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{
"id": "mp-755666",
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{
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{
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{
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"structure_string": "Sm2 Ni4 Sn4\n1.0\n4.445641 0.000000 0.000000\n0.000000 4.445641 0.000000\n0.000000 0.000000 10.061911\nSm Ni Sn\n2 4 4\ndirect\n0.000000 0.500000 0.239045 Sm\n0.500000 0.000000 0.760955 Sm\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.000000 0.500000 0.627145 Ni\n0.500000 0.000000 0.372855 Ni\n0.000000 0.000000 0.500000 Sn\n0.500000 0.500000 0.500000 Sn\n0.000000 0.500000 0.872925 Sn\n0.500000 0.000000 0.127075 Sn\n",
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"formula_full": "Sm2 Ni4 Sn4",
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{
"id": "mp-1095547",
"created_at": "2022-09-04T14:44:17.984899Z",
"structure_string": "Zr1 Ti2 Ni9\n1.0\n6.503470 -2.580500 0.000000\n6.503470 2.580500 0.000000\n5.479559 0.000000 4.350695\nZr Ti Ni\n1 2 9\ndirect\n0.000000 0.000000 0.000000 Zr\n0.780876 0.780876 0.780876 Ti\n0.219124 0.219124 0.219124 Ti\n0.500000 0.500000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.713492 0.235919 0.713492 Ni\n0.713492 0.713492 0.235919 Ni\n0.235919 0.713492 0.713492 Ni\n0.286508 0.764081 0.286508 Ni\n0.286508 0.286508 0.764081 Ni\n0.764081 0.286508 0.286508 Ni\n",
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{
"id": "mp-6054",
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"structure_string": "Ba5 Tm8 Zn4 O21\n1.0\n-6.877899 6.877899 2.850880\n6.877899 -6.877899 2.850880\n6.877899 6.877899 -2.850880\nBa Tm Zn O\n5 8 4 21\ndirect\n0.140279 0.536035 0.676314 Ba\n0.536035 0.859721 0.395756 Ba\n0.463965 0.140279 0.604244 Ba\n0.859721 0.463965 0.323686 Ba\n0.000000 0.000000 0.000000 Ba\n0.358598 0.411288 0.769886 Tm\n0.411288 0.641402 0.052689 Tm\n0.588712 0.358598 0.947311 Tm\n0.641402 0.588712 0.230114 Tm\n0.168430 0.247625 0.416055 Tm\n0.247625 0.831570 0.079195 Tm\n0.752375 0.168430 0.920805 Tm\n0.831570 0.752375 0.583945 Tm\n0.249350 0.040521 0.289870 Zn\n0.040521 0.750650 0.791171 Zn\n0.959479 0.249350 0.208829 Zn\n0.750650 0.959479 0.710130 Zn\n0.006236 0.899137 0.405136 O\n0.899137 0.494001 0.892901 O\n0.601100 0.006236 0.107099 O\n0.494001 0.601100 0.594864 O\n0.993764 0.100863 0.594864 O\n0.100863 0.505999 0.107099 O\n0.398900 0.993764 0.892901 O\n0.505999 0.398900 0.405136 O\n0.202829 0.074353 0.774174 O\n0.074353 0.300179 0.871524 O\n0.428655 0.202829 0.128476 O\n0.300179 0.428655 0.225826 O\n0.797171 0.925647 0.225826 O\n0.925647 0.699821 0.128476 O\n0.571345 0.797171 0.871524 O\n0.699821 0.571345 0.774174 O\n0.960189 0.629601 0.589790 O\n0.500000 0.500000 0.000000 O\n0.039811 0.370399 0.410210 O\n0.370399 0.960189 0.330588 O\n0.629601 0.039811 0.669412 O\n",
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{
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"created_at": "2022-09-04T14:44:17.748592Z",
