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{
"id": "mp-561194",
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"structure_string": "La40 S56 O4\n1.0\n-7.697601 7.697601 10.216599\n7.697601 -7.697601 10.216599\n7.697601 7.697601 -10.216599\nLa S O\n40 56 4\ndirect\n0.394012 0.299718 0.350418 La\n0.884623 0.884623 0.269247 La\n0.449300 0.799718 0.905706 La\n0.689101 0.050514 0.373873 La\n0.956406 0.605988 0.905706 La\n0.800514 0.926641 0.861413 La\n0.565228 0.426641 0.126127 La\n0.134623 0.634623 0.769247 La\n0.634623 0.865377 0.500000 La\n0.894012 0.543594 0.094294 La\n0.800700 0.206406 0.850418 La\n0.115377 0.384623 0.000000 La\n0.060899 0.199486 0.126127 La\n0.365377 0.134623 0.500000 La\n0.049718 0.199300 0.405706 La\n0.300514 0.439101 0.873873 La\n0.065228 0.939101 0.138587 La\n0.573359 0.699486 0.138587 La\n0.615377 0.615377 0.730753 La\n0.456406 0.550700 0.350418 La\n0.449486 0.810899 0.626127 La\n0.855988 0.706406 0.405706 La\n0.200282 0.105988 0.649582 La\n0.355988 0.950282 0.149582 La\n0.676641 0.315228 0.626127 La\n0.384623 0.115377 0.000000 La\n0.300700 0.450282 0.594294 La\n0.293594 0.699300 0.149582 La\n0.684772 0.310899 0.361413 La\n0.176641 0.550514 0.361413 La\n0.189101 0.815228 0.638587 La\n0.949486 0.323359 0.638587 La\n0.865377 0.365377 0.230753 La\n0.949300 0.043594 0.649582 La\n0.793594 0.644012 0.594294 La\n0.184772 0.823359 0.373873 La\n0.560899 0.434772 0.861413 La\n0.700282 0.050700 0.094294 La\n0.549718 0.144012 0.850418 La\n0.073359 0.934772 0.873873 La\n0.772328 0.875000 0.397328 S\n0.625000 0.727672 0.602672 S\n0.438910 0.959474 0.834839 S\n0.395929 0.561090 0.520564 S\n0.902370 0.510643 0.657618 S\n0.617740 0.834979 0.859230 S\n0.124635 0.604071 0.165161 S\n0.989357 0.597630 0.342382 S\n0.311090 0.290526 0.665161 S\n0.489357 0.146975 0.391727 S\n0.260643 0.103025 0.108273 S\n0.402370 0.744752 0.391727 S\n0.241490 0.382260 0.217239 S\n0.975749 0.758510 0.140770 S\n0.084979 0.367740 0.359230 S\n0.040526 0.875365 0.479436 S\n0.477672 0.375000 0.602672 S\n0.994752 0.152370 0.891727 S\n0.125000 0.522328 0.897328 S\n0.347630 0.505248 0.108273 S\n0.741490 0.524251 0.859230 S\n0.165021 0.024251 0.782761 S\n0.209474 0.188910 0.334839 S\n0.625000 0.227672 0.102672 S\n0.709474 0.374635 0.020564 S\n0.665021 0.882260 0.140770 S\n0.895929 0.375365 0.834839 S\n0.274251 0.915021 0.282761 S\n0.117740 0.258510 0.782761 S\n0.494752 0.603025 0.842382 S\n0.755248 0.097630 0.608273 S\n0.008510 0.725749 0.640770 S\n0.624635 0.459474 0.520564 S\n0.847630 0.739357 0.842382 S\n0.272328 0.875000 0.897328 S\n0.760643 0.652370 0.157618 S\n0.774251 0.491490 0.359230 S\n0.584979 0.225749 0.717239 S\n0.255248 0.646975 0.657618 S\n0.854071 0.874635 0.665161 S\n0.938910 0.104071 0.479436 S\n0.125000 0.022328 0.397328 S\n0.396975 0.239357 0.891727 S\n0.132260 0.415021 0.640770 S\n0.632260 0.991490 0.717239 S\n0.508510 0.867740 0.282761 S\n0.625365 0.645929 0.334839 S\n0.354071 0.688910 0.979436 S\n0.540526 0.061090 0.165161 S\n0.475749 0.334979 0.217239 S\n0.977672 0.375000 0.102672 S\n0.896975 0.005248 0.157618 S\n0.853025 0.244752 0.342382 S\n0.125365 0.790526 0.979436 S\n0.353025 0.010643 0.608273 S\n0.811090 0.145929 0.020564 S\n0.750000 0.250000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.250000 0.750000 0.500000 O\n0.000000 0.000000 0.000000 O\n",
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"formula_full": "La40 S56 O4",
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{
