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{
"id": "mp-1046151",
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{
"id": "mp-1163942",
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"structure_string": "Al8 V12 Si12 O48\n1.0\n-5.879822 5.879822 5.879822\n5.879822 -5.879822 5.879822\n5.879822 5.879822 -5.879822\nAl V Si O\n8 12 12 48\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.500000 Al\n0.500000 0.500000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.875000 0.750000 0.625000 V\n0.875000 0.625000 0.250000 V\n0.625000 0.875000 0.750000 V\n0.250000 0.875000 0.625000 V\n0.750000 0.625000 0.875000 V\n0.625000 0.250000 0.875000 V\n0.125000 0.250000 0.375000 V\n0.125000 0.375000 0.750000 V\n0.375000 0.125000 0.250000 V\n0.750000 0.125000 0.375000 V\n0.250000 0.375000 0.125000 V\n0.375000 0.750000 0.125000 V\n0.125000 0.750000 0.875000 Si\n0.750000 0.875000 0.125000 Si\n0.250000 0.625000 0.375000 Si\n0.625000 0.750000 0.375000 Si\n0.875000 0.125000 0.750000 Si\n0.375000 0.250000 0.625000 Si\n0.375000 0.625000 0.750000 Si\n0.250000 0.125000 0.875000 Si\n0.625000 0.375000 0.250000 Si\n0.125000 0.875000 0.250000 Si\n0.750000 0.375000 0.625000 Si\n0.875000 0.250000 0.125000 Si\n0.581388 0.894087 0.381758 O\n0.381758 0.581388 0.894087 O\n0.300369 0.312699 0.918612 O\n0.487670 0.605913 0.187301 O\n0.312699 0.894087 0.012330 O\n0.118242 0.012330 0.199631 O\n0.381758 0.300369 0.487670 O\n0.894087 0.381758 0.581388 O\n0.187301 0.199631 0.581388 O\n0.487670 0.381758 0.300369 O\n0.894087 0.012330 0.312699 O\n0.605913 0.918612 0.118242 O\n0.918612 0.118242 0.605913 O\n0.300369 0.487670 0.381758 O\n0.581388 0.187301 0.199631 O\n0.199631 0.581388 0.187301 O\n0.012330 0.312699 0.894087 O\n0.918612 0.300369 0.312699 O\n0.012330 0.199631 0.118242 O\n0.812699 0.800369 0.418612 O\n0.312699 0.918612 0.300369 O\n0.605913 0.187301 0.487670 O\n0.199631 0.118242 0.012330 O\n0.118242 0.605913 0.918612 O\n0.418612 0.105913 0.618242 O\n0.618242 0.418612 0.105913 O\n0.699631 0.687301 0.081388 O\n0.512330 0.394087 0.812699 O\n0.687301 0.105913 0.987670 O\n0.881758 0.987670 0.800369 O\n0.618242 0.699631 0.512330 O\n0.105913 0.618242 0.418612 O\n0.881758 0.394087 0.081388 O\n0.800369 0.881758 0.987670 O\n0.394087 0.812699 0.512330 O\n0.687301 0.081388 0.699631 O\n0.812699 0.512330 0.394087 O\n0.987670 0.800369 0.881758 O\n0.081388 0.699631 0.687301 O\n0.987670 0.687301 0.105913 O\n0.800369 0.418612 0.812699 O\n0.418612 0.812699 0.800369 O\n0.699631 0.512330 0.618242 O\n0.081388 0.881758 0.394087 O\n0.394087 0.081388 0.881758 O\n0.105913 0.987670 0.687301 O\n0.512330 0.618242 0.699631 O\n0.187301 0.487670 0.605913 O\n",
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"elements": [
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],
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"density": 3.945816175868906,
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"formula_full": "Al8 V12 Si12 O48",
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{
"id": "mp-766885",
"created_at": "2022-09-04T14:42:59.598104Z",
