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{
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{
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{
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"structure_string": "Zr4 Sn4 H16 N4 F28\n1.0\n8.610448 0.000000 0.000000\n0.000000 6.224934 0.000000\n0.000000 0.000000 12.733311\nZr Sn H N F\n4 4 16 4 28\ndirect\n0.000000 0.248568 0.918869 Zr\n0.000000 0.751432 0.081131 Zr\n0.500000 0.248568 0.581131 Zr\n0.500000 0.751432 0.418869 Zr\n0.000000 0.229392 0.596556 Sn\n0.000000 0.770608 0.403444 Sn\n0.500000 0.229392 0.903444 Sn\n0.500000 0.770608 0.096556 Sn\n0.161460 0.654494 0.781856 H\n0.161460 0.345506 0.218144 H\n0.338540 0.654494 0.718144 H\n0.338540 0.345506 0.281856 H\n0.838540 0.345506 0.218144 H\n0.838540 0.654494 0.781856 H\n0.661460 0.345506 0.281856 H\n0.661460 0.654494 0.718144 H\n0.202602 0.844449 0.692516 H\n0.202602 0.155551 0.307484 H\n0.297398 0.844449 0.807484 H\n0.297398 0.155551 0.192516 H\n0.797398 0.155551 0.307484 H\n0.797398 0.844449 0.692516 H\n0.702602 0.155551 0.192516 H\n0.702602 0.844449 0.807484 H\n0.250000 0.748285 0.750000 N\n0.250000 0.251715 0.250000 N\n0.750000 0.251715 0.250000 N\n0.750000 0.748285 0.750000 N\n0.139421 0.500000 0.000000 F\n0.360579 0.500000 0.500000 F\n0.860579 0.500000 0.000000 F\n0.639421 0.500000 0.500000 F\n0.000000 0.123426 0.071628 F\n0.000000 0.876574 0.928372 F\n0.500000 0.123426 0.428372 F\n0.500000 0.876574 0.571628 F\n0.000000 0.499242 0.810168 F\n0.000000 0.500758 0.189832 F\n0.500000 0.499242 0.689832 F\n0.500000 0.500758 0.310168 F\n0.000000 0.108318 0.763450 F\n0.000000 0.891682 0.236550 F\n0.500000 0.108318 0.736550 F\n0.500000 0.891682 0.263450 F\n0.231703 0.164281 0.895113 F\n0.231703 0.835719 0.104887 F\n0.268297 0.164281 0.604887 F\n0.268297 0.835719 0.395113 F\n0.768297 0.835719 0.104887 F\n0.768297 0.164281 0.895113 F\n0.731703 0.835719 0.395113 F\n0.731703 0.164281 0.604887 F\n0.000000 0.885781 0.587013 F\n0.000000 0.114219 0.412987 F\n0.500000 0.885781 0.912987 F\n0.500000 0.114219 0.087013 F\n",
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{
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"structure_string": "Re8 C12 I16 O12\n1.0\n4.405480 11.330925 0.000000\n-4.405480 11.330925 0.000000\n0.000000 1.361554 12.803688\nRe C I O\n8 12 16 12\ndirect\n0.370969 0.644842 0.835932 Re\n0.004197 0.318844 0.245279 Re\n0.681156 0.995803 0.254721 Re\n0.629031 0.355158 0.164068 Re\n0.995803 0.681156 0.754721 Re\n0.355158 0.629031 0.664068 Re\n0.644842 0.370969 0.335932 Re\n0.318844 0.004197 0.745279 Re\n0.014247 0.451513 0.164129 C\n0.985753 0.548487 0.835871 C\n0.126111 0.216784 0.692911 C\n0.548487 0.985753 0.335871 C\n0.092484 0.317493 0.361642 C\n0.682507 0.907516 0.138358 C\n0.216784 0.126111 0.192911 C\n0.317493 0.092484 0.861642 C\n0.451513 0.014247 0.664129 C\n0.873889 0.783216 0.307089 C\n0.783216 0.873889 0.807089 C\n0.907516 0.682507 0.638358 C\n0.342013 0.853076 0.574956 I\n0.669748 0.380315 0.603913 I\n0.024010 0.870738 0.637686 I\n0.330252 0.619685 0.396087 I\n0.129262 0.975990 0.862314 I\n0.975990 0.129262 0.362314 I\n0.324855 0.424673 0.673017 I\n0.146924 0.657987 0.925044 I\n0.424673 0.324855 0.173017 I\n0.870738 0.024010 0.137686 I\n0.575327 0.675145 0.826983 I\n0.853076 0.342013 0.074956 I\n0.675145 0.575327 0.326983 I\n0.380315 0.669748 0.103913 I\n0.657987 0.146924 0.425044 I\n0.619685 0.330252 0.896087 I\n0.470260 0.975495 0.385747 O\n0.681813 0.854092 0.068413 O\n0.024505 0.529740 0.114253 O\n0.006789 0.346503 0.662216 O\n0.318187 0.145908 0.931587 O\n0.653497 0.993211 0.837784 O\n0.145908 0.318187 0.431587 O\n0.346503 0.006789 0.162216 O\n0.529740 0.024505 0.614253 O\n0.975495 0.470260 0.885747 O\n0.993211 0.653497 0.337784 O\n0.854092 0.681813 0.568413 O\n",
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{
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{
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{
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