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{1 1.733,2 -11.589,3 134.3,4 247.755,6 5.147,7 5.237,8 4.802,9 4.436,10 6.33,11 4.474,12 5.754,13 5.869,14 5.145,15 4.834,16 7.17,17 4.87,18 6.131,19 6.291,20 5.316,21 5.05,22 7.494,23 5.068,24 6.239,25 6.416,26 5.353,27 5.13,28 7.55,29 5.137,30 6.313,31 6.497,32 5.445,33 5.206,34 7.665,35 5.197,36 6.344,37 6.519,38 5.526,39 5.304,40 7.678,41 5.297,42 6.48,43 6.661,44 5.598,45 5.388,46 7.861,47 5.385,48 6.572,49 6.771,50 5.59,51 5.427,52 7.974,53 5.402,54 1.832,55 41.54,56 13.772,57 16.51,58 2.731,59 72.852,60 21.996,61 28.368,62 3.377,63 116.14,64 27.992,65 38.68,66 3.655,67 130.9,68 29.956,69 43.018,70 3.941,71 145.2,72 33.117,73 46.872,74 4.377,75 148.031,76 36.478,77 50.388,78 4.789,79 165.743,80 39.048,81 56.608,82 4.973,83 188.139,84 41.524,85 61.103,86 805,87 120,88 0.236,89 4.383,91 4,92 2,93 12,94 3,95 1,96 17,98 6,100 8,101 2,102 1,103 18,104 14,105 21479,106 49.816,107 49.816,108 49.816,109 49.816,110 49.816,111 48.751,112 48.898,113 28.179,114 50.721,115 39.995,116 39.995,117 39.995,118 39.995,119 39.995,120 38.14,121 48.896,122 13.021,123 41.807,124 5.515,125 5.055,126 3748,127 8.124,128 1293.55,129 248.866,130 0.6,131 191.833,132 1828,133 4.179,134 3.087,135 3.087,136 3.487,137 3.483,138 3.47,139 0.532,140 3.499,141 2.617,142 3.493,143 2.945,144 2.499,145 3.459,146 2.94,147 2.496,148 2.22,149 3.342,150 2.866,151 2.351,152 0.38,153 2.212,154 3.335,155 2.863,156 3.114,157 2.137,158 2.343,159 0.248,160 2.114,161 3.175,162 2.598,163 3.049,164 2.109,165 2.183,166 0.088,167 1.962,168 34.667,169 0.439,170 3.015,171 0.038,172 62.5,173 53.5,174 0.677,175 143.488,176 103.333,177 0.68,178 103.05,179 1.304,180 12.742,181 24.002,182 0.278,183 0.418,184 1.456,185 0.708,186 0.983,187 0.946,188 0.879,189 1.109,190 0.946,191 1.121,192 1.162,193 0.981,194 1.078,195 0.938,196 0.807,197 0.92,198 0.98,199 22,200 1.33,201 11.778,202 7.5,203 7.022,204 4.125,205 3.073,206 2.15,207 1.914,208 147702,209 592308,210 1.955,211 1.657,212 263.341,213 1.733,214 5.72,215 6.101,216 6.273,217 5.93,218 6.278,219 14380.5,220 11.34,221 409803,222 1101.69,223 6.163,224 0.268,225 0.098,226 0.055,227 0.022,228 0.017,229 0.57,230 537.255,231 -0.093,232 4.699}
{0 CHEMBL1162088,1 1.73,2 -11.567,3 133.805,4 257.199,6 5.177,7 5.266,8 4.832,9 4.471,10 6.361,11 4.509,12 5.784,13 5.901,14 5.175,15 4.864,16 7.201,17 4.899,18 6.156,19 6.316,20 5.337,21 5.077,22 7.521,23 5.096,24 6.263,25 6.44,26 5.372,27 5.161,28 7.569,29 5.165,30 6.34,31 6.526,32 5.462,33 5.236,34 7.683,35 5.224,36 6.37,37 6.547,38 5.542,39 5.332,40 7.695,41 5.321,42 6.503,43 6.686,44 5.617,45 5.414,46 7.871,47 5.409,48 6.593,49 6.793,50 5.623,51 5.455,52 7.991,53 5.432,54 1.905,55 42.227,56 14.268,57 17.037,58 2.836,59 74.812,60 22.627,61 29.177,62 3.502,63 118.662,64 28.705,65 39.393,66 3.8,67 133.558,68 31.096,69 44.326,70 4.094,71 148.871,72 34.388,73 48.507,74 4.531,75 151.654,76 37.753,77 51.985,78 4.959,79 169.379,80 40.319,81 58.204,82 5.171,83 191.629,84 42.744,85 62.679,86 862,87 124,88 0.234,89 4.42,91 5,92 2,93 13,94 4,95 1,96 17,98 7,99 1,100 9,101 2,102 2,103 19,104 15,105 24756,106 51.515,107 51.515,108 51.515,109 51.515,110 51.515,111 50.243,112 52.575,113 29.144,114 52.43,115 41.512,116 41.512,117 41.512,118 41.512,119 41.512,120 39.337,121 53.655,122 13.545,123 43.325,124 5.565,125 