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{
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{
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{
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{
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"structure_string": "Li6 Bi2 O8\n1.0\n6.311722 0.000000 0.000000\n0.000000 5.322419 0.000000\n0.000000 1.759066 5.101581\nLi Bi O\n6 2 8\ndirect\n0.613305 0.000000 0.750000 Li\n0.386695 0.000000 0.250000 Li\n0.842498 0.500000 0.750000 Li\n0.421383 0.500000 0.750000 Li\n0.578617 0.500000 0.250000 Li\n0.157502 0.500000 0.250000 Li\n0.149127 0.000000 0.750000 Bi\n0.850873 0.000000 0.250000 Bi\n0.373671 0.748401 0.986249 O\n0.108286 0.764127 0.492799 O\n0.626329 0.748401 0.486249 O\n0.891714 0.764127 0.992799 O\n0.373671 0.251599 0.513751 O\n0.891714 0.235873 0.507201 O\n0.626329 0.251599 0.013751 O\n0.108286 0.235873 0.007201 O\n",
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{
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"structure_string": "Cs2 Yb1 Cl4\n1.0\n-2.702162 2.702162 8.707256\n2.702162 -2.702162 8.707256\n2.702162 2.702162 -8.707256\nCs Yb Cl\n2 1 4\ndirect\n0.644098 0.644098 0.000000 Cs\n0.355902 0.355902 0.000000 Cs\n0.000000 0.000000 0.000000 Yb\n0.843512 0.843512 0.000000 Cl\n0.156488 0.156488 0.000000 Cl\n0.500000 0.000000 0.500000 Cl\n0.000000 0.500000 0.500000 Cl\n",
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{
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"structure_string": "Eu8 Mo12 O48\n1.0\n10.614154 0.000000 0.000000\n0.000000 10.620313 0.000000\n0.000000 0.000000 10.843197\nEu Mo O\n8 12 48\ndirect\n0.689560 0.002570 0.735867 Eu\n0.310440 0.997430 0.735867 Eu\n0.810440 0.502570 0.735867 Eu\n0.189560 0.497430 0.735867 Eu\n0.993763 0.190580 0.264162 Eu\n0.006237 0.809420 0.264162 Eu\n0.506237 0.690580 0.264162 Eu\n0.493763 0.309420 0.264162 Eu\n0.706809 0.012534 0.356262 Mo\n0.293191 0.987466 0.356262 Mo\n0.793191 0.512534 0.356262 Mo\n0.206809 0.487466 0.356262 Mo\n0.502675 0.292629 0.643602 Mo\n0.497325 0.707371 0.643602 Mo\n0.997325 0.792629 0.643602 Mo\n0.002675 0.207371 0.643602 Mo\n0.742082 0.257085 0.000343 Mo\n0.257918 0.742915 0.000343 Mo\n0.757918 0.757085 0.000343 Mo\n0.242082 0.242915 0.000343 Mo\n0.694890 0.015533 0.520468 O\n0.305110 0.984467 0.520468 O\n0.805110 0.515533 0.520468 O\n0.194890 0.484467 0.520468 O\n0.654699 0.162811 0.302457 O\n0.345301 0.837189 0.302457 O\n0.845301 0.662811 0.302457 O\n0.154699 0.337189 0.302457 O\n0.628672 0.494585 0.310211 O\n0.371328 0.505415 0.310211 O\n0.871328 0.994585 0.310211 O\n0.128672 0.005415 0.310211 O\n0.883902 0.386148 0.294600 O\n0.116098 0.613852 0.294600 O\n0.616098 0.886148 0.294600 O\n0.383902 0.113852 0.294600 O\n0.656230 0.349509 0.681214 O\n0.343770 0.650491 0.681214 O\n0.843770 0.849509 0.681214 O\n0.156230 0.150491 0.681214 O\n0.978861 0.197470 0.480750 O\n0.021139 0.802530 0.480750 O\n0.521139 0.697470 0.480750 O\n0.478861 0.302530 0.480750 O\n0.882818 0.118908 0.719051 O\n0.117182 0.881092 0.719051 O\n0.617182 0.618908 0.719051 O\n0.382818 0.381092 0.719051 