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{
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{
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{
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{
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{
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"structure_string": "K1 Rb1 Mg6 O7\n1.0\n4.303524 0.000000 0.000000\n0.000000 4.303524 0.000000\n0.000000 0.000000 11.501414\nK Rb Mg O\n1 1 6 7\ndirect\n0.000000 0.000000 0.007009 K\n0.500000 0.500000 0.979685 Rb\n0.000000 0.000000 0.503000 Mg\n0.500000 0.500000 0.484231 Mg\n0.000000 0.500000 0.269098 Mg\n0.000000 0.500000 0.674932 Mg\n0.500000 0.000000 0.269098 Mg\n0.500000 0.000000 0.674932 Mg\n0.000000 0.000000 0.685653 O\n0.500000 0.500000 0.311169 O\n0.500000 0.500000 0.685937 O\n0.000000 0.500000 0.108250 O\n0.000000 0.500000 0.494379 O\n0.500000 0.000000 0.108250 O\n0.500000 0.000000 0.494379 O\n",
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{
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"created_at": "2022-09-04T14:42:53.527032Z",
"structure_string": "Co5 Ni1 S8\n1.0\n0.000000 4.651446 4.651446\n4.651446 0.000000 4.651446\n4.651446 4.651446 0.000000\nCo Ni S\n5 1 8\ndirect\n0.625362 0.625362 0.123913 Co\n0.625362 0.123913 0.625362 Co\n0.123913 0.625362 0.625362 Co\n0.625362 0.625362 0.625362 Co\n0.250000 0.250000 0.250000 Co\n0.000000 0.000000 0.000000 Ni\n0.865720 0.865720 0.402841 S\n0.865720 0.402841 0.865720 S\n0.402841 0.865720 0.865720 S\n0.865720 0.865720 0.865720 S\n0.382375 0.382375 0.852876 S\n0.382375 0.852876 0.382375 S\n0.852876 0.382375 0.382375 S\n0.382375 0.382375 0.382375 S\n",
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{
"id": "mp-27067",
"created_at": "2022-09-04T14:42:53.575471Z",
"structure_string": "Li14 Mo8 P18 O64\n1.0\n14.131536 0.000000 0.000000\n0.000000 14.131536 0.000000\n0.000000 0.000000 6.603434\nLi Mo P O\n14 8 18 64\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.132136 Li\n0.500000 0.000000 0.632136 Li\n0.745576 0.111832 0.797061 Li\n0.611832 0.245576 0.297061 Li\n0.111832 0.254424 0.202939 Li\n0.245576 0.388168 0.702939 Li\n0.000000 0.500000 0.367864 Li\n0.000000 0.500000 0.867864 Li\n0.500000 0.500000 0.500000 Li\n0.754424 0.611832 0.702939 Li\n0.888168 0.745576 0.202939 Li\n0.388168 0.754424 0.297061 Li\n0.254424 0.888168 0.797061 Li\n0.198744 0.120981 0.618561 Mo\n0.879019 0.198744 0.381439 Mo\n0.379019 0.301256 0.118561 Mo\n0.698744 0.379019 0.881439 Mo\n0.301256 0.620981 0.881439 Mo\n0.620981 0.698744 0.118561 Mo\n0.120981 0.801256 0.381439 Mo\n0.801256 0.879019 0.618561 Mo\n0.309741 0.939610 0.383257 P\n0.752176 0.897826 0.128450 P\n0.439610 0.809741 0.883257 P\n0.102174 0.752176 0.871550 P\n0.602174 0.747824 0.628450 P\n0.939610 0.690259 0.616743 P\n0.252176 0.602174 0.371550 P\n0.809741 0.560390 0.116743 P\n0.000000 0.000000 0.500000 P\n0.690259 