"id": "mp-720082",
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"structure_string": "K1 Cd6 H4 C12 Cl1 O26\n1.0\n9.360865 0.000000 0.000000\n4.610028 8.208270 0.000000\n4.590995 2.748818 8.895033\nK Cd H C Cl O\n1 6 4 12 1 26\ndirect\n0.993939 0.001552 0.000300 K\n0.276389 0.787144 0.271408 Cd\n0.800680 0.631022 0.270093 Cd\n0.642219 0.293475 0.275171 Cd\n0.349292 0.716833 0.731363 Cd\n0.213153 0.345916 0.720972 Cd\n0.696908 0.208242 0.727934 Cd\n0.858837 0.932902 0.302031 H\n0.945441 0.864552 0.299247 H\n0.142076 0.104934 0.701556 H\n0.061577 0.109036 0.699153 H\n0.572735 0.950405 0.045838 C\n0.424737 0.572653 0.040509 C\n0.559497 0.955749 0.435396 C\n0.977227 0.423546 0.025736 C\n0.036859 0.954749 0.570094 C\n0.049696 0.555735 0.432493 C\n0.942519 0.447886 0.563127 C\n0.955667 0.053195 0.437165 C\n0.045860 0.572962 0.953408 C\n0.444959 0.044198 0.561866 C\n0.564327 0.429634 0.964036 C\n0.428308 0.022734 0.971192 C\n0.455223 0.564036 0.498129 Cl\n0.455789 0.402430 0.638141 O\n0.304694 0.971461 0.038850 O\n0.987118 0.678943 0.022755 O\n0.052286 0.036629 0.309062 O\n0.558940 0.834779 0.172793 O\n0.430985 0.554749 0.168173 O\n0.035581 0.610198 0.301854 O\n0.195010 0.862169 0.539367 O\n0.672708 0.309533 0.030288 O\n0.865613 0.420431 0.153330 O\n0.589309 0.798291 0.471493 O\n0.390448 0.954237 0.692989 O\n0.144240 0.587278 0.466898 O\n0.845660 0.418116 0.530312 O\n0.615989 0.046725 0.305531 O\n0.409764 0.203431 0.525258 O\n0.160944 0.573184 0.826358 O\n0.317384 0.694379 0.974620 O\n0.796846 0.143768 0.467600 O\n0.959179 0.397908 0.691991 O\n0.556566 0.445887 0.837739 O\n0.445335 0.131951 0.842289 O\n0.943885 0.974032 0.698418 O\n0.034033 0.316634 0.957238 O\n0.691532 0.007723 0.976973 O\n0.603038 0.507043 0.361462 O\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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"structure_string": "Co2 Sb4\n1.0\n3.398553 0.000000 0.000000\n0.000000 5.625834 0.000000\n0.000000 0.000000 6.422020\nCo Sb\n2 4\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.201054 0.356842 Sb\n0.000000 0.798946 0.643158 Sb\n0.500000 0.701054 0.143158 Sb\n0.500000 0.298946 0.856842 Sb\n",
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{
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"created_at": "2022-09-04T14:45:59.391650Z",
"structure_string": "Rb4 Zr6 C1 Cl18\n1.0\n8.834296 5.359387 0.000000\n-8.834296 5.359387 0.000000\n0.000000 4.253801 9.068966\nRb Zr C Cl\n4 6 1 18\ndirect\n0.769857 0.446028 0.681958 Rb\n0.553972 0.230143 0.318042 Rb\n0.230143 0.553972 0.318042 Rb\n0.446028 0.769857 0.681958 Rb\n0.121809 0.121809 0.143304 Zr\n0.878191 0.878191 0.856696 Zr\n0.948140 0.764224 0.148903 Zr\n0.235776 0.051860 0.851097 Zr\n0.051860 0.235776 0.851097 Zr\n0.764224 0.948140 0.148903 Zr\n0.000000 0.000000 0.000000 C\n0.807666 0.602821 0.007922 Cl\n0.397180 0.192334 0.992078 Cl\n0.192334 0.397180 0.992078 Cl\n0.602820 0.807666 0.007922 Cl\n0.204511 0.795489 0.000000 Cl\n0.795489 0.204511 0.000000 Cl\n0.319893 0.319893 0.672695 Cl\n0.680107 0.680107 0.327305 Cl\n0.888063 0.493537 0.324016 Cl\n0.506463 0.111937 0.675984 Cl\n0.111937 0.506463 0.675984 Cl\n0.493537 0.888063 0.324016 Cl\n0.262230 0.262230 0.301160 Cl\n0.737770 0.737770 0.698840 Cl\n0.077820 0.873154 0.319980 Cl\n0.126846 0.922180 0.680020 Cl\n0.922180 0.126846 0.680020 Cl\n0.873154 0.077820 0.319980 Cl\n",
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