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{
"id": "jvasp-116831",
"created_at": "2022-09-04T14:38:41.925550Z",
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"structure_string": "Zn4 Co4 O8\n1.0\n2.980178 -0.000000 -0.000000\n-0.000001 8.545839 0.151962\n0.000000 0.125372 6.124620\nZn Co O\n4 4 8\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.250000 0.750000 Zn\n0.000000 0.500000 0.500000 Zn\n0.500001 0.750000 0.250000 Zn\n-0.000000 -0.000000 0.500000 Co\n0.500000 0.250000 0.250000 Co\n0.000000 0.500000 -0.000000 Co\n0.500001 0.750000 0.750000 Co\n0.000000 0.249948 0.499901 O\n0.500000 0.499948 0.249901 O\n0.000000 0.749948 -0.000100 O\n0.500000 -0.000052 0.749901 O\n0.000000 0.750052 0.500099 O\n0.500000 0.000052 0.250099 O\n0.000000 0.250052 0.000099 O\n0.500000 0.500052 0.750099 O\n",
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"structure_string": "Cu2 O4\n1.0\n1.693831 -2.371526 0.479422\n2.719122 -0.897178 3.903770\n-3.972523 -2.384634 2.179259\nCu O\n2 4\ndirect\n0.997564 0.000081 0.004205 Cu\n0.497529 0.000114 0.504186 Cu\n0.238176 0.756133 0.669693 O\n0.738276 0.756073 0.169696 O\n0.256860 0.244081 0.838713 O\n0.756880 0.244113 0.338675 O\n",
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{
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"updated_at": "2022-09-04T14:35:51.875996Z",
"structure_string": "Mg11 Mn2 O13\n1.0\n0.000000 -2.134193 -2.134193\n-2.133465 12.843276 -14.977470\n4.266931 -0.000000 0.000000\nMg Mn O\n11 2 13\ndirect\n0.921789 0.156419 0.078209 Mg\n0.614770 0.770456 0.385229 Mg\n0.538807 0.922386 0.461193 Mg\n0.770515 0.458966 0.229483 Mg\n0.846152 0.307692 0.153846 Mg\n0.384150 0.231699 0.615849 Mg\n0.460284 0.079431 0.539715 Mg\n0.308156 0.383687 0.691843 Mg\n0.232023 0.535954 0.767977 Mg\n0.153499 0.693000 0.846501 Mg\n0.077534 0.844929 0.922465 Mg\n0.999633 0.000730 0.000365 Mn\n0.692671 0.614654 0.307328 Mn\n0.615657 0.768682 0.884342 O\n0.458643 0.082712 0.041356 O\n0.308377 0.383246 0.191622 O\n0.383929 0.232139 0.116070 O\n0.233663 0.532673 0.266337 O\n0.151651 0.696697 0.348349 O\n0.076647 0.846703 0.423353 O\n0.769986 0.460024 0.730013 O\n0.922319 0.155361 0.577679 O\n0.846152 0.307692 0.653846 O\n0.692768 0.614461 0.807231 O\n0.999537 0.000925 0.500461 O\n0.540654 0.918688 0.959346 O\n",
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"formula_full": "Mg11 Mn2 O13",
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"spacegroup": 71
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{
"id": "jvasp-38372",
"created_at": "2022-09-04T14:37:51.139237Z",
"updated_at": "2022-09-04T14:37:51.139246Z",
"structure_string": "Nd1 Be1 O3\n1.0\n3.652334 0.000000 0.000000\n-0.000000 3.652334 -0.000000\n-0.000000 -0.000000 3.652334\nNd Be O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Nd\n0.499999 0.499999 0.499999 Be\n0.499999 0.499999 0.000000 O\n0.499999 0.000000 0.499999 O\n0.000000 0.499999 0.499999 O\n",
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},
{
"id": "jvasp-68750",
"created_at": "2022-09-04T14:35:49.601576Z",
"updated_at": "2022-09-04T14:35:49.601613Z",
"structure_string": "Be1 Co1 Ni1\n1.0\n1.219361 -2.111995 -0.000000\n1.219361 2.111995 0.000000\n0.000000 0.000000 5.675526\nBe Co Ni\n1 1 1\ndirect\n0.000000 0.000000 0.998972 Be\n0.666666 0.333333 0.317190 Co\n0.333333 0.666666 0.683840 Ni\n",
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{
"id": "jvasp-93295",
"created_at": "2022-09-04T14:36:09.559643Z",
"updated_at": "2022-09-04T14:36:09.559659Z",
"structure_string": "Mn3 N2\n1.0\n-2.020383 -2.020383 -0.000000\n-2.020383 2.020383 0.000000\n2.020383 0.000000 -5.966708\nMn N\n3 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.331224 0.331224 0.662449 Mn\n0.668775 0.668775 0.337552 Mn\n0.159724 0.159724 0.319449 N\n0.840276 0.840276 0.680552 N\n",
