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{
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{
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"structure_string": "Zr4 Au16\n1.0\n5.052314 0.000000 0.000000\n0.000000 5.298266 0.000000\n0.000000 0.000000 15.005513\nZr Au\n4 16\ndirect\n0.750000 0.733004 0.883318 Zr\n0.250000 0.766996 0.383318 Zr\n0.750000 0.233004 0.616682 Zr\n0.250000 0.266996 0.116682 Zr\n0.250000 0.365492 0.726751 Au\n0.750000 0.134508 0.226751 Au\n0.250000 0.460540 0.540968 Au\n0.250000 0.457548 0.928744 Au\n0.250000 0.865492 0.773249 Au\n0.750000 0.039460 0.040968 Au\n0.250000 0.960540 0.959032 Au\n0.750000 0.542452 0.071256 Au\n0.250000 0.957548 0.571256 Au\n0.750000 0.233959 0.806880 Au\n0.250000 0.766041 0.193120 Au\n0.750000 0.634508 0.273249 Au\n0.750000 0.042452 0.428744 Au\n0.250000 0.266041 0.306880 Au\n0.750000 0.539460 0.459032 Au\n0.750000 0.733959 0.693120 Au\n",
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"density": 14.536760162422327,
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"formula_full": "Zr4 Au16",
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{
"id": "mp-1096140",
"created_at": "2022-09-04T14:47:42.889309Z",
"structure_string": "La2 Ir1 Ru1\n1.0\n-4.856013 6.071900 8.586681\n4.856013 -6.071900 8.586681\n4.856013 6.071900 -8.586681\nLa Ir Ru\n2 1 1\ndirect\n0.000000 0.242442 0.242442 La\n0.000000 0.757558 0.757558 La\n0.000000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Ru\n",
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{
"id": "mp-1233441",
"created_at": "2022-09-04T14:47:42.988293Z",
"structure_string": "Ba4 Mg1 Rh4 O12\n1.0\n6.030934 0.181520 -0.413421\n-2.858266 4.950662 0.000000\n-0.697285 -0.402578 10.175142\nBa Mg Rh O\n4 1 4 12\ndirect\n0.813544 0.406772 0.713035 Ba\n0.329141 0.664571 0.260365 Ba\n0.058877 0.029439 0.481156 Ba\n0.895007 0.947503 0.051777 Ba\n0.366609 0.183304 0.863962 Mg\n0.350295 0.675148 0.879616 Rh\n0.696153 0.348076 0.388754 Rh\n0.565115 0.282557 0.121175 Rh\n0.415302 0.707652 0.611440 Rh\n0.261988 0.384803 0.726876 O\n0.777279 0.156274 0.247883 O\n0.352658 0.176328 0.276726 O\n0.662801 0.831401 0.785317 O\n0.261988 0.877187 0.726876 O\n0.777279 0.621005 0.247883 O\n0.620146 0.044193 0.511817 O\n0.326781 0.402732 0.011942 O\n0.326781 0.924050 0.011942 O\n0.620146 0.575952 0.511817 O\n0.089450 0.544725 0.469623 O\n0.745157 0.372579 0.962518 O\n",
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{
"id": "mp-776689",
"created_at": "2022-09-04T14:47:43.126260Z",
"structure_string": "Li12 Fe8 F36\n1.0\n7.816776 0.000000 0.000000\n0.000000 9.522448 0.000000\n0.000000 0.000000 10.682208\nLi Fe F\n12 8 36\ndirect\n0.750000 0.016043 0.841594 Li\n0.750000 0.032863 0.530676 Li\n0.250000 0.113340 0.848639 Li\n0.750000 0.386660 0.348639 Li\n0.250000 0.467137 0.030676 Li\n0.250000 0.483957 0.341594 Li\n0.750000 0.516043 0.658406 Li\n0.750000 0.532863 0.969324 Li\n0.250000 0.613340 0.651361 Li\n0.750000 0.886660 0.151361 Li\n0.250000 0.967137 0.469324 Li\n0.250000 0.983957 0.158406 Li\n0.939543 0.226757 0.068110 Fe\n0.560457 0.226757 0.068110 Fe\n0.060457 0.273243 0.568110 Fe\n0.439543 0.273243 0.568110 Fe\n0.560457 0.726757 0.431890 Fe\n0.939543 0.726757 0.431890 