP0207715.1 [0,1,0,0,0,1|1,0,1]=4 545 B13R1.510 N[C@H](C(=O)O)C1=CC=C(C(=C1)Cl)O CNP0381317.1 [0,1,0,0,0,1|1,0,0]=3 546 B13R1.510 O=C(O)C(=O)C1=CC=C(C(=C1)O)O CNP0227130.0 [0,1,0,0,0,1|0,0,0]=2 547 B13R1.510 O=C(O)[C@@H](O)C1=CC=C(C(=C1)O)O CNP0143159.2 [0,1,0,0,0,1|0,0,0]=2 548 B13R1.510 O=C(O)[C@H](O)C1=CC=C(C(=C1)O)O CNP0143159.1 [0,1,0,0,0,1|0,0,0]=2 549 B13R1.876 NC(=O)CC1=CC(=C(C=C1O)Br)O CNP0313752.0 [0,1,0,0,0,1|2,0,0]=4 550 B13R1.876 O=C(O)CC1=CC(=C(C=C1O)O)O CNP0083814.0 [0,1,0,0,0,1|0,0,0]=2 551 B13R1.2879 COC(=O)CC1=CC=C(C(=C1)Br)O CNP0313435.0 [0,1,0,0,0,1|1,0,0]=3 552 B13R1.2879 COC(=O)CC1=CC=C(C(=C1)O)O CNP0226998.0 [0,1,0,0,0,1|0,0,0]=2 553 B13R1.2879 N[C@H](C=O)CC1=CC=C(C(=C1)O)O CNP0552942.1 [0,1,0,0,0,1|1,0,1]=4 554 B13R1.3763 CC(=O)CC1=CC(=C(C(=C1)O)C)O CNP0464022.0 [0,1,0,0,0,1|2,0,0]=4 555 B13R1.3763 NC(=O)CC1=CC(=C(C(=C1)Br)O)Br CNP0314536.0 [0,1,0,0,0,1|2,0,0]=4 556 B13R1.3763 O=C(O)CC1=CC(=C(C(=C1)Br)O)Br CNP0332466.0 [0,1,0,0,0,1|1,0,0]=3 557 B13R1.3763 O=C(O)CC1=CC(=C(C(=C1)O)O)O CNP0261737.0 [0,1,0,0,0,1|0,0,0]=2 558 B13R1.7910 O=C(O)C1=CC(=CC(=O)C(=C1)O)O CNP0386274.0 [0,1,0,0,0,1|0,0,1]=3 559 B13R1.7910 O=C(O)C1=CC(=O)C(=CC(=C1)O)O CNP0604744.0 [0,1,0,0,0,1|0,0,1]=3 560 B13R1.7910 O=C(O)C1=CC(=O)C=C(C(=C1)O)O CNP0073815.0 [0,1,0,0,0,1|0,0,0]=2 561 B13R1.6806 COC1(CC(=CC=C1O)C(=O)O)O CNP0600103.0 [0,2,0,0,0,0|0,0,2]=4 562 B13R1.38 CC(C)(O)C1=CC=C(C(=C1)O)CO CNP0520449.0 [0,2,0,0,0,0|1,0,1]=4 563 B13R1.120 CC(=O)C1=CC=C(C=C1O)C(=O)O CNP0605440.0 [0,2,0,0,0,0|0,0,1]=3 564 B13R1.120 CC(C)C1=CC=C(C=C1O)C(=O)O CNP0237614.0 [0,2,0,0,0,0|1,0,0]=3 565 B13R1.120 CC1=CC(=CC=C1C(=O)O)C(=O)N CNP0577452.0 [0,2,0,0,0,0|2,0,0]=4 566 B13R1.120 O=C(O)C1=CC=C(C(=C1)O)C(=O)O CNP0423012.0 [0,2,0,0,0,0|0,0,0]=2 567 B13R1.652 COC1=CC(=C(C=C1Br)C(=O)C)O CNP0197660.0 [0,2,0,0,0,0|2,0,0]=4 568 B13R1.652 COC1=CC(=C(C=C1C)C(=O)O)C CNP0473530.0 [0,2,0,0,0,0|1,0,0]=3 569 B13R1.652 COC1=CC(=C(C=C1O)C(=O)C)O CNP0205734.0 [0,2,0,0,0,0|1,0,0]=3 570 