"structure_string": "Sb18 P6 O42\n1.0\n6.794550 6.773369 0.000000\n-6.794550 6.773369 0.000000\n0.000000 4.226541 11.767947\nSb P O\n18 6 42\ndirect\n0.123750 0.439422 0.048835 Sb\n0.439422 0.123750 0.048835 Sb\n0.179108 0.485948 0.377198 Sb\n0.485948 0.179108 0.377198 Sb\n0.196457 0.822727 0.178441 Sb\n0.822727 0.196457 0.178441 Sb\n0.534061 0.222537 0.728536 Sb\n0.222537 0.534061 0.728536 Sb\n0.116333 0.819304 0.496337 Sb\n0.819304 0.116333 0.496337 Sb\n0.174314 0.834722 0.837331 Sb\n0.834722 0.174314 0.837331 Sb\n0.819725 0.485793 0.324852 Sb\n0.485793 0.819725 0.324852 Sb\n0.510119 0.873725 0.623739 Sb\n0.873725 0.510119 0.623739 Sb\n0.483890 0.838341 0.926352 Sb\n0.838341 0.483890 0.926352 Sb\n0.167584 0.167584 0.285675 P\n0.174893 0.174893 0.914768 P\n0.504233 0.504233 0.461491 P\n0.478174 0.478174 0.876734 P\n0.858123 0.858123 0.350114 P\n0.821644 0.821644 0.726616 P\n0.071766 0.071766 0.396324 O\n0.263288 0.073379 0.216100 O\n0.073379 0.263288 0.216100 O\n0.073792 0.073792 0.885625 O\n0.272064 0.272064 0.316279 O\n0.600036 0.162875 0.226501 O\n0.162875 0.600036 0.226501 O\n0.078471 0.264159 0.991090 O\n0.264159 0.078471 0.991090 O\n0.274210 0.274210 0.809800 O\n0.081502 0.593436 0.558927 O\n0.593436 0.081502 0.558927 O\n0.403070 0.403070 0.561290 O\n0.500006 0.500006 0.339731 O\n0.546979 0.081567 0.886197 O\n0.081567 0.546979 0.886197 O\n0.263144 0.775656 0.338342 O\n0.775656 0.263144 0.338342 O\n0.369913 0.369913 0.975160 O\n0.890347 0.417852 0.095426 O\n0.417852 0.890347 0.095426 O\n0.225782 0.754689 0.691001 O\n0.754689 0.225782 0.691001 O\n0.665221 0.470273 0.472880 O\n0.470273 0.665221 0.472880 O\n0.579405 0.392314 0.799956 O\n0.392314 0.579405 0.799956 O\n0.764101 0.271386 0.970987 O\n0.271386 0.764101 0.970987 O\n0.963390 0.428760 0.421733 O\n0.428760 0.963390 0.421733 O\n0.751989 0.751989 0.332723 O\n0.570392 0.570392 0.920340 O\n0.926869 0.389175 0.767801 O\n0.389175 0.926869 0.767801 O\n0.954802 0.766866 0.424477 O\n0.766866 0.954802 0.424477 O\n0.849992 0.660656 0.722558 O\n0.660656 0.849992 0.722558 O\n0.952013 0.952013 0.240574 O\n0.846875 0.846875 0.834371 O\n0.917553 0.917553 0.612871 O\n",
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],
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"formula_full": "Sb18 P6 O42",
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"spacegroup": 8
},
{
"id": "mp-707169",
"created_at": "2022-09-04T14:42:59.599111Z",
"structure_string": "Cu8 H32 C24 Cl8 O16\n1.0\n6.360270 0.000000 0.000000\n0.000000 8.800446 0.000000\n0.000000 0.000000 20.733086\nCu H C Cl O\n8 32 24 8 16\ndirect\n0.871561 0.345127 0.321559 Cu\n0.628439 0.845127 0.678441 Cu\n0.371561 0.654873 0.178441 Cu\n0.128439 0.154873 0.821559 Cu\n0.128439 0.654873 0.678441 Cu\n0.371561 0.154873 0.321559 Cu\n0.628439 0.345127 0.821559 Cu\n0.871561 0.845127 0.178441 Cu\n0.608523 0.396574 0.507674 H\n0.891477 0.896574 0.492326 H\n0.108523 0.603426 0.992326 H\n0.391477 0.103426 0.007674 H\n0.391477 0.603426 0.492326 H\n0.108523 0.103426 0.507674 H\n0.891477 0.396574 0.007674 H\n0.608523 0.896574 0.992326 H\n0.842933 0.624503 0.350593 H\n0.657067 0.124503 0.649407 H\n0.342933 0.375497 0.149407 H\n0.157067 0.875497 0.850593 H\n0.157067 0.375497 0.649407 H\n0.342933 0.875497 0.350593 H\n0.657067 0.624503 0.850593 H\n0.842933 0.124503 0.149407 H\n0.091546 0.377031 0.425868 H\n0.408454 0.877031 0.574132 H\n0.591546 0.622969 0.074132 H\n0.908454 0.122969 0.925868 H\n0.908454 0.622969 0.574132 H\n0.591546 0.122969 0.425868 H\n0.408454 0.377031 0.925868 H\n0.091546 0.877031 0.074132 H\n0.191323 0.494285 0.357812 H\n0.308677 0.994285 0.642188 H\n0.691323 0.505715 0.142188 H\n0.808677 0.005715 0.857812 H\n0.808677 0.505715 0.642188 H\n0.691323 0.005715 0.357812 H\n0.308677 0.494285 0.857812 H\n0.191323 0.994285 0.142188 H\n0.698907 