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{
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{
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{
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{
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"structure_string": "Sr2 Ga3 Au3\n1.0\n3.098815 0.000000 0.000000\n0.000000 3.098815 0.000000\n0.000000 0.000000 22.664885\nSr Ga Au\n2 3 3\ndirect\n0.500000 0.500000 0.745990 Sr\n0.500000 0.500000 0.254010 Sr\n0.500000 0.500000 0.500000 Ga\n0.500000 0.500000 0.113193 Ga\n0.500000 0.500000 0.886807 Ga\n0.500000 0.500000 0.000000 Au\n0.500000 0.500000 0.386611 Au\n0.500000 0.500000 0.613389 Au\n",
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{
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"structure_string": "Li1 Sm1 S2\n1.0\n6.318171 -2.001301 0.000000\n6.318171 2.001301 0.000000\n5.684253 0.000000 3.407898\nLi Sm S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Sm\n0.251513 0.251513 0.251513 S\n0.748487 0.748487 0.748487 S\n",
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{
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"structure_string": "Er4 Ga12 Pt1\n1.0\n-4.306284 4.306284 4.306284\n4.306284 -4.306284 4.306284\n4.306284 4.306284 -4.306284\nEr Ga Pt\n4 12 1\ndirect\n0.500000 0.500000 0.500000 Er\n0.000000 0.000000 0.500000 Er\n0.000000 0.500000 0.000000 Er\n0.500000 0.000000 0.000000 Er\n0.000000 0.296749 0.296749 Ga\n0.000000 0.703251 0.703251 Ga\n0.296749 0.000000 0.296749 Ga\n0.703251 0.000000 0.703251 Ga\n0.296749 0.296749 0.000000 Ga\n0.703251 0.703251 0.000000 Ga\n0.500000 0.750000 0.250000 Ga\n0.500000 0.250000 0.750000 Ga\n0.250000 0.500000 0.750000 Ga\n0.750000 0.500000 0.250000 Ga\n0.750000 0.250000 0.500000 Ga\n0.250000 0.750000 0.500000 Ga\n0.000000 0.000000 0.000000 Pt\n",
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{
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{
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"structure_string": "Na4 Tb4 P16 O48\n1.0\n13.193559 0.000000 0.000000\n0.000000 7.252462 0.000000\n0.000000 7.157413 9.857512\nNa Tb P O\n4 4 16 48\ndirect\n0.721680 0.064185 0.436560 Na\n0.778320 0.064185 0.936560 Na\n0.278320 0.935815 0.563440 Na\n0.221680 0.935815 0.063440 Na\n0.719184 0.464501 0.522860 Tb\n0.780816 0.464501 0.022860 Tb\n0.280816 0.535499 0.477140 Tb\n0.219184 0.535499 0.977140 Tb\n0.601853 0.994209 0.255792 P\n0.898147 0.994209 0.755792 P\n0.398147 0.005791 0.744208 P\n0.101853 0.005791 0.244208 P\n0.615292 0.887110 0.736903 P\n0.884708 0.887110 0.236903 P\n0.384708 0.112890 0.263097 P\n0.115292 0.112890 0.763097 P\n0.628046 0.655980 0.196723 P\n0.871954 0.655980 0.696723 P\n0.371954 0.344020 0.803277 P\n0.128046 0.344020 0.303277 P\n0.591427 0.432304 0.799622 P\n0.908573 0.432304 0.299622 P\n0.408573 0.567696 0.200378 P\n0.091427 0.567696 0.700378 P\n0.790202 0.671873 0.605314 O\n0.709798 0.671873 0.105314 O\n0.209798 0.328127 0.394686 O\n0.290202 0.328127 0.894686 O\n0.580920 0.706637 0.707393 O\n0.919080 0.706637 0.207393 O\n0.419080 0.293363 0.292607 O\n0.080920 0.293363 0.792607 O\n0.810784 0.779708 0.352185 O\n0.689216 