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{
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{
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{
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"structure_string": "Ba4 Cu2 H12\n1.0\n7.375518 2.905616 -0.000000\n-7.375518 2.905616 -0.000000\n0.000000 -0.000000 5.810822\nBa Cu H\n4 2 12\ndirect\n0.141485 0.858517 0.500000 Ba\n0.641485 0.358517 0.000000 Ba\n0.858517 0.141485 0.500000 Ba\n0.358517 0.641485 0.000000 Ba\n0.500001 0.500001 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.710124 0.710124 0.290028 H\n0.289877 0.289877 0.709972 H\n0.108749 0.891253 0.000000 H\n0.608749 0.391253 0.500000 H\n0.891253 0.108749 0.000000 H\n0.999803 0.499803 0.250000 H\n0.500198 0.000198 0.750000 H\n0.210123 0.210123 0.209972 H\n0.499803 0.999803 0.250000 H\n0.000198 0.500198 0.750000 H\n0.391253 0.608749 0.500000 H\n0.789878 0.789878 0.790028 H\n",
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{
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"updated_at": "2022-09-04T14:37:07.703810Z",
"structure_string": "Zn4 Bi2 W2 O12\n1.0\n0.000000 5.485251 -0.100533\n5.520271 0.000000 0.000000\n0.000000 -5.114766 -8.131348\nZn Bi W O\n4 2 2 12\ndirect\n0.288443 0.988251 0.256532 Zn\n0.711556 0.488251 0.243468 Zn\n0.711556 0.011749 0.743468 Zn\n0.288443 0.511749 0.756532 Zn\n0.500000 0.000000 -0.000000 Bi\n0.499999 0.500000 0.500000 Bi\n-0.000000 0.000000 0.500000 W\n0.000000 0.500000 0.000000 W\n0.666402 0.133552 0.285757 O\n0.333597 0.633552 0.214243 O\n0.739853 0.633470 0.059411 O\n0.260146 0.133470 0.440589 O\n0.260145 0.366530 0.940589 O\n0.980469 0.196923 0.096061 O\n0.019530 0.803077 0.903939 O\n0.980469 0.303077 0.596061 O\n0.333597 0.866448 0.714243 O\n0.019530 0.696922 0.403939 O\n0.739853 0.866530 0.559411 O\n0.666402 0.366448 0.785757 O\n",
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{
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"created_at": "2022-09-04T14:37:51.185156Z",
"updated_at": "2022-09-04T14:37:51.185165Z",
"structure_string": "Rb2 Li1 Mo1 Cl6\n1.0\n6.115988 -0.000000 3.531067\n2.038663 5.766209 3.531067\n-0.000000 -0.000000 7.062134\nRb Li Mo Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mo\n0.754305 0.245695 0.245695 Cl\n0.245695 0.245695 0.754305 Cl\n0.245694 0.754305 0.754305 Cl\n0.245694 0.754305 0.245695 Cl\n0.754305 0.245695 0.754305 Cl\n0.754305 0.754305 0.245695 Cl\n",
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{
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"created_at": "2022-09-04T14:36:13.810852Z",
"updated_at": "2022-09-04T14:36:13.810876Z",
"structure_string": "Ce4 P8\n1.0\n3.999151 0.000000 -0.507796\n0.000000 6.424500 0.000000\n0.075760 0.000000 9.683119\nCe P\n4 8\ndirect\n0.216080 0.315075 0.138303 Ce\n0.783919 0.684925 0.861696 Ce\n0.283920 0.815075 0.361696 Ce\n0.716080 0.184925 0.638303 Ce\n0.209056 0.855238 0.672309 P\n0.790943 0.144762 0.327690 P\n0.149284 0.368621 0.449370 P\n0.350715 0.868622 0.050629 P\n0.709056 0.644762 0.172309 P\n0.649284 0.131379 0.949370 P\n0.850715 0.631379 0.550629 P\n0.290943 0.355238 0.827691 P\n",
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{
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"created_at": "2022-09-04T14:36:02.241780Z",