0.510509 0.432047 C\n0.801093 0.010509 0.567953 C\n0.198907 0.489491 0.067953 C\n0.301093 0.989491 0.932047 C\n0.301093 0.489491 0.567953 C\n0.198907 0.989491 0.432047 C\n0.801093 0.510509 0.932047 C\n0.698907 0.010509 0.067953 C\n0.864523 0.526806 0.382249 C\n0.635477 0.026806 0.617751 C\n0.364523 0.473194 0.117751 C\n0.135477 0.973194 0.882249 C\n0.135477 0.473194 0.617751 C\n0.364523 0.973194 0.382249 C\n0.635477 0.526806 0.882249 C\n0.864523 0.026806 0.117751 C\n0.057497 0.453128 0.385698 C\n0.442503 0.953128 0.614302 C\n0.557497 0.546872 0.114302 C\n0.942503 0.046872 0.885698 C\n0.942503 0.546872 0.614302 C\n0.557497 0.046872 0.385698 C\n0.442503 0.453128 0.885698 C\n0.057497 0.953128 0.114302 C\n0.047555 0.152734 0.276034 Cl\n0.452445 0.652734 0.723966 Cl\n0.547555 0.847266 0.223966 Cl\n0.952445 0.347266 0.776034 Cl\n0.952445 0.847266 0.723966 Cl\n0.547555 0.347266 0.276034 Cl\n0.452445 0.152734 0.776034 Cl\n0.047555 0.652734 0.223966 Cl\n0.721092 0.393466 0.471791 O\n0.778908 0.893466 0.528209 O\n0.221092 0.606534 0.028209 O\n0.278908 0.106534 0.971791 O\n0.278908 0.606534 0.528209 O\n0.221092 0.106534 0.471791 O\n0.778908 0.393466 0.971791 O\n0.721092 0.893466 0.028209 O\n0.553057 0.604636 0.435628 O\n0.946943 0.104636 0.564372 O\n0.053057 0.395364 0.064372 O\n0.446943 0.895364 0.935628 O\n0.446943 0.395364 0.564372 O\n0.053057 0.895364 0.435628 O\n0.946943 0.604636 0.935628 O\n0.553057 0.104636 0.064372 O\n",
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"formula_full": "Cu8 H32 C24 Cl8 O16",
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{
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"structure_string": "Cd6 I12\n1.0\n2.166090 -3.751777 0.000000\n2.166090 3.751777 0.000000\n0.000000 0.000000 44.388783\nCd I\n6 12\ndirect\n0.333333 0.666667 0.833330 Cd\n0.000000 0.000000 0.000000 Cd\n0.000000 0.000000 0.333358 Cd\n0.000000 0.000000 0.500000 Cd\n0.666667 0.333333 0.166670 Cd\n0.000000 0.000000 0.666642 Cd\n0.666667 0.333333 0.961157 I\n0.000000 0.000000 0.872255 I\n0.000000 0.000000 0.127745 I\n0.666667 0.333333 0.627752 I\n0.333333 0.666667 0.372248 I\n0.333333 0.666667 0.205604 I\n0.666667 0.333333 0.794396 I\n0.333333 0.666667 0.705600 I\n0.333333 0.666667 0.038843 I\n0.666667 0.333333 0.461159 I\n0.666667 0.333333 0.294400 I\n0.333333 0.666667 0.538841 I\n",
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{
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"structure_string": "Na4 Co2 As2 C2 O14\n1.0\n6.600877 0.000000 0.000000\n0.000000 5.367240 0.000000\n0.000000 0.448261 9.117953\nNa Co As C O\n4 2 2 2 14\ndirect\n0.499796 0.768885 0.773862 Na\n0.000204 0.768885 0.773862 Na\n0.500204 0.231115 0.226138 Na\n0.999796 0.231115 0.226138 Na\n0.250000 0.214288 0.655814 Co\n0.750000 0.785712 0.344186 Co\n0.750000 0.295382 0.569108 As\n0.250000 0.704618 0.430892 As\n0.250000 0.278627 0.922244 C\n0.750000 0.721373 0.077756 C\n0.750000 0.714070 0.940998 O\n0.250000 0.064521 0.855858 O\n0.250000 0.471399 0.830242 O\n0.953502 0.208664 0.678493 O\n0.546498 0.208664 0.678493 O\n0.250000 0.847839 0.593890 O\n0.750000 0.620010 0.540615 O\n0.250000 0.379990 0.459385 O\n0.750000 0.152161 0.406110 O\n0.453502 0.791336 0.321507 O\n0.046498 0.791336 0.321507 O\n0.750000 0.528601 0.169758 O\n0.750000 0.935479 0.144142 O\n0.250000 0.285930 0.059002 O\n",
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{
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