forked from lijiext/lammps
853 lines
17 KiB
Plaintext
853 lines
17 KiB
Plaintext
LAMMPS data file for Nanoparticles
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420 atoms
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2 atom types
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-19.1446896794 19.1446896794 xlo xhi
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-19.1446896794 19.1446896794 ylo yhi
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-0.5 0.5 zlo zhi
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Atoms
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1 1 1 1 14.2841 -1.87906 0 0 0 0
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2 1 1 1 14.7402 -1.22181 0 0 0 0
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3 1 1 1 15.1963 -0.564553 0 0 0 0
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4 1 1 1 15.6524 0.0927 0 0 0 0
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5 1 1 1 16.1084 0.749953 0 0 0 0
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6 1 1 1 16.5645 1.40721 0 0 0 0
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7 1 1 1 12.9696 -0.966879 0 0 0 0
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8 1 1 1 13.4257 -0.309626 0 0 0 0
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9 1 1 1 13.8818 0.347628 0 0 0 0
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10 1 1 1 14.3378 1.00488 0 0 0 0
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11 1 1 1 14.7939 1.66213 0 0 0 0
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12 1 1 1 15.25 2.31939 0 0 0 0
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13 1 1 1 13.6268 -1.42297 0 0 0 0
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14 1 1 1 15.9073 1.8633 0 0 0 0
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15 1 1 1 12.924 -2.11647 0 0 0 0
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16 1 1 1 13.1673 -1.35437 0 0 0 0
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17 1 1 1 13.4106 -0.592276 0 0 0 0
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18 1 1 1 13.654 0.169823 0 0 0 0
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19 1 1 1 13.8973 0.931922 0 0 0 0
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20 1 1 1 14.1406 1.69402 0 0 0 0
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21 1 1 1 11.3998 -1.62983 0 0 0 0
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22 1 1 1 11.6431 -0.867734 0 0 0 0
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23 1 1 1 11.8864 -0.105635 0 0 0 0
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24 1 1 1 12.1298 0.656464 0 0 0 0
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25 1 1 1 12.3731 1.41856 0 0 0 0
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26 1 1 1 12.6164 2.18066 0 0 0 0
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27 1 1 1 12.1619 -1.87315 0 0 0 0
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28 1 1 1 13.3785 1.93734 0 0 0 0
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29 1 1 1 14.1831 -14.4404 0 0 0 0
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30 1 1 1 14.824 -14.9191 0 0 0 0
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31 1 1 1 15.465 -15.3978 0 0 0 0
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32 1 1 1 16.106 -15.8765 0 0 0 0
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33 1 1 1 16.7469 -16.3553 0 0 0 0
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34 1 1 1 17.3879 -16.834 0 0 0 0
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35 1 1 1 15.1405 -13.1585 0 0 0 0
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36 1 1 1 15.7815 -13.6372 0 0 0 0
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37 1 1 1 16.4225 -14.1159 0 0 0 0
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38 1 1 1 17.0634 -14.5946 0 0 0 0
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39 1 1 1 17.7044 -15.0734 0 0 0 0
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40 1 1 1 18.3453 -15.5521 0 0 0 0
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41 1 1 1 14.6618 -13.7994 0 0 0 0
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42 1 1 1 17.8666 -16.193 0 0 0 0
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43 1 1 1 4.44001 -2.7052 0 0 0 0
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44 1 1 1 5.05269 -3.21962 0 0 0 0
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45 1 1 1 5.66537 -3.73404 0 0 0 0
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46 1 1 1 6.27804 -4.24846 0 0 0 0
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47 1 1 1 6.89072 -4.76288 0 0 0 0
