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{
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{
"id": "mp-684919",
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{
"id": "mp-866302",
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"structure_string": "Ba2 Na2 P6 H6 N6 O12\n1.0\n5.251311 5.464696 0.000000\n-5.251311 5.464696 0.000000\n0.000000 3.450221 7.213240\nBa Na P H N O\n2 2 6 6 6 12\ndirect\n0.568817 0.568817 0.696579 Ba\n0.431183 0.431183 0.303421 Ba\n0.817983 0.182017 0.500000 Na\n0.182017 0.817983 0.500000 Na\n0.656623 0.939433 0.234848 P\n0.060567 0.343377 0.765152 P\n0.343377 0.060567 0.765152 P\n0.939433 0.656623 0.234848 P\n0.799771 0.799771 0.913499 P\n0.200229 0.200229 0.086501 P\n0.935531 0.935531 0.292906 H\n0.064469 0.064469 0.707094 H\n0.741167 0.102429 0.917979 H\n0.897571 0.258833 0.082021 H\n0.258833 0.897571 0.082021 H\n0.102429 0.741167 0.917979 H\n0.713386 0.968211 0.006724 N\n0.031789 0.286614 0.993276 N\n0.286614 0.031789 0.993276 N\n0.968211 0.713386 0.006724 N\n0.837154 0.837154 0.305843 N\n0.162846 0.162846 0.694157 N\n0.648005 0.129271 0.260544 O\n0.870729 0.351995 0.739456 O\n0.351995 0.870729 0.739456 O\n0.129271 0.648005 0.260544 O\n0.493792 0.794826 0.338709 O\n0.205174 0.506208 0.661290 O\n0.506208 0.205174 0.661290 O\n0.794826 0.493792 0.338709 O\n0.647621 0.647621 0.975539 O\n0.352379 0.352379 0.024461 O\n0.888172 0.888172 0.705226 O\n0.111828 0.111828 0.294774 O\n",
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"formula_full": "Ba2 Na2 P6 H6 N6 O12",
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{
"id": "mp-1188019",
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"structure_string": "Zr2 Re1 Rh1\n1.0\n0.000000 3.310095 3.310095\n3.310095 0.000000 3.310095\n3.310095 3.310095 0.000000\nZr Re Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Zr\n0.750000 0.750000 0.750000 Zr\n0.500000 0.500000 0.500000 Re\n0.000000 0.000000 0.000000 Rh\n",
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{
"id": "mp-1237627",
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"structure_string": "Te1 Mo6\n1.0\n0.000000 2.919406 2.092450\n0.000000 -2.919406 2.092450\n11.588779 0.000000 -2.092450\nTe Mo\n1 6\ndirect\n0.000000 0.000000 0.000000 Te\n0.716194 0.716194 0.432388 Mo\n0.283806 0.283806 0.567612 Mo\n0.886157 0.386157 0.772314 Mo\n0.613843 0.113843 0.227686 Mo\n0.113843 0.613843 0.227686 Mo\n0.386157 0.886157 0.772314 Mo\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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{
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{
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"formula_full": "Rb2 Nb2 Ge6 O18",
"formula_reduced": "RbNb(GeO3)3",
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}