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407 lines
18 KiB
407 lines
18 KiB
system |
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404 |
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1SLV O 1 0.682 0.076 0.216 |
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1SLV H 2 0.707 0.147 0.279 |
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1SLV H1 3 0.583 0.083 0.210 |
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2SLV O 4 0.361 0.189 0.582 |
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2SLV H 5 0.384 0.273 0.535 |
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2SLV H1 6 0.432 0.180 0.650 |
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3SLV O 7 0.020 0.744 1.097 |
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3SLV H 8 0.038 0.749 0.999 |
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3SLV H1 9 0.112 0.742 1.135 |
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4SLV O 10 0.355 1.129 0.948 |
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4SLV H 11 0.295 1.162 0.876 |
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4SLV H1 12 0.379 1.038 0.916 |
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5SLV O 13 0.087 1.162 0.060 |
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5SLV H 14 0.098 1.104 1.603 |
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5SLV H1 15 0.036 1.106 0.124 |
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6SLV O 16 0.134 0.823 0.010 |
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6SLV H 17 0.040 0.802 1.609 |
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6SLV H1 18 0.154 0.893 1.565 |
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7SLV O 19 0.079 0.809 0.826 |
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7SLV H 20 0.176 0.818 0.813 |
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7SLV H1 21 0.045 0.785 0.737 |
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8SLV O 22 1.173 0.813 0.137 |
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8SLV H 23 1.126 0.852 0.214 |
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8SLV H1 24 1.225 0.887 0.101 |
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9SLV O 25 0.563 1.519 1.520 |
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9SLV H 26 0.652 1.564 1.534 |
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9SLV H1 27 0.530 1.502 1.611 |
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10SLV O 28 1.336 1.262 1.030 |
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10SLV H 29 1.434 1.253 1.032 |
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10SLV H1 30 1.317 1.314 0.949 |
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11SLV O 31 1.019 1.340 0.333 |
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11SLV H 32 1.040 1.281 0.257 |
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11SLV H1 33 1.063 1.292 0.408 |
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12SLV O 34 0.193 1.213 0.738 |
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12SLV H 35 0.143 1.295 0.713 |
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12SLV H1 36 0.118 1.153 0.764 |
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13SLV O 37 0.752 1.306 0.021 |
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13SLV H 38 0.733 1.316 1.548 |
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13SLV H1 39 0.679 1.248 0.054 |
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14SLV O 40 1.175 0.828 0.973 |
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14SLV H 41 1.114 0.798 1.046 |
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14SLV H1 42 1.183 0.748 0.917 |
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15SLV O 43 1.469 0.539 0.098 |
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15SLV H 44 1.409 0.511 0.171 |
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15SLV H1 45 1.554 0.494 0.122 |
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16SLV O 46 1.152 0.062 0.652 |
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16SLV H 47 1.168 1.610 0.716 |
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16SLV H1 48 1.070 0.104 0.687 |
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17SLV O 49 0.465 0.804 1.547 |
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17SLV H 50 0.563 0.818 1.554 |
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17SLV H1 51 0.430 0.831 0.012 |
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18SLV O 52 0.169 0.223 1.492 |
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18SLV H 53 0.231 0.260 1.559 |
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18SLV H1 54 0.143 0.134 1.528 |
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19SLV O 55 0.757 1.249 0.391 |
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19SLV H 56 0.701 1.332 0.397 |
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19SLV H1 57 0.846 1.286 0.368 |
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20SLV O 58 0.411 0.068 0.238 |
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20SLV H 59 0.323 0.097 0.271 |
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20SLV H1 60 0.388 1.607 0.189 |
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21SLV O 61 0.366 0.854 0.179 |
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21SLV H 62 0.272 0.852 0.145 |
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21SLV H1 63 0.356 0.883 0.273 |
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22SLV O 64 1.061 1.354 1.597 |
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22SLV H 65 1.033 1.269 0.019 |
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22SLV H1 66 0.977 1.406 1.601 |
