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{
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{
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{
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{
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"structure_string": "Ca4 B12 O24\n1.0\n4.463010 0.000000 0.000000\n0.000000 7.028767 0.000000\n0.000000 0.000000 13.717413\nCa B O\n4 12 24\ndirect\n0.994038 0.273680 0.409162 Ca\n0.494038 0.726320 0.590838 Ca\n0.494038 0.773680 0.090838 Ca\n0.994038 0.226320 0.909162 Ca\n0.343726 0.402911 0.231085 B\n0.843726 0.597089 0.768915 B\n0.843726 0.902911 0.268915 B\n0.343726 0.097089 0.731085 B\n0.542551 0.285842 0.074211 B\n0.042551 0.714158 0.925789 B\n0.042551 0.785842 0.425789 B\n0.542551 0.214158 0.574211 B\n0.050288 0.155282 0.145885 B\n0.550288 0.844718 0.854115 B\n0.550288 0.655282 0.354115 B\n0.050288 0.344718 0.645885 B\n0.485190 0.445725 0.144754 O\n0.985190 0.554275 0.855246 O\n0.985190 0.945725 0.355246 O\n0.485190 0.054275 0.644754 O\n0.109200 0.274907 0.233243 O\n0.609200 0.725093 0.766757 O\n0.609200 0.774907 0.266757 O\n0.109200 0.225093 0.733243 O\n0.347094 0.116799 0.096461 O\n0.847094 0.883201 0.903539 O\n0.847094 0.616799 0.403539 O\n0.347094 0.383201 0.596461 O\n0.422388 0.472668 0.321259 O\n0.922388 0.527332 0.678741 O\n0.922388 0.972668 0.178741 O\n0.422388 0.027332 0.821259 O\n0.858493 0.238807 0.073387 O\n0.358493 0.761193 0.926613 O\n0.358493 0.738807 0.426613 O\n0.858493 0.261193 0.573387 O\n0.452032 0.321974 0.974578 O\n0.952032 0.678026 0.025422 O\n0.952032 0.821974 0.525422 O\n0.452032 0.178026 0.474578 O\n",
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{
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{
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{
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