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"structure_string": "Sc2 H2 Cl2\n1.0\n3.408631 -0.009851 8.344474\n1.630598 2.993328 8.344474\n-0.016639 -0.009851 9.013809\nSc H Cl\n2 2 2\ndirect\n0.881390 0.881392 0.881390 Sc\n0.118609 0.118609 0.118609 Sc\n0.805255 0.805257 0.805255 H\n0.194744 0.194744 0.194744 H\n0.390836 0.390837 0.390836 Cl\n0.609163 0.609165 0.609163 Cl\n",
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"created_at": "2022-09-04T14:36:07.220489Z",
"updated_at": "2022-09-04T14:36:07.220514Z",
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"updated_at": "2022-09-04T14:36:07.218254Z",
"structure_string": "Hg2 C2 S2 O6 F6\n1.0\n5.063436 -0.023830 -0.648383\n-0.398868 5.220199 -0.398288\n-0.083572 0.333487 9.881507\nHg C S O F\n2 2 2 6 6\ndirect\n0.168195 0.133207 0.587181 Hg\n0.831805 0.866794 0.412820 Hg\n0.335397 0.238912 0.126831 C\n0.664604 0.761088 0.873169 C\n0.355123 0.434359 0.290239 S\n0.644877 0.565642 0.709761 S\n0.082863 0.476359 0.304729 O\n0.917137 0.523642 0.695271 O\n0.507774 0.719654 0.607604 O\n0.515222 0.669029 0.262339 O\n0.484779 0.330971 0.737661 O\n0.492227 0.280347 0.392397 O\n0.169301 0.028930 0.132711 F\n0.579382 0.167386 0.112291 F\n0.243357 0.370949 0.019268 F\n0.830700 -0.028929 0.867289 F\n0.756643 0.629052 0.980733 F\n0.420618 0.832615 0.887710 F\n",
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"structure_string": "K1 Br1 O3\n1.0\n4.372880 0.015920 0.322818\n0.301032 4.362535 0.322818\n0.016994 0.015920 4.384746\nK Br O\n1 1 3\ndirect\n0.019467 0.019467 0.019467 K\n0.506243 0.506244 0.506245 Br\n0.121788 0.568751 0.568751 O\n0.568750 0.568751 0.121789 O\n0.568750 0.121789 0.568751 O\n",
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{
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"structure_string": "La2 Ru4\n1.0\n4.726816 0.000000 2.729029\n1.575605 4.456485 2.729029\n-0.000000 -0.000000 5.458057\nLa Ru\n2 4\ndirect\n0.125000 0.125000 0.125000 La\n0.875002 0.874999 0.875000 La\n0.500000 0.000000 0.500000 Ru\n0.000001 0.499999 0.500000 Ru\n0.500001 0.499999 0.500000 Ru\n0.500001 0.499999 -0.000000 Ru\n",
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