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"structure_string": "Ce4 P8\n1.0\n3.999389 0.000000 -0.507881\n0.000000 6.424073 0.000000\n0.075706 0.000000 9.683091\nCe P\n4 8\ndirect\n0.216077 0.315039 0.138322 Ce\n0.783924 0.684961 0.861678 Ce\n0.283924 0.815038 0.361678 Ce\n0.716077 0.184961 0.638322 Ce\n0.209052 0.855266 0.672278 P\n0.790949 0.144734 0.327722 P\n0.149292 0.368631 0.449385 P\n0.350708 0.868631 0.050615 P\n0.709051 0.644734 0.172278 P\n0.649293 0.131368 0.949385 P\n0.850709 0.631368 0.550616 P\n0.290950 0.355266 0.827722 P\n",
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{
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"created_at": "2022-09-04T14:38:34.881068Z",
"updated_at": "2022-09-04T14:38:34.881096Z",
"structure_string": "Al4 B6 O15\n1.0\n6.528547 0.005448 -2.474475\n-3.585750 5.455672 -2.474475\n0.002936 0.005448 6.981757\nAl B O\n4 6 15\ndirect\n0.997796 0.997796 0.997797 Al\n0.916601 0.196752 0.707613 Al\n0.707612 0.916600 0.196753 Al\n0.196753 0.707611 0.916601 Al\n0.828980 0.725079 0.498426 B\n0.474131 0.142251 0.402497 B\n0.142251 0.402496 0.474131 B\n0.402496 0.474130 0.142251 B\n0.498425 0.828979 0.725080 B\n0.725079 0.498425 0.828980 B\n0.972500 0.758906 0.720083 O\n0.720082 0.972499 0.758907 O\n0.309545 0.609202 0.499228 O\n0.177541 0.255400 0.983140 O\n0.983140 0.177541 0.255401 O\n0.255400 0.983139 0.177541 O\n0.666853 0.123110 0.423191 O\n0.423190 0.666853 0.123110 O\n0.123110 0.423190 0.666854 O\n0.609203 0.499227 0.309546 O\n0.922151 0.473995 0.896748 O\n0.473995 0.896746 0.922151 O\n0.896747 0.922150 0.473996 O\n0.499228 0.309545 0.609203 O\n0.758907 0.720082 0.972501 O\n",
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{
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"structure_string": "Ca6 Ga4 N8\n1.0\n5.580658 -0.007782 0.081648\n0.072894 6.580313 1.621912\n-0.011724 -0.007525 6.777628\nCa Ga N\n6 4 8\ndirect\n0.544829 0.749420 0.018494 Ca\n0.044830 0.018494 0.749421 Ca\n0.250000 0.601992 0.398008 Ca\n0.455171 0.250580 0.981506 Ca\n0.750000 0.398008 0.601992 Ca\n0.955170 0.981506 0.250580 Ca\n0.096462 0.583309 0.822096 Ga\n0.596462 0.822097 0.583309 Ga\n0.903538 0.416691 0.177904 Ga\n0.403538 0.177904 0.416691 Ga\n0.018265 0.709359 0.056842 N\n0.434923 0.574416 0.739778 N\n0.518266 0.056843 0.709359 N\n0.934923 0.739778 0.574416 N\n0.565077 0.425585 0.260222 N\n0.981736 0.290642 0.943158 N\n0.065077 0.260223 0.425585 N\n0.481735 0.943158 0.290641 N\n",
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{
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{
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"structure_string": "Ce2 Fe17\n1.0\n6.294712 0.062487 0.855164\n0.755163 6.249562 0.855164\n0.069792 0.062487 6.352152\nCe Fe\n2 17\ndirect\n0.341352 0.341352 0.341351 Ce\n0.658647 0.658648 0.658647 Ce\n0.841650 0.341138 0.341137 Fe\n0.158349 0.658862 0.658861 Fe\n0.658861 0.658862 0.158349 Fe\n0.658861 0.158350 0.658861 Fe\n0.295954 0.000000 0.704046 Fe\n-0.000000 0.704046 0.295953 Fe\n0.704046 0.295954 -0.000001 Fe\n0.341137 0.341138 0.841650 Fe\n0.295954 0.704046 -0.000001 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.905329 0.905330 0.905328 Fe\n0.094670 0.094670 0.094670 Fe\n0.341137 0.841650 0.341137 Fe\n-0.000000 0.295954 0.704046 Fe\n0.704046 0.000000 0.295953 Fe\n",
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]
}