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23SLV O 67 0.081 0.406 0.163 |
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23SLV H 68 0.129 0.460 0.095 |
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23SLV H1 69 0.120 0.317 0.149 |
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24SLV O 70 0.352 0.532 1.025 |
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24SLV H 71 0.296 0.451 1.026 |
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24SLV H1 72 0.428 0.510 1.086 |
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25SLV O 73 0.549 0.964 1.188 |
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25SLV H 74 0.511 1.054 1.193 |
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25SLV H1 75 0.645 0.979 1.186 |
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26SLV O 76 0.099 0.038 0.657 |
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26SLV H 77 0.069 1.566 0.660 |
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26SLV H1 78 0.193 0.032 0.684 |
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27SLV O 79 0.007 1.274 1.375 |
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27SLV H 80 0.099 1.307 1.396 |
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27SLV H1 81 1.576 1.313 1.447 |
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28SLV O 82 1.605 1.078 0.850 |
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28SLV H 83 0.001 0.982 0.859 |
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28SLV H1 84 1.609 1.116 0.941 |
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29SLV O 85 0.636 1.173 0.838 |
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29SLV H 86 0.550 1.172 0.792 |
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29SLV H1 87 0.613 1.156 0.932 |
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30SLV O 88 0.562 1.084 0.064 |
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30SLV H 89 0.624 1.007 0.065 |
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30SLV H1 90 0.502 1.070 0.141 |
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31SLV O 91 1.134 0.145 1.269 |
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31SLV H 92 1.082 0.060 1.268 |
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31SLV H1 93 1.132 0.167 1.366 |
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32SLV O 94 0.693 1.345 1.342 |
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32SLV H 95 0.634 1.409 1.390 |
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32SLV H1 96 0.632 1.303 1.276 |
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33SLV O 97 0.427 0.546 1.453 |
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33SLV H 98 0.444 0.642 1.475 |
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33SLV H1 99 0.337 0.533 1.493 |
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34SLV O 100 1.448 0.232 0.875 |
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34SLV H 101 1.477 0.239 0.970 |
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34SLV H1 102 1.535 0.251 0.829 |
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35SLV O 103 1.582 1.621 0.335 |
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35SLV H 104 1.526 0.045 0.402 |
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35SLV H1 105 0.047 0.043 0.345 |
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36SLV O 106 0.086 1.584 1.544 |
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36SLV H 107 0.046 1.588 1.454 |
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36SLV H1 108 0.025 1.520 1.590 |
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37SLV O 109 1.341 0.336 1.573 |
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37SLV H 110 1.390 0.257 1.607 |
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37SLV H1 111 1.391 0.413 1.609 |
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38SLV O 112 1.316 1.190 0.002 |
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38SLV H 113 1.329 1.140 1.539 |
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38SLV H1 114 1.232 1.240 1.607 |
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39SLV O 115 1.065 1.058 0.813 |
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39SLV H 116 0.974 1.053 0.850 |
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39SLV H1 117 1.112 0.993 0.871 |
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40SLV O 118 0.347 1.457 0.099 |
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40SLV H 119 0.338 1.377 0.157 |
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40SLV H1 120 0.257 1.472 0.064 |
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41SLV O 121 0.568 0.106 0.755 |
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41SLV H 122 0.655 0.063 0.767 |
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41SLV H1 123 0.502 0.038 0.785 |
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42SLV O 124 0.094 1.018 1.443 |
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42SLV H 125 0.048 0.962 1.376 |
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42SLV H1 126 0.071 1.108 1.411 |
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43SLV O 127 1.186 1.559 0.396 |
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43SLV H 128 1.122 1.486 0.376 |
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43SLV H1 129 1.157 1.591 0.486 |
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44SLV O 130 0.185 0.109 1.228 |
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44SLV H 131 0.114 0.045 1.251 |
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44SLV H1 132 0.212 0.147 1.315 |
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45SLV O 133 0.003 1.218 1.101 |