Fe\n0.060457 0.773243 0.931890 Fe\n0.439543 0.773243 0.931890 Fe\n0.750000 0.076101 0.024432 F\n0.052529 0.094784 0.168577 F\n0.447471 0.094784 0.168577 F\n0.560393 0.107406 0.608938 F\n0.939607 0.107406 0.608938 F\n0.250000 0.162487 0.473038 F\n0.052322 0.193056 0.915939 F\n0.447678 0.193056 0.915939 F\n0.250000 0.232016 0.696197 F\n0.750000 0.267984 0.196197 F\n0.947678 0.306944 0.415939 F\n0.552322 0.306944 0.415939 F\n0.750000 0.337513 0.973038 F\n0.060393 0.392594 0.108938 F\n0.439607 0.392594 0.108938 F\n0.552529 0.405216 0.668577 F\n0.947471 0.405216 0.668577 F\n0.250000 0.423899 0.524432 F\n0.750000 0.576101 0.475568 F\n0.052529 0.594784 0.331423 F\n0.447471 0.594784 0.331423 F\n0.560393 0.607406 0.891062 F\n0.939607 0.607406 0.891062 F\n0.250000 0.662487 0.026962 F\n0.052322 0.693056 0.584061 F\n0.447678 0.693056 0.584061 F\n0.250000 0.732016 0.803803 F\n0.750000 0.767984 0.303803 F\n0.552322 0.806944 0.084061 F\n0.947678 0.806944 0.084061 F\n0.750000 0.837513 0.526962 F\n0.060393 0.892594 0.391062 F\n0.439607 0.892594 0.391062 F\n0.552529 0.905216 0.831423 F\n0.947471 0.905216 0.831423 F\n0.250000 0.923899 0.975568 F\n",
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"volume": 795.1284752413974,
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"formula_full": "Li12 Fe8 F36",
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"energy": -316.37354479,
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{
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"created_at": "2022-09-04T14:47:43.176007Z",
"structure_string": "Eu1 Zr1 O3\n1.0\n4.197333 0.000000 0.000000\n0.000000 4.197333 0.000000\n0.000000 0.000000 4.197333\nEu Zr O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Eu\n0.500000 0.500000 0.500000 Zr\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
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"formula_full": "Eu1 Zr1 O3",
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{
"id": "mp-1200133",
"created_at": "2022-09-04T14:47:43.355521Z",
"structure_string": "Mg4 Cu4 C4 O20\n1.0\n8.701554 0.000000 0.000000\n0.000000 3.410747 0.000000\n0.000000 1.460741 12.456434\nMg Cu C O\n4 4 4 20\ndirect\n0.721107 0.602472 0.106935 Mg\n0.221107 0.397528 0.393065 Mg\n0.278893 0.397528 0.893065 Mg\n0.778893 0.602472 0.606935 Mg\n0.494238 0.987432 0.283442 Cu\n0.994238 0.012568 0.216558 Cu\n0.505762 0.012568 0.716558 Cu\n0.005762 0.987432 0.783442 Cu\n0.775169 0.629753 0.363178 C\n0.275169 0.370247 0.136822 C\n0.224831 0.370247 0.636822 C\n0.724831 0.629753 0.863178 C\n0.624056 0.606999 0.362563 O\n0.124056 0.393001 0.137437 O\n0.375944 0.393001 0.637437 O\n0.875944 0.606999 0.862563 O\n0.844728 0.623339 0.269257 O\n0.344728 0.376661 0.230743 O\n0.155272 0.376661 0.730743 O\n0.655272 0.623339 0.769257 O\n0.847432 0.630515 0.449328 O\n0.347432 0.369485 0.050672 O\n0.152568 0.369485 0.550672 O\n0.652568 0.630515 0.949328 O\n0.609388 0.077561 0.161800 O\n0.109388 0.922439 0.338200 O\n0.390612 0.922439 0.838200 O\n0.890612 0.077561 0.661800 O\n0.857582 0.107104 0.103552 O\n0.357582 0.892896 0.396448 O\n0.142418 0.892896 0.896448 O\n0.642418 0.107104 0.603552 O\n",
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{
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