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48 1 1 1 7.5034 -5.2773 0 0 0 0
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49 1 1 1 5.46885 -1.47985 0 0 0 0
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50 1 1 1 6.08153 -1.99427 0 0 0 0
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51 1 1 1 6.6942 -2.50869 0 0 0 0
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52 1 1 1 7.30688 -3.02311 0 0 0 0
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53 1 1 1 7.91956 -3.53753 0 0 0 0
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54 1 1 1 8.53224 -4.05194 0 0 0 0
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55 1 1 1 4.95443 -2.09253 0 0 0 0
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56 1 1 1 8.01782 -4.66462 0 0 0 0
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57 1 1 1 -17.3372 -3.78851 0 0 0 0
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58 1 1 1 -17.9342 -4.32099 0 0 0 0
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59 1 1 1 -18.5313 -4.85347 0 0 0 0
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60 1 1 1 -19.1283 -5.38595 0 0 0 0
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61 1 1 1 18.564 -5.91843 0 -1 0 0
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62 1 1 1 17.967 -6.45091 0 -1 0 0
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63 1 1 1 -16.2722 -4.9826 0 0 0 0
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64 1 1 1 -16.8693 -5.51508 0 0 0 0
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65 1 1 1 -17.4663 -6.04756 0 0 0 0
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66 1 1 1 -18.0634 -6.58004 0 0 0 0
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67 1 1 1 -18.6604 -7.11252 0 0 0 0
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68 1 1 1 19.0319 -7.64501 0 -1 0 0
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69 1 1 1 -16.8047 -4.38555 0 0 0 0
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70 1 1 1 18.4995 -7.04796 0 -1 0 0
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71 1 1 1 2.02757 -0.130558 0 0 0 0
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72 1 1 1 1.7036 0.600906 0 0 0 0
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73 1 1 1 1.37962 1.33237 0 0 0 0
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74 1 1 1 1.05565 2.06383 0 0 0 0
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75 1 1 1 0.73167 2.7953 0 0 0 0
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76 1 1 1 0.407695 3.52676 0 0 0 0
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77 1 1 1 0.564645 -0.778509 0 0 0 0
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78 1 1 1 0.240669 -0.0470453 0 0 0 0
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79 1 1 1 -0.0833067 0.684419 0 0 0 0
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80 1 1 1 -0.407282 1.41588 0 0 0 0
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81 1 1 1 -0.731258 2.14735 0 0 0 0
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82 1 1 1 -1.05523 2.87881 0 0 0 0
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83 1 1 1 1.29611 -0.454534 0 0 0 0
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84 1 1 1 -0.323769 3.20279 0 0 0 0
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85 1 1 1 8.79058 -15.5166 0 0 0 0
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86 1 1 1 8.77817 -16.3166 0 0 0 0
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87 1 1 1 8.76576 -17.1165 0 0 0 0
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88 1 1 1 8.75336 -17.9164 0 0 0 0
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89 1 1 1 8.74095 -18.7163 0 0 0 0
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90 1 1 1 8.72854 18.7732 0 0 -1 0
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91 1 1 1 10.3904 -15.5415 0 0 0 0
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92 1 1 1 10.378 -16.3414 0 0 0 0
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93 1 1 1 10.3656 -17.1413 0 0 0 0
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94 1 1 1 10.3532 -17.9412 0 0 0 0
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95 1 1 1 10.3408 -18.7411 0 0 0 0
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96 1 1 1 10.3284 18.7484 0 0 -1 0
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97 1 1 1 9.59048 -15.5291 0 0 0 0
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98 1 1 1 9.52845 18.7608 0 0 -1 0
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99 1 1 1 -7.15097 3.97363 0 0 0 0
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100 1 1 1 -7.42944 4.7236 0 0 0 0
