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{
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"structure_string": "Ca6 Mn4 O14\n1.0\n0.000013 -0.000004 -5.361439\n0.000200 -5.321748 -0.000004\n-9.745208 -2.660505 0.000023\nCa Mn O\n6 4 14\ndirect\n0.293405 0.755616 0.000010 Ca\n0.793406 0.244383 0.999989 Ca\n0.211838 0.569030 0.374416 Ca\n0.711829 0.056645 0.374403 Ca\n0.711831 0.430968 0.625579 Ca\n0.211820 0.943363 0.625592 Ca\n0.250285 0.152538 0.196282 Mn\n0.750286 0.651296 0.196282 Mn\n0.750266 0.847438 0.803725 Mn\n0.250267 0.348719 0.803725 Mn\n0.235776 0.318372 0.999997 O\n0.735774 0.681633 0.999993 O\n0.043418 0.040230 0.831797 O\n0.543419 0.127880 0.831756 O\n0.543419 0.959769 0.168204 O\n0.043418 0.872119 0.168243 O\n0.958809 0.567716 0.777648 O\n0.458813 0.654520 0.777625 O\n0.458814 0.432280 0.222354 O\n0.958814 0.345484 0.222376 O\n0.261063 0.394604 0.608273 O\n0.761080 0.996936 0.608273 O\n0.761068 0.605400 0.391729 O\n0.261082 0.003058 0.391730 O\n",
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{
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"structure_string": "Y10 Si6\n1.0\n4.229683 -7.326025 0.000000\n4.229683 7.326025 0.000000\n0.000000 0.000000 6.387596\nY Si\n10 6\ndirect\n0.000000 0.756633 0.750000 Y\n0.000000 0.243367 0.250000 Y\n0.756633 0.756633 0.250000 Y\n0.756633 0.000000 0.750000 Y\n0.243367 0.243367 0.750000 Y\n0.243367 0.000000 0.250000 Y\n0.333333 0.666667 0.500000 Y\n0.666667 0.333333 0.000000 Y\n0.666667 0.333333 0.500000 Y\n0.333333 0.666667 0.000000 Y\n0.394389 0.000000 0.750000 Si\n0.394389 0.394389 0.250000 Si\n0.000000 0.605611 0.250000 Si\n0.000000 0.394389 0.750000 Si\n0.605611 0.605611 0.750000 Si\n0.605611 0.000000 0.250000 Si\n",
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{
"id": "mp-1195741",
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"structure_string": "Co8 Te4 S4 O32\n1.0\n7.303384 0.000000 0.000000\n0.000000 8.456070 0.000000\n0.000000 0.000000 10.139019\nCo Te S O\n8 4 4 32\ndirect\n0.686486 0.049187 0.918404 Co\n0.313514 0.549187 0.081596 Co\n0.686486 0.950813 0.581596 Co\n0.313514 0.450813 0.418404 Co\n0.313514 0.950813 0.081596 Co\n0.686486 0.450813 0.918404 Co\n0.313514 0.049187 0.418404 Co\n0.686486 0.549187 0.581596 Co\n0.629280 0.250000 0.213947 Te\n0.370720 0.750000 0.786053 Te\n0.629280 0.750000 0.286053 Te\n0.370720 0.250000 0.713947 Te\n0.056325 0.250000 0.030157 S\n0.943675 0.750000 0.969843 S\n0.056325 0.750000 0.469843 S\n0.943675 0.250000 0.530157 S\n0.436293 0.250000 0.339480 O\n0.563707 0.750000 0.660520 O\n0.436293 0.750000 0.160520 O\n0.563707 0.250000 0.839480 O\n0.035133 0.250000 0.172360 O\n0.964867 0.750000 0.827640 O\n0.035133 0.750000 0.327640 O\n0.964867 0.250000 0.672360 O\n0.865420 0.250000 0.966487 O\n0.134580 0.750000 0.033513 O\n0.865420 0.750000 0.533513 O\n0.134580 0.250000 0.466487 O\n0.757027 0.000000 0.750000 O\n0.242973 0.500000 0.250000 O\n0.242973 0.000000 0.250000 O\n0.757027 0.500000 0.750000 O\n0.550587 0.418085 0.100270 O\n0.449413 0.918085 0.899730 O\n0.550587 0.581915 0.399730 O\n0.449413 0.081915 0.600270 O\n0.449413 0.581915 0.899730 O\n0.550587 0.081915 0.100270 O\n0.449413 0.418085 0.600270 O\n0.550587 0.918085 0.399730 O\n0.845018 0.893015 0.021424 O\n0.154982 0.393015 0.978576 O\n0.845018 0.106985 0.478576 O\n0.154982 0.606985 0.521424 O\n0.154982 0.106985 0.978576 O\n0.845018 0.606985 0.021424 O\n0.154982 0.893015 0.521424 O\n0.845018 0.393015 0.478576 O\n",
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"density_atomic": 0.07665713702867212,
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{
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"created_at": "2022-09-04T14:45:36.588445Z",
"structure_string": "Co2 C8 N12\n1.0\n6.079277 0.000000 0.000000\n0.000000 7.147182 0.000000\n0.000000 0.000000 7.342145\nCo C N\n2 8 12\ndirect\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.743488 0.155812 0.653812 C\n0.243488 0.344188 0.846188 C\n0.743488 0.155812 0.346188 C\n0.243488 0.344188 0.153812 C\n0.756512 0.655812 0.153812 C\n0.256512 0.844188 0.346188 C\n0.256512 0.844188 0.653812 C\n0.756512 0.655812 0.846188 C\n0.825327 0.728435 0.000000 N\n0.325327 0.771565 0.500000 N\n0.799520 0.098504 0.203650 N\n0.299520 0.401496 0.296350 N\n0.700480 0.598504 0.296350 N\n0.200480 0.901496 0.203650 N\n0.200480 0.901496 0.796350 N\n0.700480 0.598504 0.703650 N\n0.299520 0.401496 0.703650 N\n0.799520 0.098504 0.796350 N\n0.674673 0.228435 0.500000 N\n0.174673 0.271565 0.000000 N\n",
