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{
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"formula_full": "C40 Cl32",
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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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"formula_full": "Dy2 H2 O4",
"formula_reduced": "DyHO2",
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{
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{
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"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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"created_at": "2022-09-04T14:39:07.277999Z",
"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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{
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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": "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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{
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{
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}