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{
"id": "mp-759949",
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"structure_string": "Li8 Cr8 F32\n1.0\n5.111123 7.853583 0.000000\n-5.111123 7.853583 0.000000\n0.000000 1.366991 7.235246\nLi Cr F\n8 8 32\ndirect\n0.888713 0.486847 0.891563 Li\n0.486847 0.888713 0.391563 Li\n0.611128 0.618009 0.158837 Li\n0.618009 0.611128 0.658837 Li\n0.381991 0.388872 0.341163 Li\n0.388872 0.381991 0.841163 Li\n0.513153 0.111287 0.608437 Li\n0.111287 0.513153 0.108437 Li\n0.821009 0.828898 0.089551 Cr\n0.828898 0.821009 0.589551 Cr\n0.744326 0.250748 0.998209 Cr\n0.749252 0.255674 0.501791 Cr\n0.250748 0.744326 0.498209 Cr\n0.255674 0.749252 0.001791 Cr\n0.171102 0.178991 0.410449 Cr\n0.178991 0.171102 0.910449 Cr\n0.889499 0.762904 0.337594 F\n0.968245 0.167762 0.398758 F\n0.895770 0.609273 0.680032 F\n0.824223 0.618483 0.087205 F\n0.762904 0.889499 0.837594 F\n0.950725 0.268648 0.002390 F\n0.747322 0.454979 0.506210 F\n0.609273 0.895770 0.180032 F\n0.618483 0.824223 0.587205 F\n0.832238 0.031755 0.101242 F\n0.815054 0.184946 0.750000 F\n0.672595 0.327405 0.250000 F\n0.731352 0.049275 0.497610 F\n0.681021 0.471449 0.901476 F\n0.471449 0.681021 0.401476 F\n0.454979 0.747322 0.006210 F\n0.268648 0.950725 0.502390 F\n0.545021 0.252678 0.993790 F\n0.528551 0.318979 0.598524 F\n0.318979 0.528551 0.098524 F\n0.327405 0.672595 0.750000 F\n0.184946 0.815054 0.250000 F\n0.167762 0.968245 0.898758 F\n0.381517 0.175777 0.412795 F\n0.390727 0.104230 0.819968 F\n0.252678 0.545021 0.493790 F\n0.049275 0.731352 0.997610 F\n0.237096 0.110501 0.162406 F\n0.175777 0.381517 0.912795 F\n0.104230 0.390727 0.319968 F\n0.031755 0.832238 0.601242 F\n0.110501 0.237096 0.662406 F\n",
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{
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"created_at": "2022-09-04T14:39:18.889776Z",
"structure_string": "Fe2 Co2 Bi4 As4 O24\n1.0\n6.188640 0.000000 0.000000\n0.429558 9.089468 0.000000\n1.231353 2.907760 8.710331\nFe Co Bi As O\n2 2 4 4 24\ndirect\n0.000000 0.000000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.319984 0.092431 0.608582 Bi\n0.680016 0.907569 0.391418 Bi\n0.316302 0.592991 0.606976 Bi\n0.683698 0.407009 0.393024 Bi\n0.204046 0.158973 0.220394 As\n0.795954 0.841027 0.779606 As\n0.207651 0.657510 0.217318 As\n0.792349 0.342490 0.782682 As\n0.235256 0.341413 0.085996 O\n0.764744 0.658587 0.914004 O\n0.620520 0.133127 0.450695 O\n0.379480 0.866873 0.549305 O\n0.140181 0.673689 0.395503 O\n0.859819 0.326311 0.604497 O\n0.445435 0.555095 0.188327 O\n0.554565 0.444905 0.811673 O\n0.618491 0.632827 0.451023 O\n0.381509 0.367173 0.548977 O\n0.258215 0.611957 0.913293 O\n0.741785 0.388043 0.086707 O\n0.443449 0.058743 0.193374 O\n0.556551 0.941257 0.806626 O\n0.231970 0.840835 0.086445 O\n0.768030 0.159165 0.913555 O\n0.139989 0.178539 0.397375 O\n0.860011 0.821461 0.602625 O\n0.983964 0.069970 0.186382 O\n0.016036 0.930030 0.813618 O\n0.287251 0.113145 0.909984 O\n0.712749 0.886855 0.090016 O\n0.985476 0.568034 0.185434 O\n0.014524 0.431966 0.814566 O\n",
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"formula_full": "Fe2 Co2 Bi4 As4 O24",
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{