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45SLV H 134 0.082 1.276 1.086 |
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45SLV H1 135 1.610 1.235 1.198 |
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46SLV O 136 1.133 1.470 0.837 |
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46SLV H 137 1.064 1.411 0.798 |
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46SLV H1 138 1.083 1.528 0.900 |
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47SLV O 139 0.178 0.177 0.365 |
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47SLV H 140 0.223 0.171 0.454 |
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47SLV H1 141 0.161 0.273 0.356 |
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48SLV O 142 0.920 1.572 0.139 |
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48SLV H 143 0.930 1.495 0.199 |
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48SLV H1 144 0.834 1.613 0.168 |
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49SLV O 145 0.462 0.101 1.367 |
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49SLV H 146 0.493 0.026 1.424 |
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49SLV H1 147 0.496 0.181 1.414 |
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50SLV O 148 0.815 0.017 1.511 |
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50SLV H 149 0.867 0.002 1.594 |
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50SLV H1 150 0.882 0.010 1.439 |
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51SLV O 151 1.138 0.639 1.436 |
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51SLV H 152 1.221 0.656 1.386 |
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51SLV H1 153 1.168 0.596 1.518 |
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52SLV O 154 0.751 0.619 0.456 |
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52SLV H 155 0.716 0.635 0.366 |
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52SLV H1 156 0.784 0.526 0.451 |
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53SLV O 157 0.450 0.560 0.165 |
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53SLV H 158 0.544 0.558 0.132 |
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53SLV H1 159 0.423 0.654 0.155 |
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54SLV O 160 1.261 1.512 0.090 |
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54SLV H 161 1.217 1.526 0.177 |
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54SLV H1 162 1.193 1.464 0.037 |
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55SLV O 163 1.361 0.703 1.273 |
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55SLV H 164 1.303 0.753 1.211 |
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55SLV H1 165 1.444 0.690 1.221 |
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56SLV O 166 1.006 1.131 0.121 |
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56SLV H 167 0.919 1.095 0.096 |
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56SLV H1 168 1.035 1.075 0.198 |
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57SLV O 169 1.434 0.109 0.114 |
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57SLV H 170 1.375 0.034 0.088 |
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57SLV H1 171 1.501 0.062 0.170 |
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58SLV O 172 0.280 1.229 0.244 |
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58SLV H 173 0.210 1.204 0.178 |
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58SLV H1 174 0.248 1.192 0.329 |
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59SLV O 175 1.456 1.358 0.439 |
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59SLV H 176 1.401 1.437 0.423 |
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59SLV H1 177 1.540 1.379 0.393 |
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60SLV O 178 0.420 1.105 1.450 |
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60SLV H 179 0.409 1.011 1.425 |
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60SLV H1 180 0.468 1.101 1.537 |
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61SLV O 181 0.337 1.575 0.820 |
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61SLV H 182 0.315 1.500 0.879 |
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61SLV H1 183 0.308 0.032 0.874 |
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62SLV O 184 0.377 1.537 0.530 |
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62SLV H 185 0.365 0.012 0.530 |
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62SLV H1 186 0.364 1.513 0.625 |
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63SLV O 187 1.014 0.045 0.997 |
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63SLV H 188 0.969 0.111 0.939 |
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63SLV H1 189 1.075 0.099 1.052 |
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64SLV O 190 0.567 0.317 1.514 |
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64SLV H 191 0.524 0.402 1.487 |
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64SLV H1 192 0.662 0.341 1.518 |
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65SLV O 193 1.337 1.053 1.383 |
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65SLV H 194 1.273 1.066 1.311 |
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65SLV H1 195 1.418 1.019 1.335 |
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66SLV O 196 0.176 0.556 1.571 |
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66SLV H 197 0.115 0.544 1.495 |
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66SLV H1 198 0.169 0.654 1.592 |
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67SLV O 199 1.375 0.123 0.483 |
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67SLV H 200 1.319 0.131 0.565 |