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101 1 1 1 -7.70792 5.47357 0 0 0 0
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102 1 1 1 -7.98639 6.22354 0 0 0 0
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103 1 1 1 -8.26486 6.97351 0 0 0 0
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104 1 1 1 -8.54334 7.72348 0 0 0 0
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105 1 1 1 -8.65091 3.41669 0 0 0 0
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106 1 1 1 -8.92938 4.16666 0 0 0 0
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107 1 1 1 -9.20785 4.91663 0 0 0 0
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108 1 1 1 -9.48633 5.66659 0 0 0 0
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109 1 1 1 -9.7648 6.41656 0 0 0 0
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110 1 1 1 -10.0433 7.16653 0 0 0 0
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111 1 1 1 -7.90094 3.69516 0 0 0 0
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112 1 1 1 -9.2933 7.445 0 0 0 0
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113 1 1 1 3.65725 12.9036 0 0 0 0
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114 1 1 1 3.06207 13.4381 0 0 0 0
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115 1 1 1 2.46688 13.9727 0 0 0 0
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116 1 1 1 1.8717 14.5072 0 0 0 0
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117 1 1 1 1.27652 15.0418 0 0 0 0
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118 1 1 1 0.68134 15.5764 0 0 0 0
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119 1 1 1 2.58812 11.7132 0 0 0 0
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120 1 1 1 1.99294 12.2478 0 0 0 0
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121 1 1 1 1.39776 12.7823 0 0 0 0
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122 1 1 1 0.802574 13.3169 0 0 0 0
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123 1 1 1 0.207393 13.8514 0 0 0 0
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124 1 1 1 -0.387789 14.386 0 0 0 0
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125 1 1 1 3.12268 12.3084 0 0 0 0
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126 1 1 1 0.146776 14.9812 0 0 0 0
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127 1 1 1 -2.81954 14.3053 0 0 0 0
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128 1 1 1 -2.15926 13.8536 0 0 0 0
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129 1 1 1 -1.49898 13.4019 0 0 0 0
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130 1 1 1 -0.838706 12.9502 0 0 0 0
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131 1 1 1 -0.17843 12.4985 0 0 0 0
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132 1 1 1 0.481847 12.0468 0 0 0 0
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133 1 1 1 -1.91613 15.6259 0 0 0 0
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134 1 1 1 -1.25586 15.1742 0 0 0 0
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135 1 1 1 -0.595579 14.7225 0 0 0 0
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136 1 1 1 0.0646978 14.2708 0 0 0 0
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137 1 1 1 0.724974 13.8191 0 0 0 0
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138 1 1 1 1.38525 13.3674 0 0 0 0
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139 1 1 1 -2.36783 14.9656 0 0 0 0
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140 1 1 1 0.933549 12.7071 0 0 0 0
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141 1 1 1 16.2388 -0.788805 0 0 0 0
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142 1 1 1 15.6257 -1.30272 0 0 0 0
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143 1 1 1 15.0126 -1.81663 0 0 0 0
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144 1 1 1 14.3995 -2.33054 0 0 0 0
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145 1 1 1 13.7864 -2.84446 0 0 0 0
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146 1 1 1 13.1733 -3.35837 0 0 0 0
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147 1 1 1 17.2666 -2.01501 0 0 0 0
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148 1 1 1 16.6535 -2.52892 0 0 0 0
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149 1 1 1 16.0404 -3.04283 0 0 0 0
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150 1 1 1 15.4273 -3.55675 0 0 0 0
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151 1 1 1 14.8142 -4.07066 0 0 0 0
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152 1 1 1 14.2011 -4.58457 0 0 0 0
