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{
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{
"id": "mp-1206116",
"created_at": "2022-09-04T14:47:19.550889Z",
"structure_string": "Y2 Fe4 Si2 C2\n1.0\n1.876408 -5.211105 0.000000\n1.876408 5.211105 0.000000\n0.000000 0.000000 6.742886\nY Fe Si C\n2 4 2 2\ndirect\n0.549344 0.450656 0.250000 Y\n0.450656 0.549344 0.750000 Y\n0.834453 0.165547 0.062725 Fe\n0.165547 0.834453 0.937275 Fe\n0.165547 0.834453 0.562725 Fe\n0.834453 0.165547 0.437275 Fe\n0.269036 0.730964 0.250000 Si\n0.730964 0.269036 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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{
"id": "mp-1182735",
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"structure_string": "Fe4 P4 H20 C4 O32\n1.0\n7.092117 0.000000 -1.545767\n0.000000 9.775142 0.000000\n0.445772 0.000000 10.562714\nFe P H C O\n4 4 20 4 32\ndirect\n0.378185 0.793992 0.058245 Fe\n0.621815 0.293992 0.441755 Fe\n0.378185 0.706008 0.558245 Fe\n0.621815 0.206008 0.941755 Fe\n0.550602 0.891767 0.800907 P\n0.449398 0.108233 0.199093 P\n0.550602 0.608233 0.300907 P\n0.449398 0.391767 0.699093 P\n0.873330 0.303861 0.145392 H\n0.979285 0.168618 0.528649 H\n0.126670 0.803861 0.354608 H\n0.217019 0.020459 0.501327 H\n0.298179 0.329652 0.036604 H\n0.217019 0.479541 0.001327 H\n0.233055 0.365315 0.820952 H\n0.020715 0.831382 0.471351 H\n0.701821 0.829652 0.463396 H\n0.233055 0.134685 0.320952 H\n0.020715 0.668618 0.971351 H\n0.766945 0.634685 0.179048 H\n0.701821 0.670348 0.963396 H\n0.782981 0.979541 0.498673 H\n0.873330 0.196139 0.645392 H\n0.979285 0.331382 0.028649 H\n0.782981 0.520459 0.998673 H\n0.298179 0.170348 0.536604 H\n0.126670 0.696139 0.854608 H\n0.766945 0.865315 0.679048 H\n0.054015 0.069340 0.865254 C\n0.945985 0.930660 0.134746 C\n0.054015 0.430660 0.365254 C\n0.945985 0.569340 0.634746 C\n0.147454 0.680107 0.947264 O\n0.948899 0.158203 0.828861 O\n0.468391 0.296661 0.584950 O\n0.245274 0.148934 0.229323 O\n0.449337 0.956949 0.163359 O\n0.449337 0.543051 0.663359 O\n0.193658 0.118243 0.483595 O\n0.754726 0.648934 0.270677 O\n0.245274 0.351066 0.729323 O\n0.754726 0.851066 0.770677 O\n0.806342 0.618243 0.016405 O\n0.159433 0.982014 0.903284 O\n0.468391 0.203339 0.084950 O\n0.595411 0.135868 0.319503 O\n0.595411 0.364132 0.819503 O\n0.404589 0.635868 0.180497 O\n0.404589 0.864132 0.680497 O\n0.159433 0.517986 0.403284 O\n0.852546 0.319893 0.052736 O\n0.051101 0.841797 0.171139 O\n0.840567 0.482014 0.596716 O\n0.806342 0.881757 0.516405 O\n0.531609 0.703339 0.415050 O\n0.948899 0.341797 0.328861 O\n0.193658 0.381757 0.983595 O\n0.051101 0.658203 0.671139 O\n0.852546 0.180107 0.552736 O\n0.531609 0.796661 0.915050 O\n0.550663 0.456949 0.336641 O\n0.840567 0.017986 0.096716 O\n0.550663 0.043051 0.836641 O\n0.147454 0.819893 0.447264 O\n",
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{
"id": "mp-1103921",
"created_at": "2022-09-04T14:47:16.465622Z",
"structure_string": "Yb1 Mo6 Se8\n1.0\n4.861865 -4.791830 0.000000\n4.861865 4.791830 0.000000\n0.139062 0.000000 6.824956\nYb Mo Se\n1 6 8\ndirect\n0.000000 0.000000 0.000000 Yb\n0.764003 0.576834 0.441205 Mo\n0.441205 0.764003 0.576834 Mo\n0.576834 0.441205 0.764003 Mo\n0.235997 0.423166 0.558795 Mo\n0.558795 0.235997 0.423166 Mo\n0.423166 0.558795 0.235997 Mo\n0.760829 0.760829 0.760829 Se\n0.239171 0.239171 0.239171 Se\n0.247783 0.624717 0.876901 Se\n0.876901 0.247783 0.624717 Se\n0.624717 0.876901 0.247783 Se\n0.752217 0.375283 0.123099 Se\n0.123099 0.752217 0.375283 Se\n0.375283 0.123099 0.752217 Se\n",
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{
"id": "mp-1210813",
"created_at": "2022-09-04T14:47:16.470041Z",
"structure_string": "Lu6 Fe4 Si6\n1.0\n2.015102 -5.136702 0.000000\n2.015102 5.136702 0.000000\n0.000000 0.000000 13.320838\nLu Fe Si\n6 4 6\ndirect\n0.638508 0.361492 0.250000 Lu\n0.361492 0.638508 0.750000 Lu\n0.922065 0.077935 0.113221 Lu\n0.077935 0.922065 0.886779 Lu\n0.077935 0.922065 0.613221 Lu\n0.922065 0.077935 0.386779 Lu\n0.785928 0.214072 0.581423 Fe\n0.214072 0.785928 0.418577 Fe\n0.214072 0.785928 0.081423 Fe\n0.785928 0.214072 0.918577 Fe\n0.329207 0.670793 0.250000 Si\n0.670793 0.329207 0.750000 Si\n0.621130 0.378870 0.038917 Si\n0.378870 0.621130 0.961083 Si\n0.378870 0.621130 0.538917 Si\n0.621130 0.378870 0.461083 Si\n",
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{
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{
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{
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{
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{
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"O"
],
"chemical_system": "Bi-Cr-O-Sb-Sr",
"density": 7.177589745697717,
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"formula_full": "Sr1 Cr1 Bi1 Sb1 O6",
"formula_reduced": "SrCrBiSbO6",
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{
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"structure_string": "Zn1 Cu2 Si1 Se4\n1.0\n-2.795659 2.795659 5.595276\n2.795659 -2.795659 5.595276\n2.795659 2.795659 -5.595276\nZn Cu Si Se\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.250000 0.750000 0.500000 Cu\n0.750000 0.250000 0.500000 Cu\n0.500000 0.500000 0.000000 Si\n0.861814 0.861814 0.472572 Se\n0.389242 0.389242 0.527428 Se\n0.610758 0.138186 0.000000 Se\n0.138186 0.610758 0.000000 Se\n",
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],
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"volume": 174.92420143001448,
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"formula_full": "Zn1 Cu2 Si1 Se4",
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"formula_anonymous": "ABC2D4",
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}
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}