5.092,126 3875,127 8.367,128 1352.17,129 256.657,130 0.6,131 198.833,132 1893,133 4.179,134 3.087,135 3.087,136 3.514,137 3.487,138 3.483,139 1.392,140 3.55,141 2.71,142 3.499,143 3.147,144 2.617,145 3.493,146 2.945,147 2.499,148 2.228,149 3.459,150 2.94,151 2.496,152 0.532,153 2.22,154 3.342,155 2.866,156 3.237,157 2.233,158 2.351,159 0.38,160 2.212,161 3.335,162 2.863,163 3.114,164 2.137,165 2.343,166 0.248,167 2.113,168 36,169 0.439,170 3.159,171 0.039,172 66,173 55.5,174 0.677,175 150.035,176 106.8,177 0.68,178 109.42,179 1.334,180 13.514,181 24.585,182 0.28,183 0.417,184 1.451,185 0.692,186 1.006,187 0.97,188 0.905,189 1.109,190 0.939,191 1.113,192 1.156,193 0.979,194 1.072,195 0.928,196 0.81,197 0.905,198 0.971,199 23,200 1.413,201 12,202 7.625,203 7.102,204 4.181,205 3.135,206 2.249,207 1.954,208 161213,209 648370,210 1.964,211 1.657,212 271.542,213 1.73,214 5.734,215 6.129,216 6.333,217 6.022,218 6.331,219 15495.7,220 11.459,221 453322,222 1145.26,223 6.217,224 0.271,225 0.097,226 0.054,227 0.022,228 0.017,229 0.569,230 561.974,231 -0.125,232 5.745}
{0 CHEMBL1162089,1 1.741,2 -10.65,3 113.416,4 282.072,5 0.065,6 5.233,7 5.324,8 4.89,9 4.553,10 6.423,11 4.587,12 5.83,13 5.944,14 5.235,15 4.95,16 7.238,17 4.98,18 6.202,19 6.362,20 5.402,21 5.158,22 7.561,23 5.172,24 6.315,25 6.492,26 5.432,27 5.225,28 7.635,29 5.229,30 6.385,31 6.571,32 5.501,33 5.29,34 7.726,35 5.277,36 6.409,37 6.588,38 5.571,39 5.384,40 7.721,41 5.367,42 6.54,43 6.725,44 5.644,45 5.465,46 7.892,47 5.453,48 6.628,49 6.83,50 5.649,51 5.505,52 8.01,53 5.474,54 2.092,55 43.575,56 15.371,57 17.91,58 3.147,59 76.444,60 24.659,61 30.934,62 3.907,63 122.115,64 31.37,65 42.145,66 4.197,67 139.02,68 33.471,69 46.666,70 4.451,71 154.439,72 36.574,73 50.582,74 4.887,75 156.246,76 40.376,77 54.43,78 5.357,79 174.678,80 43.378,81 61.192,82 5.586,83 197.416,84 45.948,85 65.936,86 834,87 134,88 0.232,89 4.49,90 4,91 5,92 6,93 13,94 6,95 5,96 17,97 2,98 9,99 1,100 10,101 2,102 3,103 19,104 15,105 32008,106 55.791,107 55.791,108 55.791,109 55.791,110 55.791,111 53.83,112 56.418,113 31.593,114 56.734,115 44.94,116 44.94,117 44.94,118 44.94,119 44.94,120 41.758,121 58.033,122 14.658,123 46.793,124 5.634,125 5.167,126 4204,127 8.426,128 1860.06,129 267.072,130 0.6,131 211.333,132 2036,133 4.179,134 3.087,135 3.087,136 3.583,137 3.487,138 3.483,139 1.058,140 3.805,141 2.935,142 3.499,143 3.147,144 2.66,145 3.493,146 2.945,147 2.617,148 2.346,149 3.459,150 2.94,151 2.499,152 0.532,153 2.22,154 3.423,155 2.866,156 3.272,157 2.313,158 2.496,159 0.38,160 2.212,161 3.342,162 2.863,163 3.114,164 2.137,165 2.351,166 0.248,167 2.114,168 38.9,169 0.442,170 3.262,171 0.037,172 76.25,173 59.25,174 0.673,175 158.079,176 112.3,177 0.677,178 124.957,179 1.42,180 15.584,181 25.498,182 0.256,183 0.411,184 1.41,185 0.697,186 0.986,187 0.955,188 0.885,189 1.1,190 0.952,191 1.083,192 1.123,193 0.977,194 1.069,195 0.935,196 0.813,197 0.915,198 0.972,199 23.5,200 1.483,201 13.111,202 8.375,203 7.404,204 4.333,205 3.148,206 2.257,207 2.02,208 198442,209 766386,210 1.98,211 1.687,212 288.955,213 1.741,214 5.964,215 6.325,216 6.482,217 6.093,218 6.432,219 17904.6,220 11.676,221 554719,222 1224.26,223 6.327,224 0.255,225 0.098,226 0.055,227 0.022,228 0.017,229 0.553,230 612.906,231 -0.069,232 7.046}
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