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153 1 1 1 16.7527 -1.40191 0 0 0 0
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154 1 1 1 13.6872 -3.97147 0 0 0 0
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155 1 1 1 -5.60482 -8.31138 0 0 0 0
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156 1 1 1 -4.83946 -8.0785 0 0 0 0
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157 1 1 1 -4.07411 -7.84562 0 0 0 0
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158 1 1 1 -3.30876 -7.61274 0 0 0 0
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159 1 1 1 -2.5434 -7.37985 0 0 0 0
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160 1 1 1 -1.77805 -7.14697 0 0 0 0
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161 1 1 1 -6.07058 -6.78067 0 0 0 0
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162 1 1 1 -5.30523 -6.54779 0 0 0 0
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163 1 1 1 -4.53987 -6.31491 0 0 0 0
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164 1 1 1 -3.77452 -6.08203 0 0 0 0
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165 1 1 1 -3.00917 -5.84915 0 0 0 0
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166 1 1 1 -2.24381 -5.61627 0 0 0 0
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167 1 1 1 -5.8377 -7.54603 0 0 0 0
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168 1 1 1 -2.01093 -6.38162 0 0 0 0
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169 1 1 1 -12.5302 -3.5347 0 0 0 0
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170 1 1 1 -11.8187 -3.16901 0 0 0 0
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171 1 1 1 -11.1071 -2.80332 0 0 0 0
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172 1 1 1 -10.3956 -2.43763 0 0 0 0
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173 1 1 1 -9.68409 -2.07195 0 0 0 0
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174 1 1 1 -8.97256 -1.70626 0 0 0 0
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175 1 1 1 -13.2616 -2.11164 0 0 0 0
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176 1 1 1 -12.5501 -1.74596 0 0 0 0
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177 1 1 1 -11.8385 -1.38027 0 0 0 0
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178 1 1 1 -11.127 -1.01458 0 0 0 0
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179 1 1 1 -10.4155 -0.64889 0 0 0 0
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180 1 1 1 -9.70394 -0.283201 0 0 0 0
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181 1 1 1 -12.8959 -2.82317 0 0 0 0
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182 1 1 1 -9.33825 -0.994729 0 0 0 0
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183 1 1 1 7.74782 -4.57812 0 0 0 0
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184 1 1 1 8.54746 -4.60217 0 0 0 0
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185 1 1 1 9.3471 -4.62621 0 0 0 0
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186 1 1 1 10.1467 -4.65025 0 0 0 0
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187 1 1 1 10.9464 -4.6743 0 0 0 0
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188 1 1 1 11.746 -4.69834 0 0 0 0
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189 1 1 1 7.7959 -2.97885 0 0 0 0
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190 1 1 1 8.59554 -3.00289 0 0 0 0
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191 1 1 1 9.39518 -3.02693 0 0 0 0
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192 1 1 1 10.1948 -3.05098 0 0 0 0
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193 1 1 1 10.9945 -3.07502 0 0 0 0
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194 1 1 1 11.7941 -3.09906 0 0 0 0
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195 1 1 1 7.77186 -3.77849 0 0 0 0
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196 1 1 1 11.7701 -3.8987 0 0 0 0
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197 1 1 1 -17.1956 1.63592 0 0 0 0
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198 1 1 1 -16.5789 2.14546 0 0 0 0
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199 1 1 1 -15.9621 2.65499 0 0 0 0
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200 1 1 1 -15.3454 3.16452 0 0 0 0
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201 1 1 1 -14.7286 3.67405 0 0 0 0
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202 1 1 1 -14.1119 4.18358 0 0 0 0
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203 1 1 1 -18.2147 2.86942 0 0 0 0
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204 1 1 1 -17.5979 3.37895 0 0 0 0