B13R1.3088 COC(=O)C1=CC=C(C(=C1)O)OC CNP0155987.0 [0,2,0,0,0,0|0,0,0]=2 571 B13R1.3088 COC1=CC=C(C=C1O)[C@@H](O)CO CNP0150126.1 [0,2,0,0,0,0|0,0,2]=4 572 B13R1.3091 C=C(C)C1=CC=C(C(=C1)OC)OC CNP0310060.0 [0,2,0,0,0,0|2,0,0]=4 573 B13R1.3091 COC1=CC=C(C=C1C=O)C(=O)C CNP0138193.0 [0,2,0,0,0,0|1,0,1]=4 574 B13R1.3091 COC1=CC=C(C=C1OC)C(=O)C CNP0212163.0 [0,2,0,0,0,0|1,0,0]=3 575 B13R1.3091 COC1=CC=C(C=C1OC)C(=O)N CNP0186366.0 [0,2,0,0,0,0|1,0,0]=3 576 B13R1.3091 COC1=CC=C(C=C1OC)C(=O)O CNP0328859.0 [0,2,0,0,0,0|0,0,0]=2 577 B13R1.3091 COC1=CC=C(C=C1OC)C(C)O CNP0521065.0 [0,2,0,0,0,0|1,0,1]=4 578 B13R1.3096 COC1=CC=C(C(=C1N)O)C(=O)N CNP0395135.0 [0,2,0,0,0,0|2,0,0]=4 579 B13R1.3096 COC1=CC=C(C(=C1O)O)C(=O)C CNP0408569.0 [0,2,0,0,0,0|1,0,0]=3 580 B13R1.3096 COC1=CC=C(C(=C1O)O)C(=O)O CNP0277888.0 [0,2,0,0,0,0|0,0,0]=2 581 B13R1.3380 COC1=C(C=C(C=C1Br)C(=O)N)O CNP0243712.0 [0,2,0,0,0,0|1,0,0]=3 582 B13R1.3380 COC1=C(C=C(C=C1Br)C(=O)O)Br CNP0514258.0 [0,2,0,0,0,0|1,0,0]=3 583 B13R1.3380 COC1=C(C=C(C=C1Br)C(=O)O)O CNP0129092.0 [0,2,0,0,0,0|0,0,0]=2 584 B13R1.3380 COC1=C(C=C(C=C1C)C(=O)C)C CNP0309261.0 [0,2,0,0,0,0|2,0,0]=4 585 B13R1.3380 COC1=C(C=C(C=C1C)C(=O)O)C CNP0306507.0 [0,2,0,0,0,0|1,0,0]=3 586 B13R1.3380 COC1=C(C=C(C=C1Cl)C(=O)O)Cl CNP0247534.0 [0,2,0,0,0,0|1,0,0]=3 587 B13R1.3380 COC1=C(C=C(C=C1O)C(=O)C)C CNP0342545.0 [0,2,0,0,0,0|1,0,0]=3 588 B13R1.3380 COC1=C(C=C(C=C1O)C(=O)O)O CNP0151030.0 [0,2,0,0,0,0|0,0,0]=2 589 B13R1.13 CC(=O)C1=CC(=CC=C1O)C(=O)O CNP0076310.0 [0,2,0,0,0,0|0,0,1]=3 590 B13R1.13 CC(=O)C1=CC=C(C(=C1)C(=O)C)O CNP0162097.0 [0,2,0,0,0,0|1,0,1]=4 591 B13R1.13 CC(=O)C1=CC=C(C(=C1)C(=O)O)O CNP0528188.0 [0,2,0,0,0,0|1,0,0]=3 592 B13R1.13 CC1=CC=C(C=C1[N+](=O)[O-])C(=O)O CNP0530373.0 [0,2,0,0,0,0|1,0,1]=4 593 B13R1.13 NC(=O)C1=CC=C(C(=C1)[N+](=O)[O-])O CNP0560375.0 [0,2,0,0,0,0|1,0,1]=4 594 B13R1.13 O=C(O)C1=CC=C(C(=C1)C(=O)O)O CNP0159995.0 [0,2,0,0,0,0|0,0,0]=2 595 B13R1.13 O=C(O)C1=CC=C(C(=C1)[N+](=O)[O-])O CNP0525330.0 [0,2,0,0,0,0|0,0,1]=3 