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67SLV H1 201 1.319 0.061 0.429 |
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68SLV O 202 0.289 0.765 1.174 |
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68SLV H 203 0.369 0.822 1.188 |
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68SLV H1 204 0.322 0.689 1.120 |
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69SLV O 205 1.274 1.189 0.288 |
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69SLV H 206 1.300 1.192 0.193 |
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69SLV H1 207 1.350 1.228 0.338 |
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70SLV O 208 0.975 0.407 1.224 |
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70SLV H 209 0.951 0.422 1.131 |
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70SLV H1 210 1.003 0.313 1.229 |
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71SLV O 211 0.550 0.490 1.214 |
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71SLV H 212 0.639 0.506 1.255 |
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71SLV H1 213 0.491 0.508 1.292 |
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72SLV O 214 0.614 1.483 0.396 |
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72SLV H 215 0.523 1.500 0.433 |
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72SLV H1 216 0.625 1.549 0.325 |
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73SLV O 217 1.326 0.339 1.197 |
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73SLV H 218 1.279 0.419 1.229 |
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73SLV H1 219 1.264 0.265 1.221 |
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74SLV O 220 0.505 1.263 1.139 |
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74SLV H 221 0.439 1.221 1.078 |
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74SLV H1 222 0.476 1.358 1.141 |
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75SLV O 223 1.393 0.459 0.718 |
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75SLV H 224 1.487 0.482 0.701 |
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75SLV H1 225 1.400 0.377 0.774 |
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76SLV O 226 1.104 0.330 0.237 |
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76SLV H 227 1.199 0.335 0.262 |
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76SLV H1 228 1.055 0.368 0.313 |
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77SLV O 229 0.931 1.573 1.256 |
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77SLV H 230 0.866 1.500 1.272 |
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77SLV H1 231 0.925 1.590 1.159 |
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78SLV O 232 0.457 0.907 0.811 |
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78SLV H 233 0.552 0.932 0.813 |
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78SLV H1 234 0.460 0.816 0.771 |
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79SLV O 235 1.579 0.257 1.114 |
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79SLV H 236 1.502 0.297 1.163 |
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79SLV H1 237 0.011 0.212 1.182 |
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80SLV O 238 1.121 1.241 0.589 |
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80SLV H 239 1.101 1.176 0.662 |
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80SLV H1 240 1.218 1.251 0.592 |
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81SLV O 241 0.685 0.436 0.741 |
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81SLV H 242 0.656 0.391 0.823 |
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81SLV H1 243 0.729 0.364 0.691 |
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82SLV O 244 0.483 0.649 0.709 |
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82SLV H 245 0.560 0.600 0.669 |
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82SLV H1 246 0.425 0.576 0.739 |
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83SLV O 247 1.380 0.327 0.289 |
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83SLV H 248 1.403 0.261 0.217 |
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83SLV H1 249 1.390 0.271 0.370 |
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84SLV O 250 1.613 1.398 0.685 |
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84SLV H 251 1.544 1.455 0.728 |
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84SLV H1 252 1.560 1.348 0.619 |
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85SLV O 253 0.272 1.336 1.422 |
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85SLV H 254 0.325 1.251 1.428 |
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85SLV H1 255 0.322 1.396 1.482 |
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86SLV O 256 1.440 1.601 0.752 |
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86SLV H 257 1.416 0.049 0.816 |
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86SLV H1 258 1.484 0.028 0.680 |
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87SLV O 259 0.205 1.414 1.161 |
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87SLV H 260 0.226 1.382 1.253 |
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87SLV H1 261 0.277 1.480 1.146 |
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88SLV O 262 1.570 1.589 1.266 |
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88SLV H 263 1.477 1.614 1.249 |
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88SLV H1 264 1.586 1.512 1.207 |
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89SLV O 265 0.456 0.350 0.360 |
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89SLV H 266 0.430 0.284 0.292 |