O\n0.993928 0.371929 0.693000 O\n0.006072 0.628071 0.693000 O\n0.506072 0.871929 0.693000 O\n0.493928 0.128071 0.693000 O\n0.619170 0.323741 0.093007 O\n0.380830 0.676259 0.093007 O\n0.880830 0.823741 0.093007 O\n0.119170 0.176259 0.093007 O\n0.815027 0.379951 0.912163 O\n0.184973 0.620049 0.912163 O\n0.684973 0.879951 0.912163 O\n0.315027 0.120049 0.912163 O\n0.853886 0.181430 0.099658 O\n0.146114 0.818570 0.099658 O\n0.646114 0.681430 0.099658 O\n0.353886 0.318570 0.099658 O\n0.674297 0.145997 0.895488 O\n0.325703 0.854003 0.895488 O\n0.825703 0.645997 0.895488 O\n0.174297 0.354003 0.895488 O\n",
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{
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"structure_string": "Ba2 Mg4 Al12 Si18 O60\n1.0\n10.259044 0.000000 0.000000\n-5.124192 -8.976492 0.000000\n-0.153196 0.040379 -14.372357\nBa Mg Al Si O\n2 4 12 18 60\ndirect\n0.990191 0.995390 0.254326 Ba\n0.997758 0.993375 0.754476 Ba\n0.666407 0.337779 0.752312 Mg\n0.665220 0.335260 0.251816 Mg\n0.336078 0.661501 0.753387 Mg\n0.341432 0.669365 0.250436 Mg\n0.350769 0.247528 0.387750 Al\n0.504983 0.501590 0.246589 Al\n0.495845 0.998673 0.251747 Al\n0.108356 0.747676 0.887937 Al\n0.002843 0.493608 0.748406 Al\n0.002301 0.503298 0.252334 Al\n0.504935 0.004007 0.749478 Al\n0.243078 0.345520 0.889184 Al\n0.646218 0.896708 0.112117 Al\n0.495770 0.502008 0.752927 Al\n0.652596 0.758058 0.386520 Al\n0.648447 0.755254 0.611323 Al\n0.347598 0.247140 0.612319 Si\n0.349854 0.099638 0.886674 Si\n0.341304 0.094815 0.109484 Si\n0.758444 0.655760 0.109553 Si\n0.757292 0.658160 0.887404 Si\n0.901488 0.653652 0.612703 Si\n0.900716 0.650047 0.390847 Si\n0.752478 0.105253 0.387966 Si\n0.751768 0.101762 0.609721 Si\n0.105160 0.748121 0.111008 Si\n0.893915 0.243628 0.889367 Si\n0.897188 0.249004 0.112115 Si\n0.248636 0.903022 0.611872 Si\n0.247602 0.899005 0.390920 Si\n0.102596 0.351006 0.387225 Si\n0.101612 0.347808 0.607071 Si\n0.240907 0.339843 0.112410 Si\n0.645357 0.895999 0.889481 Si\n0.283500 0.205966 0.855704 O\n0.265155 0.196206 0.138842 O\n0.265380 0.056587 0.358793 O\n0.273575 0.068296 0.642216 O\n0.392725 0.272854 0.506055 O\n0.486910 0.351927 0.683161 O\n0.502750 0.359232 0.316496 O\n0.384954 0.111494 0.999961 O\n0.645102 0.510753 0.824716 O\n0.646621 0.508568 0.170457 O\n0.731957 0.619322 0.998101 O\n0.502127 0.140667 0.825334 O\n0.486904 0.133845 0.175911 O\n0.803287 0.725871 0.358601 O\n0.798952 0.723323 0.643023 O\n0.929621 0.723900 0.857729 O\n0.933471 0.708727 0.140183 O\n0.644907 0.142624 0.674665 O\n0.639722 0.140418 0.323881 O\n0.891331 0.612131 0.502047 O\n0.863472 0.504391 0.325838 O\n0.866156 0.507046 0.676220 O\n0.721988 0.113580 0.498801 O\n0.074575 0.787311 0.639760 O\n0.075054 0.773039 0.362840 O\n0.859989 0.354489 0.822907 O\n0.866846 0.363854 0.175913 O\n0.886630 0.276282 0.000265 O\n0.223649 0.933372 0.855685 O\n0.207825 0.926563 0.139098 O\n0.774267 0.068725 0.862664 O\n0.787022 0.079013 0.141780 O\n0.121841 0.718780 0.004775 O\n0.143261 0.632638 0.817236 O\n0.142366 0.647343 0.182798 O\n0.930003 0.220560 0.633389 O\n0.925504 0.231545 0.361673 