"structure_string": "Sb1 Pt3\n1.0\n-2.024184 2.024184 4.209845\n2.024184 -2.024184 4.209845\n2.024184 2.024184 -4.209845\nSb Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Sb\n0.750000 0.250000 0.500000 Pt\n0.250000 0.750000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n",
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{
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"structure_string": "Tm10 Pt6\n1.0\n4.180609 -7.241027 0.000000\n4.180609 7.241027 0.000000\n0.000000 0.000000 6.074174\nTm Pt\n10 6\ndirect\n0.666667 0.333333 0.000000 Tm\n0.333333 0.666667 0.000000 Tm\n0.333333 0.666667 0.500000 Tm\n0.666667 0.333333 0.500000 Tm\n0.754227 0.754227 0.750000 Tm\n0.245773 0.000000 0.750000 Tm\n0.000000 0.245773 0.750000 Tm\n0.245773 0.245773 0.250000 Tm\n0.754227 0.000000 0.250000 Tm\n0.000000 0.754227 0.250000 Tm\n0.394495 0.394495 0.750000 Pt\n0.605505 0.000000 0.750000 Pt\n0.000000 0.605505 0.750000 Pt\n0.605505 0.605505 0.250000 Pt\n0.394495 0.000000 0.250000 Pt\n0.000000 0.394495 0.250000 Pt\n",
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{
"id": "mp-1195000",
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"structure_string": "Cs6 Zn12 B18 O42\n1.0\n4.319696 -9.752177 0.000000\n4.319696 9.752177 0.000000\n0.000000 0.000000 14.712386\nCs Zn B O\n6 12 18 42\ndirect\n0.392170 0.607830 0.798481 Cs\n0.607830 0.392170 0.298481 Cs\n0.389241 0.610759 0.156997 Cs\n0.610759 0.389241 0.656997 Cs\n0.997549 0.002451 0.229231 Cs\n0.002451 0.997549 0.729231 Cs\n0.623399 0.004625 0.984416 Zn\n0.995375 0.376601 0.984416 Zn\n0.376601 0.995375 0.484416 Zn\n0.004625 0.623399 0.484416 Zn\n0.400735 0.980493 0.823874 Zn\n0.019507 0.599265 0.823874 Zn\n0.599265 0.019507 0.323874 Zn\n0.980493 0.400735 0.323874 Zn\n0.017837 0.603785 0.145122 Zn\n0.396215 0.982163 0.145122 Zn\n0.982163 0.396215 0.645122 Zn\n0.603785 0.017837 0.645122 Zn\n0.247606 0.752394 0.983904 B\n0.752394 0.247606 0.483904 B\n0.704982 0.769414 0.978681 B\n0.230586 0.295018 0.978681 B\n0.295018 0.230586 0.478681 B\n0.769414 0.704982 0.478681 B\n0.825454 0.671332 0.063985 B\n0.328668 0.174546 0.063985 B\n0.174546 0.328668 0.563985 B\n0.671332 0.825454 0.563985 B\n0.225496 0.774504 0.649942 B\n0.774504 0.225496 0.149942 B\n0.822997 0.665774 0.896971 B\n0.334226 0.177003 0.896971 B\n0.177003 0.334226 0.396971 B\n0.665774 0.822997 0.396971 B\n0.224861 0.775139 0.314415 B\n0.775139 0.224861 0.814415 B\n0.871981 0.652342 0.143867 O\n0.347658 0.128019 0.143867 O\n0.128019 0.347658 0.643867 O\n0.652342 0.871981 0.643867 O\n0.748000 0.738654 0.061516 O\n0.261346 0.252000 0.061516 O\n0.252000 0.261346 0.561516 O\n0.738654 0.748000 0.561516 O\n0.625378 0.825620 0.977282 O\n0.174380 0.374622 0.977282 O\n0.374622 0.174380 0.477282 O\n0.825620 0.625378 0.477282 O\n0.225168 0.774832 0.220085 O\n0.774832 0.225168 0.720085 O\n0.084819 0.634324 0.359826 O\n0.365676 0.915181 0.359826 O\n0.915181 0.365676 0.859826 O\n0.634324 0.084819 0.859826 O\n0.392501 