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"structure_string": "Li4 P8 W4 O28\n1.0\n8.298821 0.000000 0.000000\n0.000000 7.374563 0.000000\n0.000000 3.525058 9.230458\nLi P W O\n4 8 4 28\ndirect\n0.521840 0.701393 0.773187 Li\n0.978160 0.701393 0.273187 Li\n0.021840 0.298607 0.726813 Li\n0.478160 0.298607 0.226813 Li\n0.742823 0.917428 0.958215 P\n0.757177 0.917428 0.458215 P\n0.283653 0.666261 0.549666 P\n0.783653 0.333739 0.950334 P\n0.216347 0.666261 0.049666 P\n0.716347 0.333739 0.450334 P\n0.242823 0.082572 0.541785 P\n0.257177 0.082572 0.041785 P\n0.998759 0.744078 0.748542 W\n0.501241 0.744078 0.248542 W\n0.498759 0.255922 0.751458 W\n0.001241 0.255922 0.251458 W\n0.587362 0.955343 0.866107 O\n0.872270 0.814586 0.906338 O\n0.912638 0.955343 0.366107 O\n0.325028 0.873102 0.566282 O\n0.209129 0.683881 0.891398 O\n0.781518 0.814444 0.620911 O\n0.627730 0.814586 0.406338 O\n0.112216 0.605783 0.608618 O\n0.174972 0.873102 0.066282 O\n0.290871 0.683881 0.391398 O\n0.916669 0.451633 0.849753 O\n0.718482 0.814444 0.120911 O\n0.416669 0.548367 0.650247 O\n0.612216 0.394217 0.891382 O\n0.387784 0.605783 0.108618 O\n0.583331 0.451633 0.349753 O\n0.281518 0.185556 0.879089 O\n0.083331 0.548367 0.150247 O\n0.709129 0.316119 0.608602 O\n0.825028 0.126898 0.933718 O\n0.887784 0.394217 0.391382 O\n0.372270 0.185414 0.593662 O\n0.218482 0.185556 0.379089 O\n0.790871 0.316119 0.108602 O\n0.674972 0.126898 0.433718 O\n0.087362 0.044657 0.633893 O\n0.127730 0.185414 0.093662 O\n0.412638 0.044657 0.133893 O\n",
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"formula_full": "Li4 P8 W4 O28",
"formula_reduced": "LiP2WO7",
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{
"id": "mp-1218156",
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"structure_string": "Sr1 La1 Mn1 O4\n1.0\n3.889727 0.000000 0.000000\n0.000000 3.889727 0.000000\n1.944863 1.944863 6.433409\nSr La Mn O\n1 1 1 4\ndirect\n0.356797 0.356797 0.286405 Sr\n0.643437 0.643437 0.713126 La\n0.997170 0.997170 0.005660 Mn\n0.505573 0.005573 0.988853 O\n0.005573 0.505573 0.988853 O\n0.167807 0.167807 0.664385 O\n0.823642 0.823642 0.352716 O\n",
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],
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"formula_full": "Sr1 La1 Mn1 O4",
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{
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"created_at": "2022-09-04T14:39:32.028520Z",
"structure_string": "Eu4 Ge8 Pt8\n1.0\n4.723100 0.000000 0.000000\n0.000000 9.373735 0.000000\n0.000000 0.225867 10.298523\nEu Ge Pt\n4 8 8\ndirect\n0.758480 0.629845 0.754906 Eu\n0.741520 0.129845 0.754906 Eu\n0.258480 0.870155 0.245094 Eu\n0.241520 0.370155 0.245094 Eu\n0.735511 0.374002 0.999387 Ge\n0.688576 0.108477 0.382178 Ge\n0.311424 0.891523 0.617822 Ge\n0.264489 0.625998 0.000613 Ge\n0.764489 0.874002 0.999387 Ge\n0.188576 0.391523 0.617822 Ge\n0.235511 0.125998 0.000613 Ge\n0.811424 0.608477 0.382178 Ge\n0.176264 0.140808 0.499934 Pt\n0.236925 0.378924 0.875220 Pt\n0.763075 0.621076 0.124780 Pt\n0.823736 0.859192 0.500066 Pt\n0.676264 0.359192 0.500066 Pt\n0.736925 0.121076 0.124780 Pt\n0.323736 0.640808 0.499934 Pt\n0.263075 0.878924 0.875220 Pt\n",
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{
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"structure_string": "Dy2 H2 O4\n1.0\n1.764920 -3.056931 0.000000\n1.764920 3.056931 0.000000\n0.000000 0.000000 9.224384\nDy H O\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Dy\n0.000000 0.000000 0.500000 Dy\n0.333333 0.666667 0.250000 H\n0.666667 0.333333 0.750000 H\n0.333333 0.666667 0.117094 O\n0.333333 0.666667 0.382906 O\n0.666667 0.333333 0.882906 O\n0.666667 0.333333 0.617094 O\n",