O\n0.273595 0.891618 0.502135 O\n0.141393 0.497584 0.324485 O\n0.136385 0.489597 0.671286 O\n0.119158 0.389405 0.497963 O\n0.362549 0.872247 0.674510 O\n0.361476 0.866564 0.330313 O\n0.052760 0.262880 0.856885 O\n0.065854 0.279135 0.144458 O\n0.205059 0.274064 0.638303 O\n0.197843 0.273439 0.356583 O\n0.505949 0.862736 0.819554 O\n0.493124 0.858834 0.181296 O\n0.264663 0.380241 0.005624 O\n0.357103 0.499959 0.824237 O\n0.351694 0.480959 0.176715 O\n0.599784 0.875521 0.995632 O\n0.499220 0.641594 0.683000 O\n0.505817 0.644703 0.310917 O\n0.598847 0.732305 0.498133 O\n0.738764 0.949693 0.354035 O\n0.731470 0.945073 0.646112 O\n0.723197 0.795057 0.859349 O\n0.737757 0.795292 0.139755 O\n",
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{
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{
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"structure_string": "Ba6 Tm2\n1.0\n4.170704 -7.223872 0.000000\n4.170704 7.223872 0.000000\n0.000000 0.000000 6.728748\nBa Tm\n6 2\ndirect\n0.171449 0.342897 0.250000 Ba\n0.657103 0.828551 0.250000 Ba\n0.171449 0.828551 0.250000 Ba\n0.828551 0.657103 0.750000 Ba\n0.342897 0.171449 0.750000 Ba\n0.828551 0.171449 0.750000 Ba\n0.333333 0.666667 0.750000 Tm\n0.666667 0.333333 0.250000 Tm\n",
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"elements": [
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],
"chemical_system": "Ba-Tm",
"density": 4.758260019654752,
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"formula_full": "Ba6 Tm2",
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},
{
"id": "mp-1187537",
"created_at": "2022-09-04T14:41:53.479749Z",
"structure_string": "Yb1 Tm1 Pd2\n1.0\n0.000000 3.462354 3.462354\n3.462354 0.000000 3.462354\n3.462354 3.462354 0.000000\nYb Tm Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Tm\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Pd\n",
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},
{
"id": "mp-1933075",
"created_at": "2022-09-04T14:41:53.485798Z",
"structure_string": "Mg2 Sn4 O10\n1.0\n3.419085 0.010727 -0.022307\n0.015967 5.198429 0.004658\n-0.071399 0.006574 12.706756\nMg Sn O\n2 4 10\ndirect\n0.744896 0.895815 0.251041 Mg\n0.253832 0.105104 0.748489 Mg\n0.251637 0.399497 0.107062 Sn\n0.743573 0.601978 0.893116 Sn\n0.755864 0.601817 0.606661 Sn\n0.248132 0.398376 0.393215 Sn\n0.755307 0.411520 0.749811 O\n0.247350 0.589355 0.250141 O\n0.748820 0.590736 0.068982 O\n0.246319 0.411292 0.931227 O\n0.747578 0.589989 0.430707 O\n0.256281 0.410497 0.568829 O\n0.231071 0.039025 0.355085 O\n0.774914 0.961191 0.644461 O\n0.717143 0.960200 0.853263 O\n0.267728 0.040635 0.146168 O\n",
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"elements": [
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],
"chemical_system": "Mg-O-Sn",
"density": 5.025226565876102,
"density_atomic": 0.070847347823214,
"volume": 225.83767059177623,
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"formula_full": "Mg2 Sn4 O10",
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"formula_anonymous": "AB2C5",
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}
]
}