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{
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{
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"elements": [
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"formula_full": "Mn8 Bi8 O24",
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"spacegroup": 14
},
{
"id": "mp-865098",
"created_at": "2022-09-04T14:41:21.928615Z",
"structure_string": "Na1 La1 Au2\n1.0\n0.000000 3.662778 3.662778\n3.662778 0.000000 3.662778\n3.662778 3.662778 0.000000\nNa La Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 La\n0.750000 0.750000 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
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"density": 9.391350000933272,
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"spacegroup": 225
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{
"id": "mp-1187602",
"created_at": "2022-09-04T14:41:21.496196Z",
"structure_string": "Tm1 Ga1 Ni2\n1.0\n0.000000 3.110256 3.110256\n3.110256 0.000000 3.110256\n3.110256 3.110256 0.000000\nTm Ga Ni\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Ga\n0.250000 0.250000 0.250000 Ni\n0.750000 0.750000 0.750000 Ni\n",
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"density": 9.825041101120512,
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"volume": 60.17531956853532,
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"formula_full": "Tm1 Ga1 Ni2",
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{
"id": "mp-753139",
"created_at": "2022-09-04T14:41:21.946746Z",
"structure_string": "Li6 Cu1 F8\n1.0\n0.000000 4.148316 4.148316\n4.148316 0.000000 4.148316\n4.148316 4.148316 0.000000\nLi Cu F\n6 1 8\ndirect\n0.500000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 F\n0.757026 0.242974 0.242974 F\n0.757026 0.757026 0.242974 F\n0.242974 0.757026 0.242974 F\n0.757026 0.242974 0.757026 F\n0.242974 0.242974 0.757026 F\n0.242974 0.757026 0.757026 F\n0.750000 0.750000 0.750000 F\n",
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"elements": [
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"F"
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"chemical_system": "Cu-F-Li",
"density": 2.991158945376184,
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"volume": 142.77280446326327,
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"formula_full": "Li6 Cu1 F8",
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{
"id": "mp-758396",
"created_at": "2022-09-04T14:41:21.496821Z",
"structure_string": "Mn4 C6 O18\n1.0\n7.604566 0.015418 0.037787\n-2.316161 7.246667 0.045515\n-2.305110 -3.158806 6.519044\nMn C O\n4 6 18\ndirect\n0.054230 0.533360 0.183999 Mn\n0.182752 0.052455 0.532713 Mn\n0.521761 0.521807 0.523502 Mn\n0.532719 0.182934 0.053164 Mn\n0.170672 0.254308 0.923802 C\n0.254106 0.923462 0.170605 C\n0.414343 0.811645 0.609929 C\n0.610242 0.414872 0.810436 C\n0.810437 0.607447 0.413655 C\n0.923610 0.170811 0.254233 C\n0.062285 0.352760 0.949187 O\n0.098818 0.750066 0.098519 O\n0.098246 0.099416 0.750444 O\n0.072190 0.345328 0.308764 O\n0.384809 0.972006 0.685527 O\n0.358066 0.711484 0.414524 O\n0.503929 0.746497 0.728020 O\n0.352412 0.948445 0.061897 O\n0.415114 0.359605 0.708057 O\n0.345299 0.308467 0.071861 O\n0.308345 0.071751 0.344737 O\n0.684585 0.385207 0.970945 O\n0.741915 0.723593 0.502688 O\n0.728728 0.504285 0.745129 O\n0.711808 0.412727 0.357727 O\n0.971026 0.686088 0.385654 O\n0.948692 0.062164 0.352769 O\n0.750352 0.098544 0.098984 O\n",
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{
"id": "mp-761202",
"created_at": "2022-09-04T14:41:21.949911Z",
"structure_string": "Li6 Fe8 B8 O24\n1.0\n9.005772 0.000000 0.000000\n0.000000 5.266693 0.000000\n0.000000 0.325784 10.267240\nLi Fe B O\n6 8 8 24\ndirect\n0.988461 0.656717 0.836953 Li\n0.994651 0.336675 0.083227 Li\n0.504498 0.850661 0.579337 Li\n0.495502 0.850661 0.079337 Li\n0.011539 0.656717 0.336953 Li\n0.005349 0.336675 0.583227 Li\n0.836750 0.837716 0.113389 Fe\n0.820990 0.152228 0.361547 Fe\n0.651807 0.664605 0.868158 Fe\n0.668077 0.336470 0.627441 Fe\n0.348193 0.664605 0.368158 Fe\n0.163250 0.837716 0.613389 Fe\n0.331923 0.336470 0.127441 Fe\n0.179010 0.152228 0.861547 Fe\n0.828520 0.830768 0.627651 B\n0.678124 0.667631 0.381651 B\n0.839903 0.168190 0.868886 B\n0.662013 0.343199 0.118343 B\n0.321876 0.667631 0.881651 B\n0.337987 0.343199 0.618343 B\n0.171480 0.830768 0.127651 B\n0.160097 0.168190 0.368886 B\n0.957926 0.690521 0.635416 O\n0.834489 0.907883 0.900241 O\n0.968412 0.304574 0.889484 O\n0.807701 0.778262 0.329296 O\n0.691688 0.712282 0.653429 O\n0.796772 0.223884 0.150334 O\n0.830932 0.088226 0.594355 O\n0.660687 0.599151 0.081186 O\n0.549359 0.801368 0.385776 O\n0.689153 0.421022 0.435078 O\n0.714905 0.296354 0.818923 O\n0.450641 0.801368 0.885776 O\n0.530860 0.206926 0.123574 O\n0.308312 0.712282 0.153429 O\n0.339313 0.599151 0.581186 O\n0.469140 0.206926 0.623574 O\n0.310847 0.421022 0.935078 O\n0.165511 0.907883 0.400241 O\n0.192299 0.778262 0.829296 O\n0.285095 0.296354 0.318923 O\n0.203228 0.223884 0.650334 O\n0.042074 0.690521 0.135416 O\n0.169068 0.088226 0.094355 O\n0.031588 0.304574 0.389484 O\n",
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"formula_full": "Li6 Fe8 B8 O24",
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{
"id": "mp-766793",
"created_at": "2022-09-04T14:41:21.956696Z",
"structure_string": "Li5 Co5 Ni2 O12\n1.0\n5.004313 0.000000 0.000000\n-2.451596 4.367559 0.000000\n-0.814883 -1.365861 9.482894\nLi Co Ni O\n5 5 2 12\ndirect\n0.827952 0.668475 0.496418 Li\n0.676028 0.844295 0.002826 Li\n0.331439 0.170831 0.002194 Li\n0.155220 0.323151 0.496211 Li\n0.087030 0.914731 0.252404 Li\n0.912824 0.088752 0.751549 Co\n0.578221 0.423340 0.751767 Co\n0.483185 0.994321 0.495133 Co\n0.002175 0.515828 0.008333 Co\n0.421386 0.580556 0.248552 Co\n0.758677 0.250946 0.251205 Ni\n0.244802 0.754748 0.749268 Ni\n0.848259 0.359714 0.637460 O\n0.706740 0.518722 0.128079 O\n0.931904 0.782488 0.866775 O\n0.642724 0.153378 0.867354 O\n0.483779 0.301168 0.362627 O\n0.766524 0.944642 0.358448 O\n0.214456 0.073608 0.639295 O\n0.563482 0.726426 0.639438 O\n0.369476 0.837701 0.122066 O\n0.049928 0.233269 0.135648 O\n0.267918 0.439535 0.865683 O\n0.156045 0.619209 0.371269 O\n",
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{
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