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"structure_string": "Fe10 O14 F6\n1.0\n4.423078 0.009817 0.004475\n0.221604 4.479054 0.007492\n-0.004157 -0.073226 14.379554\nFe O F\n10 14 6\ndirect\n0.002464 0.003692 0.985335 Fe\n0.506290 0.502757 0.097962 Fe\n0.525298 0.545465 0.693574 Fe\n0.469387 0.471105 0.501289 Fe\n0.493182 0.506334 0.903355 Fe\n0.474189 0.475668 0.302673 Fe\n0.012972 0.014607 0.403272 Fe\n-0.001780 0.005108 0.602044 Fe\n0.014135 0.970590 0.804844 Fe\n0.010359 0.009577 0.207018 Fe\n0.711016 0.310290 -0.001093 O\n0.808236 0.822717 0.700683 O\n0.791987 0.805083 0.896714 O\n0.697574 0.307307 0.201424 O\n0.692634 0.299546 0.402690 O\n0.701559 0.312027 0.599287 O\n0.297282 0.687459 0.200959 O\n0.306479 0.681839 0.798524 O\n0.293693 0.697986 0.599718 O\n0.291565 0.697187 -0.001923 O\n0.197162 0.187424 0.305982 O\n0.193201 0.186272 0.501871 O\n0.214278 0.193166 0.896470 O\n0.286635 0.685704 0.402706 O\n0.807188 0.824903 0.094957 F\n0.213390 0.195550 0.700921 F\n0.200186 0.185580 0.091791 F\n0.717802 0.312027 0.798093 F\n0.788551 0.806176 0.502416 F\n0.783072 0.796837 0.306441 F\n",
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"structure_string": "Lu2 H2 Cl2\n1.0\n3.545998 -0.005763 8.484203\n1.697009 3.113566 8.484203\n-0.009723 -0.005763 9.195418\nLu H Cl\n2 2 2\ndirect\n0.882203 0.882205 0.882199 Lu\n0.117798 0.117798 0.117797 Lu\n0.803176 0.803178 0.803173 H\n0.196825 0.196825 0.196824 H\n0.388890 0.388891 0.388888 Cl\n0.611110 0.611112 0.611108 Cl\n",
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{
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"created_at": "2022-09-04T14:37:28.923974Z",
"updated_at": "2022-09-04T14:37:28.923994Z",
"structure_string": "Te8 O18\n1.0\n7.176592 -0.033676 1.191778\n1.004716 7.105994 1.191778\n-0.038956 -0.033676 7.274770\nTe O\n8 18\ndirect\n0.817837 0.817835 0.817837 Te\n0.182163 0.182163 0.182163 Te\n0.156081 0.701609 0.396155 Te\n0.396154 0.156080 0.701610 Te\n0.701610 0.396154 0.156081 Te\n0.843919 0.298390 0.603846 Te\n0.603846 0.843919 0.298391 Te\n0.298390 0.603844 0.843920 Te\n0.289907 0.776440 0.575308 O\n0.223559 0.424692 0.710094 O\n0.424693 0.710093 0.223560 O\n0.710093 0.223559 0.424693 O\n0.912739 0.717465 0.584581 O\n0.717466 0.584579 0.912739 O\n0.584581 0.912737 0.717467 O\n0.087262 0.282533 0.415420 O\n0.279991 0.064343 0.952235 O\n0.415419 0.087261 0.282534 O\n0.952235 0.279991 0.064344 O\n0.575307 0.289906 0.776441 O\n0.064344 0.952234 0.279992 O\n0.047765 0.720007 0.935657 O\n0.720009 0.935656 0.047766 O\n0.935656 0.047764 0.720009 O\n0.282534 0.415419 0.087262 O\n0.776441 0.575306 0.289907 O\n",
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"structure_string": "U2 Br8\n1.0\n7.011114 0.038819 0.437366\n0.352482 6.875575 1.578836\n0.048595 -0.029407 7.063092\nU Br\n2 8\ndirect\n0.438146 0.802447 0.802448 U\n0.561853 0.197552 0.197553 U\n0.333208 0.559051 0.174619 Br\n0.666791 0.825381 0.440950 Br\n0.756602 0.942147 0.942148 Br\n0.243397 0.057852 0.057853 Br\n0.855718 0.333515 0.333516 Br\n0.144281 0.666484 0.666485 Br\n0.333208 0.174618 0.559051 Br\n0.666791 0.440948 0.825382 Br\n",
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{
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"structure_string": "B3 As1\n1.0\n3.051027 0.027033 1.086846\n1.041404 -4.829059 0.075201\n-2.093177 -0.752476 -3.766753\nB As\n3 1\ndirect\n0.269586 0.917501 0.113576 B\n0.817838 0.846339 0.150065 B\n0.151539 0.731649 0.706692 B\n0.923048 0.406907 0.868185 As\n",
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{
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"created_at": "2022-09-04T14:38:50.410731Z",
"updated_at": "2022-09-04T14:38:50.410754Z",
"structure_string": "Ba1 B1 F1\n1.0\n6.414864 2.734485 0.000000\n2.002574 4.104562 0.000000\n0.000000 0.000000 3.798798\nBa B F\n1 1 1\ndirect\n0.423179 0.054740 0.000000 Ba\n-0.175827 0.053513 0.000000 B\n0.024675 0.053882 0.000000 F\n",
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"structure_string": "Ba1 B1 F1\n1.0\n3.669939 0.000000 0.000000\n0.000000 3.669939 -0.000000\n-0.000000 -0.000000 7.020014\nBa B F\n1 1 1\ndirect\n0.000000 0.000000 0.615733 Ba\n0.000000 0.000000 0.213903 B\n0.000000 0.000000 0.023880 F\n",
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"structure_string": "Ba1 B1 F1\n1.0\n4.838309 0.000000 -0.000000\n-2.419154 4.190099 0.000000\n-0.000000 -0.000000 3.723001\nBa B F\n1 1 1\ndirect\n0.333334 0.666668 0.000000 Ba\n0.000000 0.000000 0.000000 B\n0.666667 0.333334 0.000000 F\n",
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"structure_string": "Mg1 B1 H1\n1.0\n3.797063 -0.610490 0.000000\n-0.785816 3.765163 0.000000\n0.000000 0.000000 2.761501\nMg B H\n1 1 1\ndirect\n-0.247625 0.392356 0.000000 Mg\n0.108834 0.035912 0.000000 B\n0.300804 -0.156241 0.000000 H\n",
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