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205 1 1 1 -16.9812 3.88848 0 0 0 0
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206 1 1 1 -16.3644 4.39801 0 0 0 0
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207 1 1 1 -15.7477 4.90755 0 0 0 0
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208 1 1 1 -15.1309 5.41708 0 0 0 0
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209 1 1 1 -17.7051 2.25267 0 0 0 0
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210 1 1 1 -14.6214 4.80033 0 0 0 0
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211 1 1 1 -7.81635 1.49637 0 0 0 0
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212 1 1 1 -8.55073 1.17906 0 0 0 0
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213 1 1 1 -9.28511 0.861744 0 0 0 0
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214 1 1 1 -10.0195 0.544431 0 0 0 0
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215 1 1 1 -10.7539 0.227118 0 0 0 0
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216 1 1 1 -11.4882 -0.0901943 0 0 0 0
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217 1 1 1 -7.18172 0.0276114 0 0 0 0
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218 1 1 1 -7.9161 -0.289701 0 0 0 0
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219 1 1 1 -8.65048 -0.607014 0 0 0 0
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220 1 1 1 -9.38486 -0.924327 0 0 0 0
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221 1 1 1 -10.1192 -1.24164 0 0 0 0
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222 1 1 1 -10.8536 -1.55895 0 0 0 0
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223 1 1 1 -7.49904 0.761991 0 0 0 0
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224 1 1 1 -11.1709 -0.824573 0 0 0 0
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225 1 1 1 -4.61538 3.66024 0 0 0 0
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226 1 1 1 -5.09771 3.022 0 0 0 0
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227 1 1 1 -5.58005 2.38376 0 0 0 0
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228 1 1 1 -6.06238 1.74552 0 0 0 0
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229 1 1 1 -6.54472 1.10728 0 0 0 0
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230 1 1 1 -7.02706 0.469034 0 0 0 0
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231 1 1 1 -3.33889 2.69557 0 0 0 0
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232 1 1 1 -3.82123 2.05733 0 0 0 0
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233 1 1 1 -4.30357 1.41909 0 0 0 0
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234 1 1 1 -4.7859 0.780844 0 0 0 0
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235 1 1 1 -5.26824 0.142603 0 0 0 0
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236 1 1 1 -5.75057 -0.495638 0 0 0 0
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237 1 1 1 -3.97713 3.1779 0 0 0 0
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238 1 1 1 -6.38882 -0.0133018 0 0 0 0
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239 1 1 1 7.23353 5.22432 0 0 0 0
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240 1 1 1 6.60327 4.7316 0 0 0 0
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241 1 1 1 5.97301 4.23888 0 0 0 0
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242 1 1 1 5.34275 3.74616 0 0 0 0
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243 1 1 1 4.71249 3.25345 0 0 0 0
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244 1 1 1 4.08223 2.76073 0 0 0 0
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245 1 1 1 8.21897 3.96379 0 0 0 0
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246 1 1 1 7.58871 3.47108 0 0 0 0
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247 1 1 1 6.95845 2.97836 0 0 0 0
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248 1 1 1 6.32818 2.48564 0 0 0 0
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249 1 1 1 5.69792 1.99292 0 0 0 0
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250 1 1 1 5.06766 1.50021 0 0 0 0
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251 1 1 1 7.72625 4.59406 0 0 0 0
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252 1 1 1 4.57494 2.13047 0 0 0 0
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253 1 1 1 -6.11367 16.186 0 0 0 0
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254 1 1 1 -6.91119 16.123 0 0 0 0
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255 1 1 1 -7.7087 16.06 0 0 0 0
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256 1 1 1 -8.50621 15.997 0 0 0 0
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257 1 1 1 -9.30373 15.9339 0 0 0 0
