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{
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{
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"structure_string": "H8 N4 O6\n1.0\n4.893891 0.000000 0.000000\n0.000000 5.414625 0.000000\n0.000000 0.000000 5.647464\nH N O\n8 4 6\ndirect\n0.555446 0.500000 0.150689 H\n0.310954 0.654245 0.000000 H\n0.310954 0.345756 0.000000 H\n0.689046 0.154245 0.500000 H\n0.555446 0.500000 0.849310 H\n0.444553 0.000000 0.349311 H\n0.444553 0.000000 0.650689 H\n0.689046 0.845756 0.500000 H\n0.965699 0.000000 0.000000 N\n0.565745 0.000000 0.500000 N\n0.034301 0.500000 0.500000 N\n0.434254 0.500000 0.000000 N\n0.707851 0.000000 0.000000 O\n0.904102 0.500000 0.694977 O\n0.095898 0.000000 0.194978 O\n0.095898 0.000000 0.805022 O\n0.292149 0.500000 0.500000 O\n0.904102 0.500000 0.305022 O\n",
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"updated_at": "2022-09-04T14:37:06.970626Z",
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"structure_string": "Ti2 O2 F2\n1.0\n4.017022 -0.000013 0.000001\n-0.000044 5.660426 -0.000019\n0.000001 -0.000005 3.058188\nTi O F\n2 2 2\ndirect\n0.250003 0.131145 0.750001 Ti\n0.749998 0.868856 0.249998 Ti\n0.249999 0.885827 0.249998 O\n0.750001 0.114176 0.750001 O\n0.250005 0.361658 0.250003 F\n0.749995 0.638344 0.749997 F\n",
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{
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}