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{
"id": "mp-11806",
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"structure_string": "Li1 Mg1 Sn1 Pt1\n1.0\n0.000000 3.249276 3.249276\n3.249276 0.000000 3.249276\n3.249276 3.249276 0.000000\nLi Mg Sn Pt\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Li\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Pt\n",
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{
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"structure_string": "Cs12 Pu4 H16 O28\n1.0\n6.960557 0.000000 -0.093363\n0.000000 12.053097 0.000000\n0.069003 0.000000 12.552253\nCs Pu H O\n12 4 16 28\ndirect\n0.794912 0.120473 0.550945 Cs\n0.294912 0.379527 0.050945 Cs\n0.205088 0.879527 0.449055 Cs\n0.705088 0.620473 0.949055 Cs\n0.773672 0.278963 0.254710 Cs\n0.273672 0.221037 0.754710 Cs\n0.226328 0.721037 0.745290 Cs\n0.726328 0.778963 0.245290 Cs\n0.823203 0.962865 0.865271 Cs\n0.323203 0.537135 0.365271 Cs\n0.176797 0.037135 0.134729 Cs\n0.676797 0.462865 0.634729 Cs\n0.789231 0.293730 0.906886 Pu\n0.289231 0.206270 0.406886 Pu\n0.210769 0.706270 0.093114 Pu\n0.710769 0.793730 0.593114 Pu\n0.047649 0.470020 0.865139 H\n0.547649 0.029980 0.365139 H\n0.952351 0.529980 0.134861 H\n0.452351 0.970020 0.634861 H\n0.496055 0.128720 0.950796 H\n0.996055 0.371280 0.450796 H\n0.503945 0.871280 0.049204 H\n0.003945 0.628720 0.549204 H\n0.121247 0.454673 0.704404 H\n0.621247 0.045327 0.204404 H\n0.878753 0.545327 0.295596 H\n0.378753 0.954673 0.795596 H\n0.152968 0.420101 0.582632 H\n0.652968 0.079899 0.082632 H\n0.847032 0.579899 0.417368 H\n0.347032 0.920101 0.917368 H\n0.767896 0.207595 0.779618 O\n0.267896 0.292405 0.279618 O\n0.232104 0.792405 0.220382 O\n0.732104 0.707595 0.720382 O\n0.576050 0.381676 0.861342 O\n0.076050 0.118324 0.361342 O\n0.423950 0.618324 0.138658 O\n0.923950 0.881676 0.638658 O\n0.810651 0.383133 0.032079 O\n0.310651 0.116867 0.532079 O\n0.189349 0.616867 0.967921 O\n0.689349 0.883133 0.467921 O\n0.000556 0.205996 0.952057 O\n0.500556 0.294004 0.452057 O\n0.999444 0.794004 0.047943 O\n0.499444 0.705996 0.547943 O\n0.000855 0.414207 0.815149 O\n0.500855 0.085793 0.315149 O\n0.999145 0.585793 0.184851 O\n0.499145 0.914207 0.684851 O\n0.579175 0.171695 0.997808 O\n0.079175 0.328305 0.497808 O\n0.420825 0.828305 0.002192 O\n0.920825 0.671695 0.502192 O\n0.190047 0.478306 0.637544 O\n0.690047 0.021694 0.137544 O\n0.809953 0.521694 0.362456 O\n0.309953 0.978306 0.862456 O\n",
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"formula_full": "Cs12 Pu4 H16 O28",
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{
"id": "mp-724172",
"created_at": "2022-09-04T14:40:27.596387Z",
"structure_string": "N1 Cl1 O4\n1.0\n0.000000 3.855625 3.855625\n3.855625 0.000000 3.855625\n3.855625 3.855625 0.000000\nN Cl O\n1 1 4\ndirect\n0.500000 0.500000 0.500000 N\n0.000000 0.000000 0.000000 Cl\n0.109389 0.109389 0.671834 O\n0.109389 0.671834 0.109389 O\n0.671834 0.109389 0.109389 O\n0.109389 0.109389 0.109389 O\n",
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"spacegroup": 216
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{
"id": "mp-28813",
"created_at": "2022-09-04T14:40:31.398353Z",