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89SLV H1 267 0.451 0.436 0.311 |
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90SLV O 268 0.452 1.549 1.148 |
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90SLV H 269 0.435 1.615 1.221 |
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90SLV H1 270 0.536 1.584 1.111 |
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91SLV O 271 1.035 0.744 1.192 |
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91SLV H 272 0.947 0.786 1.200 |
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91SLV H1 273 1.048 0.696 1.278 |
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92SLV O 274 1.212 0.540 0.521 |
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92SLV H 275 1.265 0.529 0.440 |
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92SLV H1 276 1.273 0.512 0.594 |
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93SLV O 277 0.055 0.298 0.741 |
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93SLV H 278 0.122 0.355 0.695 |
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93SLV H1 279 0.074 0.208 0.704 |
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94SLV O 280 1.508 0.750 1.536 |
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94SLV H 281 1.476 0.672 1.589 |
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94SLV H1 282 1.452 0.749 1.455 |
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95SLV O 283 1.101 0.207 1.542 |
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95SLV H 284 1.182 0.265 1.549 |
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95SLV H1 285 1.089 0.174 0.011 |
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96SLV O 286 1.545 1.382 0.002 |
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96SLV H 287 1.595 1.305 0.040 |
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96SLV H1 288 1.451 1.366 0.029 |
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97SLV O 289 0.249 0.168 0.968 |
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97SLV H 290 0.166 0.217 0.947 |
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97SLV H1 291 0.237 0.146 1.065 |
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98SLV O 292 1.550 0.968 1.221 |
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98SLV H 293 1.581 1.041 1.163 |
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98SLV H1 294 1.580 0.885 1.173 |
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99SLV O 295 0.347 0.318 0.067 |
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99SLV H 296 0.426 0.293 0.013 |
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99SLV H1 297 0.368 0.410 0.096 |
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100SLV O 298 0.772 0.512 1.384 |
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100SLV H 299 0.858 0.483 1.343 |
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100SLV H1 300 0.799 0.556 1.468 |
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101URA C 301 1.001 1.134 1.184 |
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101URA O 302 0.904 1.062 1.199 |
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101URA N 303 0.982 1.268 1.152 |
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101URA N1 304 1.122 1.080 1.143 |
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101URA H 305 0.889 1.307 1.161 |
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101URA H1 306 1.061 1.324 1.124 |
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101URA H2 307 1.124 0.981 1.122 |
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101URA H3 308 1.191 1.141 1.101 |
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102URA C 309 0.825 0.251 0.476 |
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102URA O 310 0.849 0.357 0.422 |
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102URA N 311 0.913 0.145 0.461 |
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102URA N1 312 0.693 0.213 0.493 |
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102URA H 313 1.002 0.161 0.416 |
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102URA H1 314 0.893 0.057 0.507 |
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102URA H2 315 0.619 0.278 0.467 |
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102URA H3 316 0.670 0.121 0.529 |
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103URA C 317 0.809 0.916 1.509 |
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103URA O 318 0.735 0.865 1.592 |
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103URA N 319 0.944 0.884 1.507 |
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103URA N1 320 0.779 1.044 1.463 |
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103URA H 321 0.975 0.796 1.547 |
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103URA H1 322 1.010 0.947 1.464 |
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103URA H2 323 0.686 1.081 1.476 |
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103URA H3 324 0.842 1.089 1.398 |
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104URA C 325 1.539 0.966 0.252 |
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104URA O 326 1.580 1.073 0.294 |
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104URA N 327 1.478 0.963 0.128 |
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104URA N1 328 1.606 0.851 0.288 |
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104URA H 329 1.437 1.048 0.090 |
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104URA H1 330 1.475 0.877 0.074 |
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104URA H2 331 0.029 0.848 0.378 |
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104URA H3 332 1.598 0.768 0.231 |
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105URA C 333 0.821 0.466 0.100 |
