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{
"id": "mp-1174028",
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"structure_string": "Li5 Mn1 Co2 O8\n1.0\n2.910669 0.000000 0.000000\n0.000000 5.077038 0.000000\n0.000000 1.883513 9.558420\nLi Mn Co O\n5 1 2 8\ndirect\n0.000000 0.238584 0.269016 Li\n0.500000 0.258539 0.737972 Li\n0.000000 0.761416 0.730984 Li\n0.500000 0.741461 0.262028 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.000000 0.358174 0.890408 O\n0.500000 0.385558 0.387063 O\n0.000000 0.829040 0.389338 O\n0.500000 0.898214 0.884857 O\n0.000000 0.170960 0.610662 O\n0.500000 0.101786 0.115143 O\n0.000000 0.641826 0.109592 O\n0.500000 0.614442 0.612937 O\n",
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{
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{
"id": "mp-1106359",
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"structure_string": "Li10 Cl6 O2\n1.0\n-3.522245 3.522245 5.907831\n3.522245 -3.522245 5.907831\n3.522245 3.522245 -5.907831\nLi Cl O\n10 6 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.000000 Li\n0.802215 0.302215 0.785228 Li\n0.516988 0.016988 0.214772 Li\n0.302215 0.516988 0.500000 Li\n0.016988 0.802215 0.500000 Li\n0.197785 0.697785 0.214772 Li\n0.483012 0.983012 0.785228 Li\n0.697785 0.483012 0.500000 Li\n0.983012 0.197785 0.500000 Li\n0.750000 0.750000 0.000000 Cl\n0.250000 0.250000 0.000000 Cl\n0.208526 0.708526 0.917053 Cl\n0.791474 0.291474 0.082947 Cl\n0.708526 0.791474 0.500000 Cl\n0.291474 0.208526 0.500000 Cl\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n",
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"formula_full": "Li10 Cl6 O2",
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{
"id": "mp-554562",
"created_at": "2022-09-04T14:40:33.043431Z",
"structure_string": "Ti4 Cu18 B12 O44\n1.0\n7.401458 -0.085299 -0.968700\n-0.423035 10.365761 -2.661758\n-0.242504 0.098068 11.815435\nTi Cu B O\n4 18 12 44\ndirect\n0.884546 0.914757 0.067614 Ti\n0.610523 0.099527 0.951718 Ti\n0.389477 0.900473 0.048282 Ti\n0.115454 0.085243 0.932385 Ti\n0.946447 0.213303 0.697070 Cu\n0.433061 0.217802 0.711551 Cu\n0.077423 0.765022 0.872704 Cu\n0.868799 0.503999 0.611339 Cu\n0.183961 0.357679 0.981225 Cu\n0.381555 0.500866 0.612059 Cu\n0.053553 0.786697 0.302930 Cu\n0.242978 0.002221 0.510461 Cu\n0.131201 0.496001 0.388661 Cu\n0.566939 0.782198 0.288449 Cu\n0.329111 0.632018 0.010303 Cu\n0.922577 0.234978 0.127296 Cu\n0.670889 0.367982 0.989697 Cu\n0.757022 0.997779 0.489539 Cu\n0.369533 0.232505 0.203715 Cu\n0.630467 0.767495 0.796285 Cu\n0.816039 0.642321 0.018775 Cu\n0.618445 0.499134 0.387941 Cu\n0.181509 0.259515 0.480543 B\n0.487878 0.934762 0.696440 B\n0.036257 0.072830 0.313650 B\n0.328538 0.744413 0.532396 B\n0.568681 0.496182 0.794479 B\n0.431319 0.503818 0.205521 B\n0.942596 0.503913 0.206161 B\n0.963743 0.927170 0.686350 B\n0.671462 0.255587 0.467604 B\n0.512122 0.065238 0.303560 B\n0.818491 0.740485 0.519457 B\n0.057404 0.496087 0.793839 B\n0.933722 0.053361 0.205187 O\n0.906593 0.801225 0.631319 O\n0.078057 0.973301 0.365900 O\n0.446710 0.398151 0.725921 O\n0.809314 0.608502 0.494941 O\n0.659748 0.244520 0.085016 O\n0.190686 0.391498 0.505059 O\n0.957520 0.395260 0.251532 O\n0.251731 0.189098 0.558370 O\n0.832003 0.760387 0.918387 O\n0.366539 0.054688 0.961231 O\n0.921943 0.026699 0.634100 O\n0.448246 0.805098 0.636578 O\n0.236653 0.816576 0.464161 O\n0.748269 0.810902 0.441630 O\n0.426453 0.778418 0.139413 O\n0.553290 0.601849 0.274079 O\n0.042480 0.604740 0.748468 O\n0.878231 0.079212 0.981738 O\n0.121769 0.920788 0.018262 O\n0.840491 0.505270 0.100918 O\n0.053080 0.605072 0.281504 O\n0.946920 0.394928 0.718496 O\n0.586926 0.968254 0.346778 O\n0.913062 0.786080 0.149748 O\n0.581834 0.589877 0.731618 O\n0.763347 0.183424 0.535839 O\n0.607884 0.951161 0.799202 O\n0.684513 0.387198 0.494792 O\n0.093407 0.198775 0.368681 O\n0.167997 0.239613 0.081613 O\n0.418166 0.410123 0.268382 O\n0.653129 0.504900 0.906054 O\n0.346871 0.495100 0.093946 O\n0.551754 0.194902 0.363422 O\n0.315487 0.612802 0.505208 O\n0.392116 0.048839 0.200798 O\n0.066278 0.946639 0.794813 O\n0.573547 0.221582 0.860587 O\n0.340252 0.755480 0.914984 O\n0.633461 0.945312 0.038769 O\n0.086938 0.213920 0.850252 O\n0.159509 0.494730 0.899082 O\n0.413074 0.031746 0.653222 O\n",