0.060390 0.383257 P\n0.247824 0.102174 0.128450 P\n0.560390 0.190259 0.883257 P\n0.897826 0.247824 0.871550 P\n0.500000 0.500000 0.000000 P\n0.060390 0.309741 0.616743 P\n0.747824 0.397826 0.371550 P\n0.190259 0.439610 0.116743 P\n0.397826 0.252176 0.628450 P\n0.916443 0.554173 0.114895 O\n0.259635 0.981366 0.571244 O\n0.062936 0.940358 0.354818 O\n0.416443 0.945827 0.385105 O\n0.940358 0.937064 0.645182 O\n0.445827 0.916443 0.885105 O\n0.810513 0.904784 0.935486 O\n0.658116 0.846605 0.109555 O\n0.729407 0.007014 0.181592 O\n0.740365 0.018634 0.571244 O\n0.937064 0.059642 0.354818 O\n0.583557 0.054173 0.385105 O\n0.059642 0.062936 0.645182 O\n0.554173 0.083557 0.885105 O\n0.189487 0.095216 0.935486 O\n0.183895 0.141833 0.297446 O\n0.341884 0.153395 0.109555 O\n0.346605 0.158116 0.609555 O\n0.726293 0.162853 0.350617 O\n0.858167 0.183895 0.702554 O\n0.904784 0.189487 0.064514 O\n0.662853 0.226293 0.850617 O\n0.507014 0.229407 0.681592 O\n0.518634 0.240365 0.071244 O\n0.018634 0.259635 0.428756 O\n0.007014 0.270593 0.818408 O\n0.162853 0.273707 0.649383 O\n0.404784 0.310513 0.435486 O\n0.358167 0.316105 0.797446 O\n0.226293 0.337147 0.149383 O\n0.846605 0.341884 0.890445 O\n0.841884 0.346605 0.390445 O\n0.683895 0.358167 0.202554 O\n0.689487 0.404784 0.564514 O\n0.054173 0.416443 0.614895 O\n0.559642 0.437064 0.854818 O\n0.083557 0.445827 0.114895 O\n0.437064 0.440358 0.145182 O\n0.240365 0.481366 0.928756 O\n0.229407 0.492986 0.318408 O\n0.770593 0.507014 0.318408 O\n0.759635 0.518634 0.928756 O\n0.562936 0.559642 0.145182 O\n0.270593 0.992986 0.181592 O\n0.440358 0.562936 0.854818 O\n0.945827 0.583557 0.614895 O\n0.310513 0.595216 0.564514 O\n0.316105 0.641833 0.202554 O\n0.158116 0.653395 0.390445 O\n0.153395 0.658116 0.890445 O\n0.773707 0.662853 0.149383 O\n0.641833 0.683895 0.797446 O\n0.595216 0.689487 0.435486 O\n0.837147 0.726293 0.649383 O\n0.992986 0.729407 0.818408 O\n0.981366 0.740365 0.428756 O\n0.481366 0.759635 0.071244 O\n0.492986 0.770593 0.681592 O\n0.337147 0.773707 0.850617 O\n0.095216 0.810513 0.064514 O\n0.141833 0.816105 0.702554 O\n0.273707 0.837147 0.350617 O\n0.653395 0.841884 0.609555 O\n0.816105 0.858167 0.297446 O\n",
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{
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{
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{
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},
{
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"structure_string": "Li2 Mn2 O8\n1.0\n2.770877 -4.252360 0.000000\n2.770877 4.252360 0.000000\n0.000000 0.000000 6.582667\nLi Mn O\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.354179 0.645821 0.750000 Mn\n0.645821 0.354179 0.250000 Mn\n0.245075 0.754925 0.949120 O\n0.705748 0.776756 0.750000 O\n0.754925 0.245075 0.050880 O\n0.754925 0.245075 0.449120 O\n0.245075 0.754925 0.550880 O\n0.776756 0.705748 0.250000 O\n0.223244 0.294252 0.750000 O\n0.294252 0.223244 0.250000 O\n",