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258 1 1 1 -10.1012 15.8709 0 0 0 0
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259 1 1 1 -5.98763 14.591 0 0 0 0
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260 1 1 1 -6.78514 14.528 0 0 0 0
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261 1 1 1 -7.58265 14.4649 0 0 0 0
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262 1 1 1 -8.38017 14.4019 0 0 0 0
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263 1 1 1 -9.17768 14.3389 0 0 0 0
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264 1 1 1 -9.97519 14.2759 0 0 0 0
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265 1 1 1 -6.05065 15.3885 0 0 0 0
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266 1 1 1 -10.0382 15.0734 0 0 0 0
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267 1 1 1 -2.11365 8.3904 0 0 0 0
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268 1 1 1 -2.85146 8.69966 0 0 0 0
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269 1 1 1 -3.58926 9.00892 0 0 0 0
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270 1 1 1 -4.32707 9.31818 0 0 0 0
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271 1 1 1 -5.06488 9.62744 0 0 0 0
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272 1 1 1 -5.80268 9.9367 0 0 0 0
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273 1 1 1 -2.73217 6.91479 0 0 0 0
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274 1 1 1 -3.46998 7.22405 0 0 0 0
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275 1 1 1 -4.20779 7.53331 0 0 0 0
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276 1 1 1 -4.94559 7.84257 0 0 0 0
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277 1 1 1 -5.6834 8.15183 0 0 0 0
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278 1 1 1 -6.4212 8.46109 0 0 0 0
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279 1 1 1 -2.42291 7.65259 0 0 0 0
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280 1 1 1 -6.11194 9.19889 0 0 0 0
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281 1 1 1 -9.72915 16.046 0 0 0 0
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282 1 1 1 -10.3097 15.4955 0 0 0 0
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283 1 1 1 -10.8902 14.9451 0 0 0 0
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284 1 1 1 -11.4706 14.3946 0 0 0 0
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285 1 1 1 -12.0511 13.8441 0 0 0 0
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286 1 1 1 -12.6316 13.2936 0 0 0 0
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287 1 1 1 -8.62821 14.885 0 0 0 0
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288 1 1 1 -9.2087 14.3345 0 0 0 0
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289 1 1 1 -9.7892 13.7841 0 0 0 0
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290 1 1 1 -10.3697 13.2336 0 0 0 0
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291 1 1 1 -10.9502 12.6831 0 0 0 0
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292 1 1 1 -11.5307 12.1326 0 0 0 0
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293 1 1 1 -9.17868 15.4655 0 0 0 0
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294 1 1 1 -12.0812 12.7131 0 0 0 0
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295 1 1 1 5.72033 -3.07105 0 0 0 0
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296 1 1 1 6.51888 -3.02294 0 0 0 0
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297 1 1 1 7.31743 -2.97482 0 0 0 0
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298 1 1 1 8.11598 -2.92671 0 0 0 0
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299 1 1 1 8.91454 -2.8786 0 0 0 0
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300 1 1 1 9.71309 -2.83049 0 0 0 0
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301 1 1 1 5.62411 -1.47394 0 0 0 0
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302 1 1 1 6.42266 -1.42583 0 0 0 0
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303 1 1 1 7.22121 -1.37772 0 0 0 0
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304 1 1 1 8.01976 -1.32961 0 0 0 0
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305 1 1 1 8.81831 -1.2815 0 0 0 0
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306 1 1 1 9.61687 -1.23338 0 0 0 0
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307 1 1 1 5.67222 -2.27249 0 0 0 0
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308 1 1 1 9.66498 -2.03194 0 0 0 0
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309 1 1 1 15.2831 18.234 0 0 0 0