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{
"id": "mp-1227583",
"created_at": "2022-09-04T14:40:33.050549Z",
"structure_string": "Ca2 Lu4 Ge8 O24\n1.0\n7.064428 -7.081784 0.000000\n7.064428 7.081784 0.000000\n0.000000 0.000000 5.051833\nCa Lu Ge O\n2 4 8 24\ndirect\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.500000 Lu\n0.250000 0.250000 0.500000 Lu\n0.750000 0.750000 0.500000 Lu\n0.981628 0.249370 0.997808 Ge\n0.018372 0.750630 0.002192 Ge\n0.481628 0.749370 0.002192 Ge\n0.518372 0.250630 0.997808 Ge\n0.250630 0.518372 0.002192 Ge\n0.749370 0.481628 0.997808 Ge\n0.750630 0.018372 0.997808 Ge\n0.249370 0.981628 0.002192 Ge\n0.323034 0.073977 0.252247 O\n0.670299 0.558222 0.265094 O\n0.829701 0.941778 0.265094 O\n0.176966 0.426023 0.252247 O\n0.676966 0.926023 0.747753 O\n0.329701 0.441778 0.734906 O\n0.170299 0.058222 0.734906 O\n0.823034 0.573977 0.747753 O\n0.426023 0.176966 0.747753 O\n0.941778 0.829701 0.734906 O\n0.558222 0.670299 0.734906 O\n0.073977 0.323034 0.747753 O\n0.573977 0.823034 0.252247 O\n0.058222 0.170299 0.265094 O\n0.441778 0.329701 0.265094 O\n0.926023 0.676966 0.252247 O\n0.869875 0.369875 0.150526 O\n0.121914 0.878086 0.170965 O\n0.378086 0.621914 0.170965 O\n0.630125 0.130125 0.150526 O\n0.130125 0.630125 0.849474 O\n0.878086 0.121914 0.829035 O\n0.621914 0.378086 0.829035 O\n0.369875 0.869875 0.849474 O\n",
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{
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{
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"structure_string": "Ba4 Co1 Ni3 S8\n1.0\n4.423211 -9.011161 0.000000\n4.423211 9.011161 0.000000\n0.000000 0.000000 4.439189\nBa Co Ni S\n4 1 3 8\ndirect\n0.975000 0.025000 0.000000 Ba\n0.473473 0.526527 0.000000 Ba\n0.027938 0.476553 0.500000 Ba\n0.523447 0.972062 0.500000 Ba\n0.668125 0.331875 0.000000 Co\n0.168293 0.831707 0.000000 Ni\n0.333294 0.168529 0.500000 Ni\n0.831471 0.666706 0.500000 Ni\n0.868018 0.619163 0.000000 S\n0.380837 0.131982 0.000000 S\n0.125877 0.874123 0.500000 S\n0.626643 0.373357 0.500000 S\n0.296611 0.703389 0.000000 S\n0.794308 0.205692 0.000000 S\n0.703700 0.797036 0.500000 S\n0.202964 0.296300 0.500000 S\n",
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{
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"structure_string": "Li6 Co4 Si4 O16\n1.0\n6.430823 0.000000 0.000000\n0.000000 5.053124 0.000000\n0.000000 0.089147 10.593786\nLi Co Si O\n6 4 4 16\ndirect\n0.241172 0.240487 0.841085 Li\n0.758828 0.240487 0.341085 Li\n0.751541 0.740513 0.659396 Li\n0.508038 0.746693 0.422722 Li\n0.491962 0.746693 0.922722 Li\n0.248459 0.740513 0.159396 Li\n0.233769 0.729091 0.665266 Co\n0.766231 0.729091 0.165266 Co\n0.744094 0.246916 0.832195 Co\n0.255906 0.246916 0.332195 Co\n0.005467 0.737228 0.410583 Si\n0.994533 0.737228 0.910583 Si\n0.512256 0.235589 0.091858 Si\n0.487744 0.235589 0.591858 Si\n0.219560 0.863215 0.342684 O\n0.211670 0.846450 0.842566 O\n0.999527 0.801104 0.059836 O\n0.013586 0.414804 0.384575 O\n0.986414 0.414804 0.884575 O\n0.000473 0.801104 0.559836 O\n0.788330 0.846450 0.342566 O\n0.780440 0.863215 0.842684 O\n0.710813 0.355283 0.168290 O\n0.699940 0.345662 0.663258 O\n0.491801 0.339278 0.442195 O\n0.516638 0.908225 0.095929 O\n0.483362 0.908225 0.595929 O\n0.508199 0.339278 0.942195 O\n0.300060 0.345662 0.163258 O\n0.289187 0.355283 0.668290 O\n",
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