596 B13R1.49 CCC(=O)C1=CC=C(C(=C1)OC)O CNP0146838.0 [0,2,0,0,0,0|1,0,0]=3 597 B13R1.49 CC[C@@H](O)C1=CC=C(C(=C1)OC)O CNP0362761.2 [0,2,0,0,0,0|1,0,1]=4 598 B13R1.49 CC[C@H](O)C1=CC=C(C(=C1)OC)O CNP0362761.1 [0,2,0,0,0,0|1,0,1]=4 599 B13R1.49 COC(=O)C1=CC=C(C(=C1)OC)N CNP0017903.0 [0,2,0,0,0,0|1,0,0]=3 600 B13R1.49 COC(=O)C1=CC=C(C(=C1)OC)O CNP0205762.0 [0,2,0,0,0,0|0,0,0]=2 601 B13R1.49 COC1=CC(=CC=C1O)C(=NO)C CNP0173953.0 [0,2,0,0,0,0|1,0,0]=3 602 B13R1.49 COC1=CC(=CC=C1O)C(=O)CO CNP0379786.0 [0,2,0,0,0,0|0,0,0]=2 603 B13R1.49 COC1=CC(=CC=C1O)C(O)C=O CNP0022427.0 [0,2,0,0,0,0|0,0,1]=3 604 B13R1.49 COC1=CC(=CC=C1O)[C@@H](O)CN CNP0113388.2 [0,2,0,0,0,0|1,0,1]=4 605 B13R1.49 COC1=CC(=CC=C1O)[C@@H](O)CO CNP0116546.1 [0,2,0,0,0,0|0,0,2]=4 606 B13R1.49 COC1=CC(=CC=C1O)[C@H](O)CN CNP0113388.1 [0,2,0,0,0,0|1,0,1]=4 607 B13R1.49 COC1=CC(=CC=C1O)[C@H](O)CO CNP0116546.2 [0,2,0,0,0,0|0,0,2]=4 608 B13R1.298 COC1=CC(=CC(=C1O)O)C(=O)O CNP0383759.0 [0,2,0,0,0,0|0,0,0]=2 609 B13R1.354 CC(=O)C1=CC=C(C(=C1)CCO)O CNP0348573.0 [0,2,0,0,0,0|1,0,0]=3 610 B13R1.354 CC=CC1=CC(=CC=C1O)C(=O)O CNP0289208.0 [0,2,0,0,0,0|1,0,0]=3 611 B13R1.354 CCOC1=CC(=CC=C1O)C(=O)O CNP0076092.0 [0,2,0,0,0,0|0,0,0]=2 612 B13R1.2403 COC1C=C(C=CC1(C)O)C(=O)O CNP0570531.0 [0,2,0,0,0,0|0,0,2]=4 613 B13R1.3230 COC1=C(C=CC(=C1O)C(=O)C)O CNP0578194.0 [0,2,0,0,0,0|1,0,0]=3 614 B13R1.3230 COC1=C(C=CC(=C1O)C(=O)N)O CNP0315935.0 [0,2,0,0,0,0|1,0,0]=3 615 B13R1.1807 CCC(=O)C1=CC(=C(C=C1O)O)O CNP0201482.0 [0,2,0,0,0,0|1,0,0]=3 616 B13R1.2398 COC1=CC(=C(C=C1C(=O)C)O)O CNP0173358.0 [0,2,0,0,0,0|1,0,0]=3 617 B13R1.2398 COC1=CC(=C(C=C1C(=O)O)Cl)N CNP0575388.0 [0,2,0,0,0,0|2,0,0]=4 618 B13R1.2811 CC(=O)C1=CC(=C(C(=C1O)C)O)C CNP0250819.0 [0,2,0,0,0,0|2,0,0]=4 619 B13R1.2811 CC(=O)C1=CC(=C(C(=C1O)O)O)C CNP0137870.0 [0,2,0,0,0,0|1,0,0]=3 620 B13R1.2811 CC1=C(C=C(C(=C1O)O)O)C(=O)O CNP0583118.0 [0,2,0,0,0,0|0,0,0]=2 621 B13R1.2811 CC1=CC(=C(C(=C1C)C)C)C(=O)O CNP0451162.0 [0,2,0,0,0,0|2,0,0]=4 622 B13R1.2812 