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{
"id": "mp-674478",
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{
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{
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"structure_string": "Li4 Nb4 F20\n1.0\n7.705033 4.943753 0.000000\n-7.705033 4.943753 0.000000\n0.000000 0.952885 5.193466\nLi Nb F\n4 4 20\ndirect\n0.858302 0.482141 0.428686 Li\n0.517859 0.141698 0.571314 Li\n0.482141 0.858302 0.428686 Li\n0.141698 0.517859 0.571314 Li\n0.807676 0.192324 0.000000 Nb\n0.748017 0.748017 0.753323 Nb\n0.251983 0.251983 0.246677 Nb\n0.192324 0.807676 0.000000 Nb\n0.928429 0.341355 0.652966 F\n0.978217 0.783364 0.876033 F\n0.658645 0.071571 0.347034 F\n0.823353 0.393653 0.130958 F\n0.606347 0.176647 0.869042 F\n0.871472 0.871472 0.428022 F\n0.727040 0.540942 0.640065 F\n0.783364 0.978217 0.876033 F\n0.654543 0.654543 0.102876 F\n0.459058 0.272960 0.359935 F\n0.540942 0.727040 0.640065 F\n0.345457 0.345457 0.897124 F\n0.216636 0.021783 0.123967 F\n0.272960 0.459058 0.359935 F\n0.128528 0.128528 0.571978 F\n0.393653 0.823353 0.130958 F\n0.176647 0.606347 0.869042 F\n0.341355 0.928429 0.652966 F\n0.021783 0.216636 0.123967 F\n0.071571 0.658645 0.347034 F\n",
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{
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"structure_string": "Al12 W3\n1.0\n8.919650 2.639871 0.000000\n-8.919650 2.639871 0.000000\n0.000000 0.910964 5.164719\nAl W\n12 3\ndirect\n0.145287 0.145287 0.487796 Al\n0.503125 0.503125 0.849577 Al\n0.582545 0.736309 0.314436 Al\n0.736309 0.582545 0.314436 Al\n0.695102 0.931638 0.786325 Al\n0.931638 0.695102 0.786325 Al\n0.058486 0.305486 0.192061 Al\n0.305486 0.058486 0.192061 Al\n0.450593 0.920652 0.416353 Al\n0.920652 0.450593 0.416353 Al\n0.773035 0.272804 0.926266 Al\n0.272804 0.773035 0.926266 Al\n0.989897 0.989897 0.007686 W\n0.192013 0.466028 0.669029 W\n0.466028 0.192013 0.669029 W\n",
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"formula_full": "Al12 W3",
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{
"id": "mp-1214089",
"created_at": "2022-09-04T14:39:44.563054Z",
"structure_string": "Ca10 As6 C2 O24\n1.0\n5.015897 -8.687788 0.000000\n5.015897 8.687788 0.000000\n0.000000 0.000000 7.002940\nCa As C O\n10 6 2 24\ndirect\n0.333333 0.666667 0.001508 Ca\n0.666667 0.333333 0.998492 Ca\n0.666667 0.333333 0.501508 Ca\n0.333333 0.666667 0.498492 Ca\n0.263409 0.252888 0.250000 Ca\n0.736591 0.747112 0.750000 Ca\n0.747112 0.010521 0.250000 Ca\n0.252888 0.989479 0.750000 Ca\n0.989479 0.736591 0.250000 Ca\n0.010521 0.263409 0.750000 Ca\n0.398259 0.027685 0.250000 As\n0.601741 0.972315 0.750000 As\n0.972315 0.370574 0.250000 As\n0.027685 0.629426 0.750000 As\n0.629426 0.601741 0.250000 As\n0.370574 0.398259 0.750000 As\n0.000000 0.000000 0.250000 C\n0.000000 0.000000 0.750000 C\n0.166650 0.495812 0.250000 O\n0.833350 0.504188 0.750000 O\n0.504188 0.670838 0.250000 O\n0.495812 0.329162 0.750000 O\n0.329162 0.833350 0.250000 O\n0.670838 0.166650 0.750000 O\n0.598501 0.132617 0.250000 O\n0.401499 0.867383 0.750000 O\n0.867383 0.465884 0.250000 O\n0.132617 0.534116 0.750000 O\n0.534116 0.401499 0.250000 O\n0.465884 0.598501 0.750000 O\n0.343639 0.093102 0.055488 O\n0.656361 0.906898 0.944512 O\n0.906898 0.250536 0.055488 O\n0.656361 0.906898 0.555488 O\n0.093102 0.749464 0.944512 O\n0.343639 0.093102 0.444512 O\n0.749464 0.656361 0.055488 O\n0.093102 0.749464 0.555488 O\n0.250536 0.343639 0.944512 O\n0.906898 0.250536 0.444512 O\n0.250536 0.343639 0.555488 O\n0.749464 0.656361 0.444512 O\n",
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"formula_full": "Ca10 As6 C2 O24",
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{
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{
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{
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"structure_string": "Li6 Cr2 Co4 O12\n1.0\n0.000502 -1.557368 2.548359\n-9.401536 -1.351462 -2.578492\n2.423779 -5.321121 -5.007572\nLi Cr Co O\n6 2 4 12\ndirect\n0.917395 0.251077 0.583890 Li\n0.415905 0.749069 0.083153 Li\n0.741516 0.752402 0.743295 Li\n0.244719 0.255547 0.246674 Li\n0.089377 0.750043 0.423687 Li\n0.587156 0.249214 0.919669 Li\n0.164702 0.500017 0.834552 Cr\n0.663701 0.000877 0.332145 Cr\n0.000917 0.004989 0.000953 Co\n0.498890 0.506324 0.496253 Co\n0.331332 0.997055 0.670573 Co\n0.830152 0.497727 0.167694 Co\n0.618161 0.117413 0.123868 O\n0.120013 0.618621 0.626949 O\n0.711700 0.885683 0.542573 O\n0.214145 0.387005 0.044714 O\n0.282184 0.111457 0.458769 O\n0.784078 0.608803 0.964808 O\n0.045626 0.888298 0.208229 O\n0.545749 0.389701 0.706500 O\n0.952694 0.115060 0.794793 O\n0.449998 0.612970 0.293726 O\n0.378656 0.887154 0.873841 O\n0.876466 0.388687 0.368822 O\n",
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{
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"structure_string": "Ba2 Nd1 Nb1 O6\n1.0\n3.064134 5.295252 0.000000\n-3.064134 5.295252 0.000000\n0.000000 3.564470 5.046682\nBa Nd Nb O\n2 1 1 6\ndirect\n0.248424 0.248424 0.257373 Ba\n0.751576 0.751576 0.742627 Ba\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Nb\n0.301356 0.768543 0.694541 O\n0.231457 0.698644 0.305459 O\n0.698644 0.231457 0.305459 O\n0.768543 0.301356 0.694541 O\n0.730377 0.730377 0.205186 O\n0.269623 0.269623 0.794814 O\n",
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{
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{
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