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{
"id": "mp-1206240",
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{
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"structure_string": "Lu6 Fe4 Si6\n1.0\n2.015102 -5.136702 0.000000\n2.015102 5.136702 0.000000\n0.000000 0.000000 13.320838\nLu Fe Si\n6 4 6\ndirect\n0.638508 0.361492 0.250000 Lu\n0.361492 0.638508 0.750000 Lu\n0.922065 0.077935 0.113221 Lu\n0.077935 0.922065 0.886779 Lu\n0.077935 0.922065 0.613221 Lu\n0.922065 0.077935 0.386779 Lu\n0.785928 0.214072 0.581423 Fe\n0.214072 0.785928 0.418577 Fe\n0.214072 0.785928 0.081423 Fe\n0.785928 0.214072 0.918577 Fe\n0.329207 0.670793 0.250000 Si\n0.670793 0.329207 0.750000 Si\n0.621130 0.378870 0.038917 Si\n0.378870 0.621130 0.961083 Si\n0.378870 0.621130 0.538917 Si\n0.621130 0.378870 0.461083 Si\n",
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{
"id": "mp-849335",
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"structure_string": "Ti6 N4 O6\n1.0\n1.908275 4.938473 0.000000\n-1.908275 4.938473 0.000000\n0.000000 0.087568 9.973200\nTi N O\n6 4 6\ndirect\n0.808300 0.808300 0.248688 Ti\n0.855760 0.855760 0.947063 Ti\n0.865304 0.865304 0.553046 Ti\n0.202467 0.202467 0.747189 Ti\n0.143948 0.143948 0.048108 Ti\n0.135325 0.135325 0.443217 Ti\n0.693989 0.693989 0.076885 N\n0.954175 0.954175 0.381745 N\n0.305269 0.305269 0.575253 N\n0.307482 0.307482 0.922055 N\n0.684778 0.684778 0.424317 O\n0.752698 0.752698 0.752911 O\n0.954172 0.954172 0.117643 O\n0.245833 0.245833 0.258051 O\n0.045863 0.045863 0.882760 O\n0.044629 0.044629 0.621068 O\n",
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{
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"created_at": "2022-09-04T14:46:33.931119Z",
"structure_string": "Li4 Lu6 Ge6\n1.0\n2.066204 -5.584700 0.000000\n2.066204 5.584700 0.000000\n0.000000 0.000000 13.887891\nLi Lu Ge\n4 6 6\ndirect\n0.721796 0.278204 0.421468 Li\n0.278204 0.721796 0.578532 Li\n0.721796 0.278204 0.078532 Li\n0.278204 0.721796 0.921469 Li\n0.861201 0.138799 0.750000 Lu\n0.138799 0.861201 0.250000 Lu\n0.569577 0.430423 0.881231 Lu\n0.430423 0.569577 0.118769 Lu\n0.430423 0.569577 0.381231 Lu\n0.569577 0.430423 0.618769 Lu\n0.167825 0.832175 0.750000 Ge\n0.900508 0.099492 0.545192 Ge\n0.099492 0.900508 0.045192 Ge\n0.900508 0.099492 0.954808 Ge\n0.832175 0.167825 0.250000 Ge\n0.099492 0.900508 0.454808 Ge\n",
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"formula_full": "Li4 Lu6 Ge6",
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{
"id": "mp-1206868",
"created_at": "2022-09-04T14:46:54.111065Z",
"structure_string": "Nd2 Cu3 Sn3\n1.0\n2.991348 0.000000 0.000000\n0.000000 2.991348 0.000000\n0.000000 0.000000 22.720042\nNd Cu Sn\n2 3 3\ndirect\n0.500000 0.500000 0.756919 Nd\n0.500000 0.500000 0.243081 Nd\n0.500000 0.500000 0.117732 Cu\n0.500000 0.500000 0.882268 Cu\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 0.388342 Sn\n0.500000 0.500000 0.611658 Sn\n0.500000 0.500000 0.000000 Sn\n",
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"formula_full": "Nd2 Cu3 Sn3",
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{
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"structure_string": "Er6 Ga4 Ge6\n1.0\n3.715310 -4.669168 0.000000\n3.715310 4.669168 0.000000\n0.000000 0.000000 9.381758\nEr Ga Ge\n6 4 6\ndirect\n0.653708 0.653708 0.250000 Er\n0.346292 0.346292 0.750000 Er\n0.800961 0.199039 0.000000 Er\n0.199039 0.800961 0.000000 Er\n0.199039 0.800961 0.500000 Er\n0.800961 0.199039 0.500000 Er\n0.321488 0.321488 0.050095 Ga\n0.678512 0.678512 0.949905 Ga\n0.678512 0.678512 0.550095 Ga\n0.321488 0.321488 0.449905 Ga\n0.087431 0.494966 0.250000 Ge\n0.912569 0.505034 0.750000 Ge\n0.494966 0.087431 0.250000 Ge\n0.505034 0.912569 0.750000 Ge\n0.040468 0.040468 0.250000 Ge\n0.959532 0.959532 0.750000 Ge\n",
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"formula_full": "Er6 Ga4 Ge6",
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{
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{
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{
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{
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"created_at": "2022-09-04T14:47:55.324540Z",
"structure_string": "Zr6 Ti4 Si6\n1.0\n3.907641 -6.768232 0.000000\n3.907641 6.768232 0.000000\n0.000000 0.000000 5.330259\nZr Ti Si\n6 4 6\ndirect\n0.749033 0.749033 0.750000 Zr\n0.250967 0.000000 0.750000 Zr\n0.000000 0.250967 0.750000 Zr\n0.250967 0.250967 0.250000 Zr\n0.749033 0.000000 0.250000 Zr\n0.000000 0.749033 0.250000 Zr\n0.666667 0.333333 0.000000 Ti\n0.333333 0.666667 0.000000 Ti\n0.333333 0.666667 0.500000 Ti\n0.666667 0.333333 0.500000 Ti\n0.398600 0.398600 0.750000 Si\n0.601400 0.000000 0.750000 Si\n0.000000 0.601400 0.750000 Si\n0.601400 0.601400 0.250000 Si\n0.398600 0.000000 0.250000 Si\n0.000000 0.398600 0.250000 Si\n",
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{
"id": "mp-29559",
"created_at": "2022-09-04T14:48:01.848604Z",
"structure_string": "La6 Si6 Cl4\n1.0\n2.123514 9.095519 0.000000\n-2.123514 9.095519 0.000000\n0.000000 1.474660 10.573673\nLa Si Cl\n6 6 4\ndirect\n0.680405 0.680405 0.851352 La\n0.319595 0.319595 0.148648 La\n0.384378 0.384378 0.490466 La\n0.615622 0.615622 0.509534 La\n0.464790 0.464790 0.830756 La\n0.535210 0.535210 0.169244 La\n0.935740 0.935740 0.050664 Si\n0.064260 0.064260 0.949336 Si\n0.088444 0.088444 0.723019 Si\n0.911556 0.911556 0.276981 Si\n0.981160 0.981160 0.611580 Si\n0.018840 0.018840 0.388420 Si\n0.226391 0.226391 0.391456 Cl\n0.773609 0.773609 0.608544 Cl\n0.297175 0.297175 0.873969 Cl\n0.702825 0.702825 0.126031 Cl\n",
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"formula_full": "La6 Si6 Cl4",
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]
}