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{
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{
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{
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{
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{
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{
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"structure_string": "Ni1 H44 C12 N8 Cl2 O10\n1.0\n9.399677 0.000000 0.000000\n-1.834623 9.269719 0.000000\n-0.654540 -4.908584 8.112896\nNi H C N Cl O\n1 44 12 8 2 10\ndirect\n0.000000 0.000000 0.000000 Ni\n0.863511 0.708991 0.186965 H\n0.136489 0.291009 0.813035 H\n0.806578 0.833988 0.220190 H\n0.193422 0.166012 0.779810 H\n0.876343 0.058112 0.679259 H\n0.123657 0.941888 0.320741 H\n0.807421 0.883502 0.803304 H\n0.192579 0.116498 0.196696 H\n0.796915 0.233396 0.854730 H\n0.203085 0.766604 0.145270 H\n0.881106 0.220023 0.029198 H\n0.118894 0.779977 0.970802 H\n0.548166 0.315905 0.672483 H\n0.451834 0.684095 0.327517 H\n0.667543 0.465853 0.628952 H\n0.332457 0.534147 0.371048 H\n0.588435 0.722589 0.777319 H\n0.411565 0.277411 0.222681 H\n0.704408 0.729537 0.680568 H\n0.295592 0.270463 0.319432 H\n0.985298 0.822169 0.625447 H\n0.014702 0.177831 0.374553 H\n0.143735 0.962538 0.630092 H\n0.856265 0.037462 0.369908 H\n0.362050 0.944981 0.561696 H\n0.637950 0.055019 0.438304 H\n0.369835 0.795813 0.499255 H\n0.630165 0.204187 0.500745 H\n0.361458 0.649245 0.990807 H\n0.638542 0.350755 0.009193 H\n0.361436 0.862541 0.840428 H\n0.638564 0.137459 0.159572 H\n0.992063 0.623612 0.545521 H\n0.007937 0.376388 0.454479 H\n0.157125 0.609678 0.492138 H\n0.842875 0.390322 0.507862 H\n0.368855 0.448165 0.909917 H\n0.631145 0.551835 0.090083 H\n0.371825 0.510415 0.699482 H\n0.628175 0.489585 0.300518 H\n0.150973 0.466258 0.982113 H\n0.849027 0.533742 0.017887 H\n0.988979 0.541588 0.824918 H\n0.011021 0.458412 0.175082 H\n0.106508 0.836908 0.652054 C\n0.893492 0.163092 0.347946 C\n0.326200 0.819844 0.580845 C\n0.673800 0.180156 0.419155 C\n0.323189 0.737244 0.861408 C\n0.676811 0.262756 0.138592 C\n0.113537 0.634704 0.572911 C\n0.886463 0.365296 0.427089 C\n0.329378 0.535936 0.780823 C\n0.670622 0.464064 0.219177 C\n0.110227 0.553628 0.853375 C\n0.889773 0.446372 0.146625 C\n0.163008 0.804730 0.540554 N\n0.836992 0.195270 0.459446 N\n0.384221 0.703477 0.754067 N\n0.615779 0.296523 0.245933 N\n0.159761 0.722116 0.826878 N\n0.840239 0.277884 0.173122 N\n0.166217 0.515211 0.745954 N\n0.833783 0.484789 0.254046 N\n0.688905 0.734145 0.441411 Cl\n0.311095 0.265855 0.558589 Cl\n0.847303 0.826886 0.138550 O\n0.152697 0.173114 0.861450 O\n0.883650 0.975018 0.797822 O\n0.116350 0.024982 0.202178 O\n0.889061 0.198651 0.939401 O\n0.110939 0.801349 0.060599 O\n0.652681 0.347861 0.705792 O\n0.347319 0.652139 0.294208 O\n0.697336 0.728086 0.782777 O\n0.302664 0.271914 0.217223 O\n",
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{
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{
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{
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