CC(=O)C1=C(C=C(C(=C1C)C)O)O CNP0504557.0 [0,2,0,0,0,0|2,0,0]=4 623 B13R1.2812 CC(=O)C1=C(C=C(C(=C1O)C)O)O CNP0105460.0 [0,2,0,0,0,0|2,0,0]=4 624 B13R1.2812 CC(=O)C1=C(C=C(C(=C1O)O)O)O CNP0328473.0 [0,2,0,0,0,0|1,0,0]=3 625 B13R1.2812 CC1=C(C(=CC(=C1C(=O)O)O)O)Br CNP0498175.0 [0,2,0,0,0,0|1,0,0]=3 626 B13R1.2812 CC1=C(C(=CC(=C1C(=O)O)O)O)Cl CNP0345358.0 [0,2,0,0,0,0|1,0,0]=3 627 B13R1.2812 CC1=C(C=C(C(=C1C)C(=O)O)O)O CNP0302993.0 [0,2,0,0,0,0|1,0,0]=3 628 B13R1.2812 CC1=CC(=C(C(=C1C(=O)O)O)C)O CNP0165507.0 [0,2,0,0,0,0|1,0,0]=3 629 B13R1.2812 CC1=CC(=C(C(=C1C)C)C(=O)O)C CNP0441286.0 [0,2,0,0,0,0|2,0,0]=4 630 B13R1.2812 NC1=C(C=C(C(=C1I)C(=O)O)I)I CNP0463821.0 [0,2,0,0,0,0|2,0,0]=4 631 B13R1.331 COC(OC)C1=CC=C(C(=C1)O)O CNP0129986.0 [0,2,0,0,0,0|0,0,2]=4 632 B13R1.331 CO[C@H](CO)C1=CC=C(C(=C1)O)O CNP0242961.1 [0,2,0,0,0,0|0,0,2]=4 633 B13R1.466 CCOC(=O)C1=CC(=O)C(=CO1)O CNP0491861.0 [0,2,0,0,0,0|1,0,1]=4 634 B13R1.466 CCOC(=O)C1=CC=C(C(=C1)O)O CNP0317918.0 [0,2,0,0,0,0|0,0,0]=2 635 B13R1.466 CNCC(=O)C1=CC=C(C(=C1)O)O CNP0272151.0 [0,2,0,0,0,0|1,0,0]=3 636 B13R1.466 CNC[C@@H](O)C1=CC=C(C(=C1)O)O CNP0255612.2 [0,2,0,0,0,0|1,0,1]=4 637 B13R1.466 CNC[C@H](O)C1=CC=C(C(=C1)O)O CNP0255612.1 [0,2,0,0,0,0|1,0,1]=4 638 B13R1.466 O=C(CCO)C1=CC=C(C(=C1)O)O CNP0134924.0 [0,2,0,0,0,0|0,0,0]=2 639 B13R1.1808 CC1=C(C=CC(=C1O)C(=O)CCl)O CNP0124748.0 [0,2,0,0,0,0|2,0,0]=4 640 B13R1.1808 COC(=O)C1=CC=C(C(=C1N)O)C CNP0250480.0 [0,2,0,0,0,0|1,0,0]=3 641 B13R1.1808 COC(=O)C1=CC=C(C(=C1O)O)O CNP0181804.0 [0,2,0,0,0,0|0,0,0]=2 642 B13R1.2678 COC(=O)C1=CC(=C(C(=C1)Br)O)Br CNP0492061.0 [0,2,0,0,0,0|1,0,0]=3 643 B13R1.2678 COC(=O)C1=CC(=C(C(=C1)Br)O)O CNP0266576.0 [0,2,0,0,0,0|0,0,0]=2 644 B13R1.2678 COC(=O)C1=CC(=C(C(=C1)Cl)O)Cl CNP0315875.0 [0,2,0,0,0,0|1,0,0]=3 645 B13R1.2678 COC(=O)C1=CC(=C(C(=C1)O)O)O CNP0110273.0 [0,2,0,0,0,0|0,0,0]=2 646 B13R1.3158 CC1=NC=C(C(=C1O)CO)C(=O)O CNP0580769.0 [0,2,0,0,0,0|2,0,0]=4 647 B11R1.53 O=C(O)C1=CC=CC=C1CO CNP0283123.0 [0,0,1,1,0,0|1,0,1]=4 648 B11R1.53 O=C(O)C1=CC=CC=C1NO CNP0085034.0 [0,0,1,1,0,0|2,0,0]=4 649 B11R1.53 O=CC1=CC=CC=C1C(=O)O CNP0610125.0 [0,0,1,1,0,0|1,0,1]=4 650 B11R1.81 CC=CC1=CC=C(C=C1O)O CNP0287059.0 [0,0,1,1,0,0|2,0,0]=4 651 B11R1.175 O=C(O)C1=COC(=C1)C(=O)O CNP0604129.0 [0,0,1,1,0,0|1,0,0]=3 652 B11R1.80 O=C(O)C=C1C=C(C(=O)O1)Cl CNP0437115.0 [0,0,1,1,0,0|2,0,0]=4 653 B11R2.363 CC1=CC=C2C(=O)CC2=C1 CNP0317782.0 [1,0,0,1,0,0|2,0,0]=4 654 B11R2.104 CC1=CC=CC2=C1CC2=O CNP0057604.0 [1,0,0,1,0,0|2,0,0]=4 655 B11R2.117 CC1=CC=C2CC(=O)C2=C1 CNP0035023.0 [1,0,0,1,0,0|2,0,0]=4 656 B13R2.430 CC(=O)C1=CC=C2OCCC2=C1 CNP0365179.0 [0,1,0,1,0,0|2,0,0]=4 657 B13R2.430 CC(=O)C1=CC=C2OCOC2=C1 CNP0109786.0 [0,1,0,1,0,0|1,0,0]=3 658 B13R2.430 NC(=O)C1=CC=C2OCOC2=C1 CNP0322148.0 [0,1,0,1,0,0|1,0,0]=3 659 B13R2.430 O=C(Cl)C1=CC=C2OCOC2=C1 CNP0266159.0 [0,1,0,1,0,0|1,0,0]=3 660 B13R2.430 O=C(O)C1=CC=C2NC=CC2=C1 CNP0083028.0 [0,1,0,1,0,0|2,0,0]=4 661 B13R2.430 O=C(O)C1=CC=C2OC=CC2=C1 CNP0314403.0 [0,1,0,1,0,0|1,0,0]=3 662 B13R2.430 O=C(O)C1=CC=C2OCCC2=C1 CNP0201380.0 [0,1,0,1,0,0|1,0,0]=3 663 B13R2.430 O=C(O)C1=CC=C2OCOC2=C1 CNP0322584.0 [0,1,0,1,0,0|0,0,0]=2 664 B13R2.1590 COC1=CC2=C(C=C1C)C(=O)C2 CNP0035660.0 [0,1,0,1,0,0|2,0,0]=4 665 B13R2.2131 COC1=CC=C2C(=O)CC2=C1C CNP0062804.0 [0,1,0,1,0,0|2,0,0]=4 666 B13R2.11634 O=C1OCC2=CC(=C(C=C12)O)O CNP0217673.0 [0,1,0,1,0,0|0,0,0]=2 667 B13R2.5180 CC1=C(C=CC2=C1OCC2=O)O CNP0042986.0 [0,1,0,1,0,0|1,0,0]=3 668 B13R2.5180 CC1=NC=C2C(=O)OCC2=C1O CNP0395670.0 [0,1,0,1,0,0|2,0,0]=4 669 B13R2.5180 O=C1COC2=C1C=CC(=C2O)O CNP0194185.0 [0,1,0,1,0,0|0,0,0]=2 670 B9R0.79 C=C(C(=C)C(=O)O)C(=O)O CNP0156637.0 [0,0,1,0,1,0|2,0,0]=4 671 B9R0.79 O=C(O)C(=C(O)C(=O)O)O CNP0237095.0 [0,0,1,0,1,0|2,0,0]=4 672 B9R0.79 O=C(O)C(=O)C(=C(O)O)O CNP0190522.0 [0,0,1,0,1,0|2,0,0]=4 673 B9R1.35 CC1=CC(=CO1)C(=O)O CNP0306402.0 [1,0,0,0,1,0|2,0,0]=4 674 B9R1.35 CC1=CC=C(O1)C(=O)O CNP0084070.0 [1,0,0,0,1,0|2,0,0]=4 675 B9R1.35 CC1=CNC(=C1)C(=O)O CNP0109431.0 [1,0,0,0,1,0|2,0,0]=4 676 B9R1.35 CC1=COC(=C1)C(=O)O CNP0234380.0 [1,0,0,0,1,0|2,0,0]=4 677 B9R1.35 O=C(O)C1=CC(=CN1)Br CNP0268142.0 [1,0,0,0,1,0|2,0,0]=4 678 B9R1.35 O=C(O)C1=CC(=CN1)O CNP0363770.0 [1,0,0,0,1,0|1,0,0]=3 679 B9R1.35 O=C(O)C1=CC=C(N1)Br CNP0435630.0 [1,0,0,0,1,0|2,0,0]=4 680 B9R1.35 O=C(O)C1=CC=C(O1)O CNP0082303.0 [1,0,0,0,1,0|1,0,0]=3 681 B9R1.41 C=C1C=CC=C1C(=O)O CNP0542431.0 [1,0,0,0,1,0|1,0,0]=3 682 B9R1.41 CC(=O)C1=C(C=CO1)O CNP0270989.0 [1,0,0,0,1,0|2,0,0]=4 683 B9R1.41 CC1=C(C=CO1)C(=O)O CNP0152585.0 [1,0,0,0,1,0|2,0,0]=4 684 B9R1.41 CC1=C(NC=C1)C(=O)O CNP0198389.0 [1,0,0,0,1,0|2,0,0]=4 685 B9R1.41 CC1=C(OC=C1)C(=O)O CNP0566239.0 [1,0,0,0,1,0|2,0,0]=4 686 B9R1.41 CC1=C(SC=C1)C(=O)O CNP0195449.0 [1,0,0,0,1,0|2,0,0]=4 687 B9R1.41 O=C(O)C1=CON=C1O CNP0539416.0 [1,0,0,0,1,0|2,0,0]=4 688 B9R1.132 CC1=C(OC=C1O)C=O CNP0517113.0 [1,0,0,0,1,0|2,0,0]=4 689 B11R0.29 O=C(O)CC=CC=C(O)C(=O)O CNP0120450.0 [0,0,1,0,0,1|1,0,0]=3 690 B11R1.20 C=C(C)CC1=CC=C(C=C1)O CNP0086005.0 [1,0,0,0,0,1|2,0,0]=4 691 B11R1.20 CC(=O)CC1=CC=C(C=C1)N CNP0296510.0 [1,0,0,0,0,1|2,0,0]=4 692 B11R1.20 CC(=O)CC1=CC=C(C=C1)O CNP0263134.0 [1,0,0,0,0,1|1,0,0]=3 693 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 CNP0609120.0 [1,0,0,0,0,1|1,0,1]=4 694 B11R1.20 CC(=O)NC1=CC=C(C=C1)Br CNP0177917.0 [1,0,0,0,0,1|2,0,0]=4 695 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl CNP0147054.0 [1,0,0,0,0,1|2,0,0]=4 696 B11R1.20 CC(=O)OC1=CC=C(C=C1)Br CNP0033109.0 [1,0,0,0,0,1|2,0,0]=4 697 B11R1.20 CC(=O)OC1=CC=C(C=C1)C CNP0227103.0 [1,0,0,0,0,1|2,0,0]=4 698 B11R1.20 CC(=O)OC1=CC=C(C=C1)O CNP0172781.0 [1,0,0,0,0,1|1,0,0]=3 699 B11R1.20 NC(=O)CC1=CC=C(C=C1)O CNP0490937.0 [1,0,0,0,0,1|1,0,0]=3 700 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl CNP0310141.0 [1,0,0,0,0,1|2,0,0]=4 701 B11R1.20 NC(=O)NC1=CC=C(C=C1)O CNP0160153.0 [1,0,0,0,0,1|1,0,0]=3 702 B11R1.20 NC1=CC=C(C=C1)CC(=O)O CNP0379454.0 [1,0,0,0,0,1|1,0,0]=3 703 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br