0.883796 0.030038 O\n0.116204 0.607499 0.030038 O\n0.607499 0.116204 0.530038 O\n0.883796 0.392501 0.530038 O\n0.237221 0.762779 0.890594 O\n0.762779 0.237221 0.390594 O\n0.742546 0.729965 0.897004 O\n0.270035 0.257454 0.897004 O\n0.257454 0.270035 0.397004 O\n0.729965 0.742546 0.397004 O\n0.375407 0.902660 0.694658 O\n0.097340 0.624593 0.694658 O\n0.624593 0.097340 0.194657 O\n0.902660 0.375407 0.194657 O\n0.204015 0.795985 0.559961 O\n0.795985 0.204015 0.059961 O\n0.854664 0.630831 0.981013 O\n0.369169 0.145336 0.981013 O\n0.145336 0.369169 0.481013 O\n0.630831 0.854664 0.481013 O\n0.871105 0.644875 0.818321 O\n0.355125 0.128895 0.818321 O\n0.128895 0.355125 0.318321 O\n0.644875 0.871105 0.318321 O\n",
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"formula_full": "Ca4 Au2 N2",
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},
{
"id": "mp-1201318",
"created_at": "2022-09-04T14:44:20.451117Z",
"structure_string": "Pb12 N8 O32\n1.0\n5.889587 0.000000 0.000000\n0.000000 7.850143 0.000000\n0.000000 0.000000 18.925835\nPb N O\n12 8 32\ndirect\n0.750000 0.018932 0.842918 Pb\n0.750000 0.518932 0.657082 Pb\n0.250000 0.981068 0.157082 Pb\n0.250000 0.481068 0.342918 Pb\n0.750000 0.136115 0.031961 Pb\n0.750000 0.636115 0.468039 Pb\n0.250000 0.863885 0.968039 Pb\n0.250000 0.363885 0.531961 Pb\n0.250000 0.308244 0.915784 Pb\n0.250000 0.808244 0.584216 Pb\n0.750000 0.691756 0.084216 Pb\n0.750000 0.191756 0.415784 Pb\n0.750000 0.611873 0.894239 N\n0.750000 0.111873 0.605761 N\n0.250000 0.388127 0.105761 N\n0.250000 0.888127 0.394239 N\n0.250000 0.840868 0.749488 N\n0.250000 0.340868 0.750512 N\n0.750000 0.159132 0.250512 N\n0.750000 0.659132 0.249488 N\n0.499102 0.092458 0.932477 O\n0.000898 0.592458 0.567523 O\n0.999102 0.907542 0.067523 O\n0.500898 0.407542 0.432477 O\n0.500898 0.907542 0.067523 O\n0.999102 0.407542 0.432477 O\n0.000898 0.092458 0.932477 O\n0.499102 0.592458 0.567523 O\n0.250000 0.901945 0.811383 O\n0.250000 0.401945 0.688617 O\n0.750000 0.098055 0.188617 O\n0.750000 0.598055 0.311383 O\n0.436755 0.812376 0.717747 O\n0.063245 0.312376 0.782253 O\n0.936755 0.187624 0.282253 O\n0.563245 0.687624 0.217747 O\n0.563245 0.187624 0.282253 O\n0.936755 0.687624 0.217747 O\n0.063245 0.812376 0.717747 O\n0.436755 0.312376 0.782253 O\n0.750000 0.463937 0.920033 O\n0.750000 0.963937 0.579967 O\n0.250000 0.536063 0.079967 O\n0.250000 0.036063 0.420033 O\n0.750000 0.742430 0.936938 O\n0.750000 0.242430 0.563062 O\n0.250000 0.257570 0.063062 O\n0.250000 0.757570 0.436938 O\n0.750000 0.640378 0.829167 O\n0.750000 0.140378 0.670833 O\n0.250000 0.359622 0.170833 O\n0.250000 0.859622 0.329167 O\n",
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"elements": [
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],
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"formula_full": "Pb12 N8 O32",
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"updated_at": "2021-11-28T01:36:38.497000Z",
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}
]
}