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"volume": 155.1240566761314,
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"formula_full": "Li2 Mn2 O8",
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},
{
"id": "mp-1217444",
"created_at": "2022-09-04T14:42:53.540977Z",
"structure_string": "Ti7 P12 C6 N2 O48\n1.0\n6.461823 -8.523985 0.000000\n6.461823 8.523985 0.000000\n-4.782421 0.000000 9.567755\nTi P C N O\n7 12 6 2 48\ndirect\n0.500000 0.500000 0.500000 Ti\n0.265045 0.379473 0.839019 Ti\n0.839019 0.265045 0.379473 Ti\n0.379473 0.839019 0.265045 Ti\n0.734955 0.620527 0.160981 Ti\n0.160981 0.734955 0.620527 Ti\n0.620527 0.160981 0.734955 Ti\n0.413281 0.520833 0.176223 P\n0.176223 0.413281 0.520833 P\n0.520833 0.176223 0.413281 P\n0.586719 0.479167 0.823777 P\n0.823777 0.586719 0.479167 P\n0.479167 0.823777 0.586719 P\n0.921399 0.329958 0.738904 P\n0.738904 0.921399 0.329958 P\n0.329958 0.738904 0.921399 P\n0.078601 0.670042 0.261096 P\n0.261096 0.078601 0.670042 P\n0.670042 0.261096 0.078601 P\n0.990036 0.023563 0.884754 C\n0.884754 0.990036 0.023563 C\n0.023563 0.884754 0.990036 C\n0.009964 0.976437 0.115246 C\n0.115246 0.009964 0.976437 C\n0.976437 0.115246 0.009964 C\n0.899925 0.899925 0.899925 N\n0.100075 0.100075 0.100075 N\n0.923685 0.478333 0.802285 O\n0.802285 0.923685 0.478333 O\n0.478333 0.802285 0.923685 O\n0.076315 0.521667 0.197715 O\n0.197715 0.076315 0.521667 O\n0.521667 0.197715 0.076315 O\n0.234523 0.183906 0.782025 O\n0.782025 0.234523 0.183906 O\n0.183906 0.782025 0.234523 O\n0.765477 0.816094 0.217975 O\n0.217975 0.765477 0.816094 O\n0.816094 0.217975 0.765477 O\n0.211856 0.359158 0.640023 O\n0.640023 0.211856 0.359158 O\n0.359158 0.640023 0.211856 O\n0.788144 0.640842 0.359977 O\n0.359977 0.788144 0.640842 O\n0.640842 0.359977 0.788144 O\n0.307413 0.401146 0.037744 O\n0.037744 0.307413 0.401146 O\n0.401146 0.037744 0.307413 O\n0.692587 0.598854 0.962256 O\n0.962256 0.692587 0.598854 O\n0.598854 0.962256 0.692587 O\n0.445961 0.470308 0.299116 O\n0.299116 0.445961 0.470308 O\n0.470308 0.299116 0.445961 O\n0.554039 0.529692 0.700884 O\n0.700884 0.554039 0.529692 O\n0.529692 0.700884 0.554039 O\n0.450567 0.422694 0.850617 O\n0.850617 0.450567 0.422694 O\n0.422694 0.850617 0.450567 O\n0.549433 0.577306 0.149383 O\n0.149383 0.549433 0.577306 O\n0.577306 0.149383 0.549433 O\n0.289730 0.581056 0.887249 O\n0.887249 0.289730 0.581056 O\n0.581056 0.887249 0.289730 O\n0.710270 0.418944 0.112751 O\n0.112751 0.710270 0.418944 O\n0.418944 0.112751 0.710270 O\n0.067363 0.332781 0.814994 O\n0.814994 0.067363 0.332781 O\n0.332781 0.814994 0.067363 O\n0.932637 0.667219 0.185006 O\n0.185006 0.932637 0.667219 O\n0.667219 0.185006 0.932637 O\n",
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"formula_full": "Ti7 P12 C6 N2 O48",
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}
]
}