CNP0211748.0 [1,0,0,0,0,1|1,0,0]=3 704 B11R1.20 O=C(O)CC1=CC=C(C=C1)O CNP0212603.0 [1,0,0,0,0,1|0,0,0]=2 705 B11R1.20 O=C(O)NC1=CC=C(C=C1)Cl CNP0172129.0 [1,0,0,0,0,1|1,0,0]=3 706 B11R1.20 O=C([O-])CC1=CC=C(C=C1)O CNP0582582.0 [1,0,0,0,0,1|0,0,1]=3 707 B11R1.20 O=C1C=CC(C=C1)CC(=O)O CNP0605531.0 [1,0,0,0,0,1|0,0,2]=4 708 B11R1.157 CC(=O)NC1=CC=CC(=C1)C CNP0569514.0 [1,0,0,0,0,1|2,0,0]=4 709 B11R1.157 CC(=O)NC1=CC=CC(=C1)Cl CNP0192017.0 [1,0,0,0,0,1|2,0,0]=4 710 B11R1.157 CC(=O)NC1=CC=CC(=C1)N CNP0368887.0 [1,0,0,0,0,1|2,0,0]=4 711 B11R1.157 CC(=O)NC1=CC=CC(=C1)O CNP0605398.0 [1,0,0,0,0,1|1,0,0]=3 712 B11R1.157 CC(=O)OC1=CC=CC(=C1)C CNP0423566.0 [1,0,0,0,0,1|2,0,0]=4 713 B11R1.157 CC(=O)OC1=CC=CC(=C1)O CNP0341697.0 [1,0,0,0,0,1|1,0,0]=3 714 B11R1.157 CC1=CC=CC(=C1)CC(=O)O CNP0296551.0 [1,0,0,0,0,1|1,0,0]=3 715 B11R1.157 O=C(O)CC1=CC=CC(=C1)O CNP0342864.0 [1,0,0,0,0,1|0,0,0]=2 716 B13R1.511 CC(=O)C=CC1=CC=C(C(=C1)O)O CNP0261862.0 [0,0,0,0,0,2|1,0,0]=3 717 B13R1.511 CC(=O)CCC1=CC=C(C(=C1)O)O CNP0175802.0 [0,0,0,0,0,2|1,0,0]=3 718 B13R1.511 CC1=CC(=CC=C1O)C=CC(=O)O CNP0164069.0 [0,0,0,0,0,2|1,0,0]=3 719 B13R1.511 C[C@@H](O)CCC1=CC=C(C(=C1)O)O CNP0157154.1 [0,0,0,0,0,2|1,0,1]=4 720 B13R1.511 C[C@H](O)CCC1=CC=C(C(=C1)O)O CNP0157154.2 [0,0,0,0,0,2|1,0,1]=4 721 B13R1.511 NC(=O)C=CC1=CC=C(C(=C1)O)O CNP0555794.0 [0,0,0,0,0,2|1,0,0]=3 722 B13R1.511 O=C(O)C=CC1=CC(=O)C(=O)C=C1 CNP0081893.0 [0,0,0,0,0,2|0,0,2]=4 723 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)Cl)Cl CNP0275534.0 [0,0,0,0,0,2|2,0,0]=4 724 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)O)O CNP0186784.0 [0,0,0,0,0,2|0,0,0]=2 725 B13R1.511 O=C(O)C=CC1C=CC(=C(C1)O)O CNP0489222.0 [0,0,0,0,0,2|0,0,2]=4 726 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)Cl)O CNP0565501.0 [0,0,0,0,0,2|1,0,0]=3 727 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)O)O CNP0265756.0 [0,0,0,0,0,2|0,0,0]=2 728 B13R1.511 O=[N+]([O-])C=CC1=CC=C(C(=C1)O)O CNP0342199.0 [0,0,0,0,0,2|1,0,1]=4