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310 1 1 1 14.9534 18.9629 0 0 0 0
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311 1 1 1 14.6237 -18.5976 0 0 1 0
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312 1 1 1 14.2939 -17.8687 0 0 1 0
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313 1 1 1 13.9642 -17.1398 0 0 1 0
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314 1 1 1 13.6345 -16.4109 0 0 1 0
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315 1 1 1 13.8253 17.5745 0 0 0 0
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316 1 1 1 13.4956 18.3034 0 0 0 0
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317 1 1 1 13.1659 19.0323 0 0 0 0
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318 1 1 1 12.8361 -18.5282 0 0 1 0
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319 1 1 1 12.5064 -17.7993 0 0 1 0
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320 1 1 1 12.1767 -17.0704 0 0 1 0
|
|
321 1 1 1 14.5542 17.9043 0 0 0 0
|
|
322 1 1 1 12.9056 -16.7407 0 0 1 0
|
|
323 1 1 1 2.47062 17.9997 0 0 0 0
|
|
324 1 1 1 2.25129 17.2303 0 0 0 0
|
|
325 1 1 1 2.03196 16.461 0 0 0 0
|
|
326 1 1 1 1.81263 15.6916 0 0 0 0
|
|
327 1 1 1 1.59329 14.9223 0 0 0 0
|
|
328 1 1 1 1.37396 14.1529 0 0 0 0
|
|
329 1 1 1 4.00931 17.561 0 0 0 0
|
|
330 1 1 1 3.78998 16.7917 0 0 0 0
|
|
331 1 1 1 3.57065 16.0223 0 0 0 0
|
|
332 1 1 1 3.35132 15.253 0 0 0 0
|
|
333 1 1 1 3.13199 14.4836 0 0 0 0
|
|
334 1 1 1 2.91266 13.7143 0 0 0 0
|
|
335 1 1 1 3.23997 17.7803 0 0 0 0
|
|
336 1 1 1 2.14331 13.9336 0 0 0 0
|
|
337 1 1 1 15.0414 14.311 0 0 0 0
|
|
338 1 1 1 14.3946 13.8403 0 0 0 0
|
|
339 1 1 1 13.7477 13.3696 0 0 0 0
|
|
340 1 1 1 13.1009 12.8988 0 0 0 0
|
|
341 1 1 1 12.454 12.4281 0 0 0 0
|
|
342 1 1 1 11.8072 11.9574 0 0 0 0
|
|
343 1 1 1 15.9829 13.0173 0 0 0 0
|
|
344 1 1 1 15.336 12.5466 0 0 0 0
|
|
345 1 1 1 14.6892 12.0759 0 0 0 0
|
|
346 1 1 1 14.0423 11.6051 0 0 0 0
|
|
347 1 1 1 13.3955 11.1344 0 0 0 0
|
|
348 1 1 1 12.7486 10.6637 0 0 0 0
|
|
349 1 1 1 15.5121 13.6642 0 0 0 0
|
|
350 1 1 1 12.2779 11.3105 0 0 0 0
|
|
351 1 1 1 18.9199 -6.6268 0 0 0 0
|
|
352 1 1 1 18.1207 -6.66214 0 0 0 0
|
|
353 1 1 1 17.3215 -6.69749 0 0 0 0
|
|
354 1 1 1 16.5222 -6.73284 0 0 0 0
|
|
355 1 1 1 15.723 -6.76818 0 0 0 0
|
|
356 1 1 1 14.9238 -6.80353 0 0 0 0
|
|
357 1 1 1 18.9906 -8.22523 0 0 0 0
|
|
358 1 1 1 18.1914 -8.26058 0 0 0 0
|
|
359 1 1 1 17.3922 -8.29593 0 0 0 0
|
|
360 1 1 1 16.5929 -8.33127 0 0 0 0
|
|
361 1 1 1 15.7937 -8.36662 0 0 0 0
|
|
362 1 1 1 14.9945 -8.40197 0 0 0 0
|
|
363 1 1 1 18.9552 -7.42601 0 0 0 0
|
|
364 1 1 1 14.9591 -7.60275 0 0 0 0
|
|
365 1 1 1 9.86402 -8.4027 0 0 0 0
|
|
366 1 1 1 9.55201 -7.66605 0 0 0 0
|
|
367 1 1 1 9.24 -6.9294 0 0 0 0
|
|
368 1 1 1 8.92799 -6.19276 0 0 0 0
|
|
369 1 1 1 8.61599 -5.45611 0 0 0 0
|
|
370 1 1 1 8.30398 -4.71946 0 0 0 0
|
|
371 1 1 1 8.39073 -9.02672 0 0 0 0
|
|
372 1 1 1 8.07872 -8.29007 0 0 0 0
|
|
373 1 1 1 7.76671 -7.55342 0 0 0 0
|
|
374 1 1 1 7.4547 -6.81677 0 0 0 0
|
|
375 1 1 1 7.14269 -6.08013 0 0 0 0
|
|
376 1 1 1 6.83068 -5.34348 0 0 0 0
|
|
377 1 1 1 9.12737 -8.71471 0 0 0 0
|
|
378 1 1 1 7.56733 -5.03147 0 0 0 0
|
|
379 1 1 1 -16.2195 -19.1437 0 0 0 0
|
|
380 1 1 1 -15.7317 18.5116 0 0 -1 0
|
|
381 1 1 1 -15.244 17.8775 0 0 -1 0
|
|
382 1 1 1 -14.7562 17.2434 0 0 -1 0
|
|
383 1 1 1 -14.2684 16.6093 0 0 -1 0
|
|
384 1 1 1 -13.7806 15.9752 0 0 -1 0
|
|
385 1 1 1 -14.9513 -18.1681 0 0 0 0
|
|
386 1 1 1 -14.4635 -18.8022 0 0 0 0
|
|
387 1 1 1 -13.9758 18.853 0 0 -1 0
|
|
388 1 1 1 -13.488 18.2189 0 0 -1 0
|
|
389 1 1 1 -13.0002 17.5849 0 0 -1 0
|
|
390 1 1 1 -12.5124 16.9508 0 0 -1 0
|
|
391 1 1 1 -15.5854 -18.6559 0 0 0 0
|
|
392 1 1 1 -13.1465 16.463 0 0 -1 0
|
|
393 1 1 1 0.198913 11.9537 0 0 0 0
|
|
394 1 1 1 -0.594369 12.0571 0 0 0 0
|
|
395 1 1 1 -1.38765 12.1606 0 0 0 0
|
|
396 1 1 1 -2.18093 12.264 0 0 0 0
|
|
397 1 1 1 -2.97421 12.3675 0 0 0 0
|
|
398 1 1 1 -3.7675 12.471 0 0 0 0
|
|
399 1 1 1 -0.00800755 10.3671 0 0 0 0
|
|
400 1 1 1 -0.801289 10.4706 0 0 0 0
|
|
401 1 1 1 -1.59457 10.574 0 0 0 0
|
|
402 1 1 1 -2.38785 10.6775 0 0 0 0
|
|
403 1 1 1 -3.18113 10.7809 0 0 0 0
|
|
404 1 1 1 -3.97442 10.8844 0 0 0 0
|
|
405 1 1 1 0.0954527 11.1604 0 0 0 0
|
|
406 1 1 1 -3.87096 11.6777 0 0 0 0
|
|
407 1 1 1 -3.4936 18.9783 0 0 0 0
|
|
408 1 1 1 -3.96865 -18.6674 0 0 1 0
|
|
409 1 1 1 -4.44369 -18.0237 0 0 1 0
|
|
410 1 1 1 -4.91874 -17.38 0 0 1 0
|
|
411 1 1 1 -5.39379 -16.7363 0 0 1 0
|
|
412 1 1 1 -5.86883 -16.0927 0 0 1 0
|
|
413 1 1 1 -4.78097 18.0282 0 0 0 0
|
|
414 1 1 1 -5.25602 18.6719 0 0 0 0
|
|
415 1 1 1 -5.73106 -18.9738 0 0 1 0