0.779708 0.852185 O\n0.189216 0.220292 0.647815 O\n0.310784 0.220292 0.147815 O\n0.647169 0.099084 0.602893 O\n0.852831 0.099084 0.102893 O\n0.352831 0.900916 0.397107 O\n0.147169 0.900916 0.897107 O\n0.624792 0.905846 0.164406 O\n0.875208 0.905846 0.664406 O\n0.375208 0.094154 0.835594 O\n0.124792 0.094154 0.335594 O\n0.666224 0.203517 0.202120 O\n0.833776 0.203517 0.702120 O\n0.333776 0.796483 0.797880 O\n0.166224 0.796483 0.297880 O\n0.478885 0.353370 0.864009 O\n0.021115 0.353370 0.364009 O\n0.521115 0.646630 0.135991 O\n0.978885 0.646630 0.635991 O\n0.513096 0.924796 0.791605 O\n0.986904 0.924796 0.291605 O\n0.486904 0.075204 0.208395 O\n0.013096 0.075204 0.708395 O\n0.837744 0.346047 0.416986 O\n0.662256 0.346047 0.916986 O\n0.162256 0.653953 0.583014 O\n0.337744 0.653953 0.083014 O\n0.609392 0.807009 0.405492 O\n0.890608 0.807009 0.905492 O\n0.390608 0.192991 0.594508 O\n0.109392 0.192991 0.094508 O\n0.633835 0.477097 0.346852 O\n0.866165 0.477097 0.846852 O\n0.366165 0.522903 0.653148 O\n0.133835 0.522903 0.153148 O\n0.611956 0.367320 0.705054 O\n0.888044 0.367320 0.205054 O\n0.388044 0.632680 0.294946 O\n0.111956 0.632680 0.794946 O\n",
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{
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},
{
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"created_at": "2022-09-04T14:40:41.882476Z",
"structure_string": "Al4 Hg2 S8\n1.0\n0.000000 5.200647 5.200647\n5.200647 0.000000 5.200647\n5.200647 5.200647 0.000000\nAl Hg S\n4 2 8\ndirect\n0.125000 0.625000 0.625000 Al\n0.625000 0.125000 0.625000 Al\n0.625000 0.625000 0.125000 Al\n0.625000 0.625000 0.625000 Al\n0.250000 0.250000 0.250000 Hg\n0.000000 0.000000 0.000000 Hg\n0.828480 0.390507 0.390507 S\n0.390507 0.828480 0.390507 S\n0.390507 0.390507 0.828480 S\n0.390507 0.390507 0.390507 S\n0.421520 0.859493 0.859493 S\n0.859493 0.421520 0.859493 S\n0.859493 0.859493 0.421520 S\n0.859493 0.859493 0.859493 S\n",
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"density": 4.519222594815998,
"density_atomic": 0.04976521794959102,
"volume": 281.32098234114244,
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"formula_full": "Al4 Hg2 S8",
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"updated_at": "2021-11-28T01:35:04.389000Z",
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},
{
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"structure_string": "Fe6 O8 F4\n1.0\n4.694795 0.000000 0.000000\n0.214276 5.594284 0.000000\n0.155358 0.603679 7.665031\nFe O F\n6 8 4\ndirect\n0.491612 0.833805 0.667956 Fe\n0.512269 0.496603 0.987176 Fe\n0.533676 0.168737 0.344995 Fe\n0.009489 0.334549 0.669125 Fe\n0.949429 0.657171 0.325048 Fe\n0.003348 0.003468 0.003355 Fe\n0.818355 0.363877 0.442744 O\n0.803626 0.711561 0.095910 O\n0.696568 0.208680 0.105295 O\n0.698806 0.542288 0.758085 O\n0.687510 0.863644 0.444849 O\n0.306655 0.128550 0.570644 O\n0.302621 0.793789 0.891848 O\n0.188429 0.293030 0.895245 O\n0.799699 0.036982 0.768917 F\n0.304234 0.469601 0.235142 F\n0.196448 0.961213 0.239137 F\n0.197226 0.632453 0.554529 F\n",
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]
}