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"structure_string": "Ca4 Fe9 O17\n1.0\n5.889872 0.000000 0.000000\n-2.944936 5.029189 -0.764970\n0.000000 0.035209 11.133858\nCa Fe O\n4 9 17\ndirect\n0.786972 0.585073 0.755892 Ca\n0.201899 0.414927 0.244108 Ca\n0.535370 0.081275 0.255994 Ca\n0.454095 0.918725 0.744007 Ca\n0.254728 0.000000 0.500000 Fe\n0.258112 0.497890 0.504290 Fe\n0.760222 0.502110 0.495710 Fe\n0.864693 0.739819 0.234884 Fe\n0.124875 0.260181 0.765116 Fe\n0.149296 0.000000 0.000000 Fe\n0.491920 0.662900 -0.000199 Fe\n0.829021 0.337101 0.000199 Fe\n0.764023 0.000000 0.500000 Fe\n0.596500 0.206962 0.593237 O\n0.389537 0.793038 0.406763 O\n0.823243 0.657153 0.971912 O\n0.914806 0.308154 0.405341 O\n0.606652 0.691846 0.594659 O\n0.411892 0.310446 0.408302 O\n0.101447 0.689554 0.591698 O\n0.492991 0.000000 0.000000 O\n0.584071 0.734440 0.167917 O\n0.849630 0.265560 0.832083 O\n0.842201 0.433623 0.169471 O\n0.408578 0.566378 0.830529 O\n0.140996 -0.003225 0.170512 O\n0.144221 0.003225 0.829488 O\n0.166091 0.342847 0.028089 O\n0.924481 0.794053 0.400928 O\n0.130428 0.205947 0.599072 O\n",
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{
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{
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"structure_string": "Th2 Zr4 F24\n1.0\n6.983886 -0.000286 3.743839\n3.635526 7.255440 1.468997\n0.001647 0.000025 8.247207\nTh Zr F\n2 4 24\ndirect\n0.000000 0.777940 0.222060 Th\n0.000000 0.222060 0.777940 Th\n0.430248 0.188387 0.188387 Zr\n0.569753 0.811613 0.811613 Zr\n0.774129 0.350893 0.350893 Zr\n0.225872 0.649107 0.649107 Zr\n0.663740 0.938757 0.218840 F\n0.336262 0.781160 0.061243 F\n0.336261 0.061243 0.781160 F\n0.663740 0.218840 0.938757 F\n0.888639 0.357586 0.066417 F\n0.111362 0.933584 0.642414 F\n0.111362 0.642414 0.933584 F\n0.888639 0.066416 0.357586 F\n0.426557 0.713140 0.713140 F\n0.866053 0.559871 0.307991 F\n0.719232 0.832533 0.534638 F\n0.719232 0.534638 0.832533 F\n0.280769 0.167467 0.465362 F\n0.500001 0.387330 0.612671 F\n0.500001 0.612671 0.387329 F\n0.500000 -0.000000 -0.000000 F\n0.000000 0.000000 0.000000 F\n0.139622 0.221682 0.221682 F\n0.860379 0.778318 0.778318 F\n0.866053 0.307991 0.559871 F\n0.133949 0.440129 0.692009 F\n0.133949 0.692009 0.440129 F\n0.280770 0.465362 0.167467 F\n0.573445 0.286860 0.286860 F\n",
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{
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"created_at": "2022-09-04T14:36:46.541446Z",
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"structure_string": "In6 I24\n1.0\n11.630482 -0.000000 6.714861\n3.876827 10.965322 6.714861\n0.000000 0.000000 13.429723\nIn I\n6 24\ndirect\n0.250000 0.250000 0.750000 In\n0.250000 0.750000 0.250000 In\n0.750000 0.250000 0.250000 In\n0.250000 0.750000 0.750000 In\n0.750000 0.750000 0.250000 In\n0.750000 0.250000 0.750000 In\n0.298251 0.701749 0.049690 I\n0.049691 0.950309 0.298251 I\n0.298251 0.049690 0.950309 I\n0.701749 0.049690 0.298251 I\n0.298251 0.950309 0.701749 I\n0.950310 0.298251 0.049690 I\n0.049690 0.298251 0.701749 I\n0.701749 0.950309 0.049690 I\n0.701749 0.298251 0.950309 I\n0.049691 0.701749 0.950309 I\n0.450310 0.798251 0.201749 I\n0.201749 0.549690 0.450310 I\n0.201749 0.450310 0.798251 I\n0.950310 0.049690 0.701749 I\n0.798251 0.201749 0.450310 I\n0.450310 0.549690 0.798251 I\n0.549690 0.450310 0.201749 I\n0.201749 0.798251 0.549690 I\n0.798251 0.450310 0.549690 I\n0.798251 0.549690 0.201749 I\n0.549690 0.798251 0.450309 I\n0.549690 0.201749 0.798251 I\n0.450310 0.201749 0.549690 I\n0.950310 0.701749 0.298251 I\n",
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{
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