"structure_string": "Si6 C2 Cl16\n1.0\n9.040040 0.000000 0.000000\n-1.993552 9.279324 0.000000\n-4.171980 -2.080343 8.433043\nSi C Cl\n6 2 16\ndirect\n0.979737 0.291951 0.227842 Si\n0.897798 0.565811 0.405078 Si\n0.705384 0.219435 0.341351 Si\n0.020263 0.708049 0.772158 Si\n0.294616 0.780565 0.658649 Si\n0.102202 0.434189 0.594922 Si\n0.087215 0.635618 0.618800 C\n0.912785 0.364382 0.381200 C\n0.670708 0.577883 0.396302 Cl\n0.916246 0.674021 0.240266 Cl\n0.722250 0.008024 0.303132 Cl\n0.277750 0.991976 0.696868 Cl\n0.083754 0.325979 0.759734 Cl\n0.503569 0.767879 0.853101 Cl\n0.644136 0.235157 0.521930 Cl\n0.355864 0.764843 0.478070 Cl\n0.085274 0.122573 0.282336 Cl\n0.914726 0.877427 0.717664 Cl\n0.773805 0.215407 0.005745 Cl\n0.226195 0.784593 0.994255 Cl\n0.155911 0.446060 0.203445 Cl\n0.844089 0.553940 0.796555 Cl\n0.329292 0.422117 0.603698 Cl\n0.496431 0.232121 0.146899 Cl\n",
"nsites": 24,
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"elements": [
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"density": 1.7834762103378898,
"density_atomic": 0.03392659198574047,
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{
"id": "mp-558345",
"created_at": "2022-09-04T14:40:27.615789Z",
"structure_string": "Zn2 Fe4 Se8 O24\n1.0\n8.188540 0.000000 0.000000\n0.000000 8.192550 0.000000\n0.000000 0.325896 8.330483\nZn Fe Se O\n2 4 8 24\ndirect\n0.601541 0.344497 0.163139 Zn\n0.398459 0.844497 0.163139 Zn\n0.760608 0.750422 0.000217 Fe\n0.739922 0.243894 0.508525 Fe\n0.239392 0.250422 0.000217 Fe\n0.260078 0.743894 0.508525 Fe\n0.095486 0.549768 0.191225 Se\n0.904514 0.049768 0.191225 Se\n0.571930 0.450696 0.820634 Se\n0.324519 0.167109 0.414562 Se\n0.057045 0.419240 0.680059 Se\n0.428070 0.950696 0.820634 Se\n0.675481 0.667109 0.414562 Se\n0.942955 0.919240 0.680059 Se\n0.963384 0.698341 0.119495 O\n0.309726 0.009392 0.987727 O\n0.161792 0.256981 0.776048 O\n0.666512 0.459595 0.366869 O\n0.751734 0.176832 0.269004 O\n0.192534 0.491014 0.019756 O\n0.218879 0.512610 0.578639 O\n0.626537 0.758312 0.226272 O\n0.719253 0.348448 0.721544 O\n0.333488 0.959595 0.366869 O\n0.972559 0.315674 0.521064 O\n0.482416 0.293724 0.938476 O\n0.838208 0.756981 0.776048 O\n0.502978 0.694151 0.522646 O\n0.280747 0.848448 0.721544 O\n0.248266 0.676832 0.269004 O\n0.373463 0.258312 0.226272 O\n0.036616 0.198341 0.119495 O\n0.027441 0.815674 0.521064 O\n0.517584 0.793724 0.938476 O\n0.690274 0.509391 0.987727 O\n0.781121 0.012610 0.578639 O\n0.497022 0.194151 0.522646 O\n0.807466 0.991014 0.019756 O\n",
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{
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{
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"structure_string": "Zn4 As2 O10\n1.0\n-5.722683 0.000000 0.000000\n-0.171512 -5.886848 0.000000\n1.660652 1.714748 6.401463\nZn As O\n4 2 10\ndirect\n0.394105 0.245221 0.500471 Zn\n0.605895 0.754779 0.499529 Zn\n0.028858 0.737476 0.189244 Zn\n0.971142 0.262524 0.810756 Zn\n0.827849 0.245345 0.270137 As\n0.172151 0.754655 0.729863 As\n0.765857 0.957771 0.138224 O\n0.234143 0.042229 0.861776 O\n0.941633 0.389993 0.120875 O\n0.058367 0.610007 0.879125 O\n0.576800 0.386854 0.334433 O\n0.423200 0.613146 0.665567 O\n0.953655 0.743508 0.498128 O\n0.046345 0.256492 0.501872 O\n0.349129 0.898355 0.321274 O\n0.650871 0.101645 0.678726 O\n",
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{
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{
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