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105URA O 334 0.717 0.530 0.096 |
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105URA N 335 0.940 0.528 0.066 |
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105URA N1 336 0.818 0.330 0.075 |
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105URA H 337 0.946 0.629 0.070 |
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105URA H1 338 1.025 0.472 0.067 |
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105URA H2 339 0.732 0.278 0.088 |
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105URA H3 340 0.904 0.281 0.057 |
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106URA C 341 0.799 0.777 0.906 |
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106URA O 342 0.853 0.878 0.947 |
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106URA N 343 0.812 0.743 0.772 |
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106URA N1 344 0.682 0.733 0.966 |
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106URA H 345 0.883 0.791 0.717 |
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106URA H1 346 0.757 0.668 0.732 |
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106URA H2 347 0.651 0.778 1.051 |
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106URA H3 348 0.621 0.669 0.917 |
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107URA C 349 0.984 0.919 0.438 |
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107URA O 350 1.042 0.962 0.339 |
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107URA N 351 0.856 0.966 0.467 |
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107URA N1 352 1.006 0.787 0.475 |
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107URA H 353 0.829 1.059 0.435 |
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107URA H1 354 0.795 0.912 0.526 |
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107URA H2 355 1.094 0.743 0.451 |
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107URA H3 356 0.927 0.729 0.501 |
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108URA C 357 0.804 1.476 0.729 |
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108URA O 358 0.860 1.581 0.704 |
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108URA N 359 0.737 1.462 0.850 |
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108URA N1 360 0.857 1.357 0.682 |
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108URA H 361 0.736 1.540 0.916 |
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108URA H1 362 0.706 1.370 0.878 |
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108URA H2 363 0.929 1.358 0.611 |
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108URA H3 364 0.815 1.269 0.711 |
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109URA C 365 1.417 0.821 0.607 |
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109URA O 366 1.524 0.772 0.574 |
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109URA N 367 1.355 0.915 0.526 |
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109URA N1 368 1.389 0.833 0.742 |
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109URA H 369 1.392 0.932 0.433 |
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109URA H1 370 1.277 0.969 0.561 |
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109URA H2 371 1.448 0.785 0.809 |
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109URA H3 372 1.324 0.904 0.774 |
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110URA C 373 0.688 0.161 1.094 |
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110URA O 374 0.695 0.044 1.060 |
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110URA N 375 0.583 0.238 1.047 |
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110URA N1 376 0.732 0.196 1.221 |
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110URA H 377 0.523 0.200 0.974 |
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110URA H1 378 0.554 0.320 1.099 |
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110URA H2 379 0.778 0.126 1.277 |
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110URA H3 380 0.694 0.278 1.265 |
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111URA C 381 1.024 0.365 0.838 |
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111URA O 382 0.948 0.270 0.839 |
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111URA N 383 1.155 0.348 0.879 |
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111URA N1 384 1.002 0.470 0.751 |
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111URA H 385 1.187 0.258 0.910 |
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111URA H1 386 1.224 0.419 0.855 |
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111URA H2 387 0.910 0.482 0.710 |
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111URA H3 388 1.081 0.522 0.713 |
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112URA C 389 0.185 0.559 0.510 |
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112URA O 390 0.224 0.461 0.572 |
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112URA N 391 0.062 0.553 0.446 |
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112URA N1 392 0.223 0.685 0.553 |
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112URA H 393 0.034 0.468 0.400 |
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112URA H1 394 1.622 0.632 0.452 |
|
112URA H2 395 0.311 0.694 0.602 |
|
112URA H3 396 0.184 0.767 0.508 |
|
113URA C 397 0.447 1.024 0.469 |
|
113URA O 398 0.359 0.942 0.448 |
|
113URA N 399 0.414 1.145 0.529 |
|
113URA N1 400 0.553 1.031 0.380 |
|
113URA H 401 0.333 1.150 0.589 |
|
113URA H1 402 0.465 1.229 0.504 |
|
113URA H2 403 0.579 0.948 0.329 |
|
113URA H3 404 0.615 1.112 0.381 |
|
1.62280 1.62280 1.62280
|
|
|