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"formula_full": "Co2 C8 N12",
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{
"id": "mp-19035",
"created_at": "2022-09-04T14:45:57.806889Z",
"structure_string": "Ba1 Fe1 O3\n1.0\n4.033045 0.000000 0.000000\n0.000000 4.033045 0.000000\n0.000000 0.000000 4.033045\nBa Fe O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Fe\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
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{
"id": "mp-1191888",
"created_at": "2022-09-04T14:45:36.621539Z",
"structure_string": "K4 Ag4 C4 O12\n1.0\n-2.930722 2.969093 10.238903\n2.930722 -2.969093 10.238903\n2.930722 2.969093 -10.238903\nK Ag C O\n4 4 4 12\ndirect\n0.069717 0.319717 0.750000 K\n0.430283 0.180283 0.250000 K\n0.930283 0.680283 0.250000 K\n0.569717 0.819717 0.750000 K\n0.132970 0.250000 0.382970 Ag\n0.367030 0.750000 0.117030 Ag\n0.867030 0.750000 0.617030 Ag\n0.632970 0.250000 0.882970 Ag\n0.373147 0.623147 0.750000 C\n0.126853 0.876853 0.250000 C\n0.626853 0.376853 0.250000 C\n0.873147 0.123147 0.750000 C\n0.436003 0.686003 0.750000 O\n0.063997 0.813997 0.250000 O\n0.563997 0.313997 0.250000 O\n0.936003 0.186003 0.750000 O\n0.464099 0.441279 0.722011 O\n0.219268 0.742088 0.777989 O\n0.035901 0.757912 0.977181 O\n0.280732 0.058721 0.522819 O\n0.535901 0.558721 0.277989 O\n0.780732 0.257912 0.222011 O\n0.964099 0.242088 0.022819 O\n0.719268 0.941279 0.477181 O\n",
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{
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"structure_string": "Sr6 Fe4 O10\n1.0\n3.393595 -4.078005 -0.000018\n0.000009 2.039056 10.616191\n-3.393596 -4.078006 -0.000023\nSr Fe O\n6 4 10\ndirect\n0.500000 0.000002 0.000000 Sr\n0.000001 0.000002 0.500001 Sr\n0.593694 0.374758 0.093691 Sr\n0.093691 0.374758 0.593694 Sr\n0.906307 0.625245 0.406310 Sr\n0.406310 0.625246 0.906307 Sr\n0.548260 0.193053 0.548257 Fe\n0.951741 0.806949 0.951743 Fe\n0.048252 0.193064 0.048271 Fe\n0.451736 0.806906 0.451721 Fe\n0.500002 0.000001 0.499999 O\n0.000000 0.000002 0.000001 O\n0.702017 0.808027 0.702013 O\n0.202015 0.808027 0.202019 O\n0.297984 0.191977 0.297985 O\n0.797987 0.191977 0.797986 O\n0.595759 0.383089 0.595762 O\n0.095760 0.383088 0.095760 O\n0.404241 0.616915 0.404241 O\n0.904241 0.616915 0.904239 O\n",
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{
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"formula_full": "Mn12 W12 C4",
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"spacegroup": 227
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{
"id": "mp-11371",
"created_at": "2022-09-04T14:45:57.872075Z",
"structure_string": "Er1 In1 Pd2\n1.0\n0.000000 3.385185 3.385185\n3.385185 0.000000 3.385185\n3.385185 3.385185 0.000000\nEr In Pd\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Er\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Pd\n",
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{
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"created_at": "2022-09-04T14:45:36.587748Z",
"structure_string": "Ca8 B4 Cl4 O12\n1.0\n8.753609 0.000000 0.000000\n0.000000 3.983749 0.000000\n0.000000 2.241865 12.314240\nCa B Cl O\n8 4 4 12\ndirect\n0.620861 0.670504 0.883442 Ca\n0.379139 0.329496 0.116558 Ca\n0.117989 0.706685 0.860469 Ca\n0.879139 0.670504 0.383442 Ca\n0.617989 0.293315 0.639531 Ca\n0.382011 0.706685 0.360469 Ca\n0.882011 0.293315 0.139531 Ca\n0.120861 0.329496 0.616558 Ca\n0.633591 0.710142 0.155702 B\n0.866409 0.710142 0.655702 B\n0.366409 0.289858 0.844298 B\n0.133591 0.289858 0.344298 B\n0.874807 0.200170 0.912854 Cl\n0.125193 0.799830 0.087146 Cl\n0.374807 0.799830 0.587146 Cl\n0.625193 0.200170 0.412854 Cl\n0.489565 0.801219 0.187622 O\n0.989565 0.198781 0.312378 O\n0.769594 0.775755 0.205170 O\n0.640992 0.519188 0.072495 O\n0.010435 0.801219 0.687622 O\n0.730406 0.775755 0.705170 O\n0.510435 0.198781 0.812378 O\n0.269594 0.224245 0.294830 O\n0.359008 0.480812 0.927505 O\n0.140992 0.480812 0.427505 O\n0.859008 0.519188 0.572495 O\n0.230406 0.224245 0.794830 O\n",
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