|
|
416 1 1 1 -6.20611 -18.3301 0 0 1 0
|
|
417 1 1 1 -6.68116 -17.6864 0 0 1 0
|
|
418 1 1 1 -7.1562 -17.0427 0 0 1 0
|
|
419 1 1 1 -4.13728 18.5033 0 0 0 0
|
|
420 1 1 1 -6.51252 -16.5677 0 0 1 0
|
|
|
|
Molecules
|
|
|
|
1 1
|
|
2 1
|
|
3 1
|
|
4 1
|
|
5 1
|
|
6 1
|
|
7 1
|
|
8 1
|
|
9 1
|
|
10 1
|
|
11 1
|
|
12 1
|
|
13 1
|
|
14 1
|
|
15 2
|
|
16 2
|
|
17 2
|
|
18 2
|
|
19 2
|
|
20 2
|
|
21 2
|
|
22 2
|
|
23 2
|
|
24 2
|
|
25 2
|
|
26 2
|
|
27 2
|
|
28 2
|
|
29 3
|
|
30 3
|
|
31 3
|
|
32 3
|
|
33 3
|
|
34 3
|
|
35 3
|
|
36 3
|
|
37 3
|
|
38 3
|
|
39 3
|
|
40 3
|
|
41 3
|
|
42 3
|
|
43 4
|
|
44 4
|
|
45 4
|
|
46 4
|
|
47 4
|
|
48 4
|
|
49 4
|
|
50 4
|
|
51 4
|
|
52 4
|
|
53 4
|
|
54 4
|
|
55 4
|
|
56 4
|
|
57 5
|
|
58 5
|
|
59 5
|
|
60 5
|
|
61 5
|
|
62 5
|
|
63 5
|
|
64 5
|
|
65 5
|
|
66 5
|
|
67 5
|
|
68 5
|
|
69 5
|
|
70 5
|
|
71 6
|
|
72 6
|
|
73 6
|
|
74 6
|
|
75 6
|
|
76 6
|
|
77 6
|
|
78 6
|
|
79 6
|
|
80 6
|
|
81 6
|
|
82 6
|
|
83 6
|
|
84 6
|
|
85 7
|
|
86 7
|
|
87 7
|
|
88 7
|
|
89 7
|
|
90 7
|
|
91 7
|
|
92 7
|
|
93 7
|
|
94 7
|
|
95 7
|
|
96 7
|
|
97 7
|
|
98 7
|
|
99 8
|
|
100 8
|
|
101 8
|
|
102 8
|
|
103 8
|
|
104 8
|
|
105 8
|
|
106 8
|
|
107 8
|
|
108 8
|
|
109 8
|
|
110 8
|
|
111 8
|
|
112 8
|
|
113 9
|
|
114 9
|
|
115 9
|
|
116 9
|
|
117 9
|
|
118 9
|
|
119 9
|
|
120 9
|
|
121 9
|
|
122 9
|
|
123 9
|
|
124 9
|
|
125 9
|
|
126 9
|
|
127 10
|
|
128 10
|
|
129 10
|
|
130 10
|
|
131 10
|
|
132 10
|
|
133 10
|
|
134 10
|
|
135 10
|
|
136 10
|
|
137 10
|
|
138 10
|
|
139 10
|
|
140 10
|
|
141 11
|
|
142 11
|
|
143 11
|
|
144 11
|
|
145 11
|
|
146 11
|
|
147 11
|
|
148 11
|
|
149 11
|
|
150 11
|
|
151 11
|
|
152 11
|
|
153 11
|
|
154 11
|
|
155 12
|
|
156 12
|
|
157 12
|
|
158 12
|
|
159 12
|
|
160 12
|
|
161 12
|
|
162 12
|
|
163 12
|
|
164 12
|
|
165 12
|
|
166 12
|
|
167 12
|
|
168 12
|
|
169 13
|
|
170 13
|
|
171 13
|
|
172 13
|
|
173 13
|
|
174 13
|
|
175 13
|
|
176 13
|
|
177 13
|
|
178 13
|
|
179 13
|
|
180 13
|
|
181 13
|
|
182 13
|
|
183 14
|
|
184 14
|
|
185 14
|
|
186 14
|
|
187 14
|
|
188 14
|
|
189 14
|
|
190 14
|
|
191 14
|
|
192 14
|
|
193 14
|
|
194 14
|
|
195 14
|
|
196 14
|
|
197 15
|
|
198 15
|
|
199 15
|
|
200 15
|
|
201 15
|
|
202 15
|
|
203 15
|
|
204 15
|
|
205 15
|
|
206 15
|
|
207 15
|
|
208 15
|
|
209 15
|
|
210 15
|
|
211 16
|
|
212 16
|
|
213 16
|
|
214 16
|
|
215 16
|
|
216 16
|
|
217 16
|
|
218 16
|
|
219 16
|
|
220 16
|
|
221 16
|
|
222 16
|
|
223 16
|
|
224 16
|
|
225 17
|
|
226 17
|
|
227 17
|
|
228 17
|
|
229 17
|
|
230 17
|
|
231 17
|
|
232 17
|
|
233 17
|
|
234 17
|
|
235 17
|
|
236 17
|
|
237 17
|
|
238 17
|
|
239 18
|
|
240 18
|
|
241 18
|
|
242 18
|
|
243 18
|
|
244 18
|
|
245 18
|
|
246 18
|
|
247 18
|
|
248 18
|
|
249 18
|
|
250 18
|
|
251 18
|
|
252 18
|
|
253 19
|
|
254 19
|
|
255 19
|
|
256 19
|
|
257 19
|
|
258 19
|
|
259 19
|
|
260 19
|
|
261 19
|
|
262 19
|
|
263 19
|
|
264 19
|
|
265 19
|
|
266 19
|
|
267 20
|
|
268 20
|
|
269 20
|
|
270 20
|
|
271 20
|
|
272 20
|
|
273 20
|
|
274 20
|
|
275 20
|
|
276 20
|
|
277 20
|
|
278 20
|
|
279 20
|
|
280 20
|
|
281 21
|
|
282 21
|
|
283 21
|
|
284 21
|
|
285 21
|
|
286 21
|
|
287 21
|
|
288 21
|
|
289 21
|
|
290 21
|
|
291 21
|
|
292 21
|
|
293 21
|
|
294 21
|
|
295 22
|
|
296 22
|
|
297 22
|
|
298 22
|
|
299 22
|
|
300 22
|
|
301 22
|
|
302 22
|
|
303 22
|
|
304 22
|
|
305 22
|
|
306 22
|
|
307 22
|
|
308 22
|
|
309 23
|
|
310 23
|
|
311 23
|
|
312 23
|
|
313 23
|
|
314 23
|
|
315 23
|
|
316 23
|
|
317 23
|
|
318 23
|
|
319 23
|
|
320 23
|
|
321 23
|
|
322 23
|
|
323 24
|
|
324 24
|
|
325 24
|
|
326 24
|
|
327 24
|
|
328 24
|
|
329 24
|
|
330 24
|
|
331 24
|
|
332 24
|
|
333 24
|
|
334 24
|
|
335 24
|
|
336 24
|
|
337 25
|
|
338 25
|
|
339 25
|
|
340 25
|
|
341 25
|
|
342 25
|
|
343 25
|
|
344 25
|
|
345 25
|
|
346 25
|
|
347 25
|
|
348 25
|
|
349 25
|
|
350 25
|
|
351 26
|
|
352 26
|
|
353 26
|
|
354 26
|
|
355 26
|
|
356 26
|
|
357 26
|
|
358 26
|
|
359 26
|
|
360 26
|
|
361 26
|
|
362 26
|
|
363 26
|
|
364 26
|
|
365 27
|
|
366 27
|
|
367 27
|
|
368 27
|
|
369 27
|
|
370 27
|
|
371 27
|
|
372 27
|
|
373 27
|
|
374 27
|
|
375 27
|
|
376 27
|
|
377 27
|
|
378 27
|
|
379 28
|
|
380 28
|
|
381 28
|
|
382 28
|
|
383 28
|
|
384 28
|
|
385 28
|
|
386 28
|
|
387 28
|
|
388 28
|
|
389 28
|
|
390 28
|
|
391 28
|
|
392 28
|
|
393 29
|
|
394 29
|
|
395 29
|
|
396 29
|
|
397 29
|
|
398 29
|
|
399 29
|
|
400 29
|
|
401 29
|
|
402 29
|
|
403 29
|
|
404 29
|
|
405 29
|
|
406 29
|
|
407 30
|
|
408 30
|
|
409 30
|
|
410 30
|
|
411 30
|
|
412 30
|
|
413 30
|
|
414 30
|
|
415 30
|
|
416 30
|
|
417 30
|
|
418 30
|
|
419 30
|
|
420 30
|