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{
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"structure_string": "C40 Cl32\n1.0\n7.777979 0.000000 0.000000\n0.000000 9.929241 0.000000\n0.000000 7.390667 18.438372\nC Cl\n40 32\ndirect\n0.888131 0.742298 0.345781 C\n0.111869 0.257702 0.654219 C\n0.388131 0.257702 0.154219 C\n0.611869 0.742298 0.845781 C\n0.869773 0.876890 0.192741 C\n0.130227 0.123110 0.807259 C\n0.369773 0.123110 0.307259 C\n0.630227 0.876890 0.692741 C\n0.864781 0.892160 0.313996 C\n0.135219 0.107840 0.686004 C\n0.364781 0.107840 0.186004 C\n0.635219 0.892160 0.813996 C\n0.357856 0.817554 0.376556 C\n0.642144 0.182446 0.623444 C\n0.857856 0.182446 0.123444 C\n0.142144 0.817554 0.876556 C\n0.317373 0.905677 0.416362 C\n0.682627 0.094323 0.583638 C\n0.817373 0.094323 0.083638 C\n0.182627 0.905677 0.916362 C\n0.925763 0.661076 0.302253 C\n0.074237 0.338924 0.697747 C\n0.425763 0.338924 0.197747 C\n0.574237 0.661076 0.802253 C\n0.821333 0.943734 0.117822 C\n0.178667 0.056266 0.882178 C\n0.321333 0.056266 0.382178 C\n0.678667 0.943734 0.617822 C\n0.918222 0.727053 0.227149 C\n0.081778 0.272947 0.772851 C\n0.418222 0.272947 0.272851 C\n0.581778 0.727053 0.727149 C\n0.378558 0.878934 0.301483 C\n0.621442 0.121066 0.698517 C\n0.878558 0.121066 0.198517 C\n0.121442 0.878934 0.801483 C\n0.870850 0.966050 0.236394 C\n0.129150 0.033950 0.763606 C\n0.370850 0.033950 0.263606 C\n0.629150 0.966050 0.736394 C\n0.876960 0.366562 0.078136 Cl\n0.123040 0.633438 0.921864 Cl\n0.376960 0.633438 0.421864 Cl\n0.623040 0.366562 0.578136 Cl\n0.983091 0.481787 0.343104 Cl\n0.016909 0.518213 0.656896 Cl\n0.483091 0.518213 0.156896 Cl\n0.516909 0.481787 0.843104 Cl\n0.747864 0.844050 0.068950 Cl\n0.252136 0.155950 0.931050 Cl\n0.247864 0.155950 0.431050 Cl\n0.752136 0.844050 0.568950 Cl\n0.426211 0.760818 0.258974 Cl\n0.573789 0.239182 0.741026 Cl\n0.926211 0.239182 0.241026 Cl\n0.073789 0.760818 0.758974 Cl\n0.814163 0.978957 0.372018 Cl\n0.185837 0.021043 0.627982 Cl\n0.314163 0.021043 0.127982 Cl\n0.685837 0.978957 0.872018 Cl\n0.989883 0.627999 0.177765 Cl\n0.010117 0.372001 0.822235 Cl\n0.489883 0.372001 0.322235 Cl\n0.510117 0.627999 0.677765 Cl\n0.234888 0.825547 0.006402 Cl\n0.765112 0.174453 0.993598 Cl\n0.734888 0.174453 0.493598 Cl\n0.265112 0.825547 0.506402 Cl\n0.876804 0.654002 0.438161 Cl\n0.123196 0.345998 0.561839 Cl\n0.376804 0.345998 0.061839 Cl\n0.623196 0.654002 0.938161 Cl\n",
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{
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"structure_string": "Ca4 Co4 O10\n1.0\n5.203313 0.000000 0.000000\n0.000000 5.368280 0.000000\n0.000000 0.007073 7.960632\nCa Co O\n4 4 10\ndirect\n0.475534 0.703840 0.247989 Ca\n0.975534 0.296160 0.752011 Ca\n0.031107 0.210196 0.250699 Ca\n0.531107 0.789804 0.749301 Ca\n0.008479 0.746981 0.979460 Co\n0.508479 0.253019 0.020540 Co\n0.508228 0.249777 0.479966 Co\n0.008228 0.750223 0.520034 Co\n0.101146 0.727395 0.756853 O\n0.601146 0.272605 0.243147 O\n0.208570 0.466315 0.456848 O\n0.708570 0.533685 0.543152 O\n0.268377 0.961360 0.055525 O\n0.768377 0.038640 0.944475 O\n0.206186 0.468160 0.050817 O\n0.706186 0.531840 0.949183 O\n0.768168 0.037261 0.556384 O\n0.268168 0.962739 0.443616 O\n",
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{
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