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{
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"created_at": "2022-09-04T14:38:00.648781Z",
"updated_at": "2022-09-04T14:38:00.648793Z",
"structure_string": "Mn3 N2\n1.0\n2.782694 -0.000000 -0.648226\n-0.151004 2.778594 -0.648226\n0.000610 0.000645 6.299483\nMn N\n3 2\ndirect\n0.668774 0.668773 0.337547 Mn\n0.331226 0.331227 0.662452 Mn\n0.000000 0.000000 0.000000 Mn\n0.840275 0.840275 0.680551 N\n0.159725 0.159725 0.319448 N\n",
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"spacegroup": 139
},
{
"id": "jvasp-14279",
"created_at": "2022-09-04T14:36:53.598049Z",
"updated_at": "2022-09-04T14:36:53.598065Z",
"structure_string": "Mn3 N2\n1.0\n2.782694 -0.000000 -0.648226\n-0.151004 2.778594 -0.648226\n0.000610 0.000645 6.299483\nMn N\n3 2\ndirect\n0.668774 0.668773 0.337547 Mn\n0.331226 0.331227 0.662452 Mn\n0.000000 0.000000 0.000000 Mn\n0.840275 0.840275 0.680551 N\n0.159725 0.159725 0.319448 N\n",
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},
{
"id": "jvasp-99649",
"created_at": "2022-09-04T14:37:01.955152Z",
"updated_at": "2022-09-04T14:37:01.955182Z",
"structure_string": "La1 Co5 H4\n1.0\n5.217107 -0.007636 0.000000\n-2.390010 4.637469 0.000000\n-0.000000 -0.000000 4.029539\nLa Co H\n1 5 4\ndirect\n0.500000 0.500000 0.500000 La\n0.865422 0.134577 0.500000 Co\n0.134578 0.865422 0.500000 Co\n0.000000 0.500000 -0.000000 Co\n0.500000 -0.000000 -0.000000 Co\n0.000000 0.000000 0.000000 Co\n0.646708 0.353292 -0.000000 H\n0.353292 0.646708 -0.000000 H\n0.000000 0.500000 0.500000 H\n0.500000 -0.000000 0.500000 H\n",
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"formula_full": "La1 Co5 H4",
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{
"id": "jvasp-48323",
"created_at": "2022-09-04T14:35:58.472154Z",
"updated_at": "2022-09-04T14:35:58.472178Z",
"structure_string": "Li10 Mn2 O6 F2\n1.0\n-1.850615 -4.577430 -4.255016\n-1.850615 4.577430 -4.255016\n3.757380 0.000000 -2.859945\nLi Mn O F\n10 2 6 2\ndirect\n0.961501 0.545720 0.243199 Li\n0.456979 0.052953 0.753343 Li\n0.197048 0.793021 0.496659 Li\n0.793021 0.197048 0.496659 Li\n0.769498 0.769498 0.727542 Li\n0.052953 0.456979 0.753343 Li\n0.545720 0.961501 0.243199 Li\n0.288499 0.704280 0.006804 Li\n0.704280 0.288499 0.006804 Li\n0.480502 0.480502 0.522461 Li\n0.256461 0.256461 0.248740 Mn\n-0.006461 -0.006461 0.001261 Mn\n0.981133 0.268867 0.125002 O\n0.268867 0.981133 0.125002 O\n0.223536 0.518411 0.373995 O\n0.518411 0.223536 0.373995 O\n0.731589 0.026464 0.876007 O\n0.026464 0.731589 0.876007 O\n0.772998 0.477002 0.625002 F\n0.477002 0.772998 0.625002 F\n",
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{
"id": "jvasp-43739",
"created_at": "2022-09-04T14:35:43.069732Z",
"updated_at": "2022-09-04T14:35:43.069746Z",
"structure_string": "Li2 Fe2 F6\n1.0\n2.807546 0.000000 0.000000\n-1.403773 4.783660 0.000000\n0.000000 0.000000 7.252515\nLi Fe F\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.244569 0.489135 0.250000 Fe\n0.755434 0.510865 0.750000 Fe\n0.094704 0.189405 0.750000 F\n0.360695 0.721388 0.572710 F\n0.360695 0.721388 0.927289 F\n0.639308 0.278613 0.427289 F\n0.905299 0.810595 0.250000 F\n0.639308 0.278613 0.072710 F\n",
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{
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"created_at": "2022-09-04T14:36:11.469729Z",
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"structure_string": "Be2 Co1 Si1\n1.0\n2.896360 0.000000 0.000000\n0.000000 2.896360 0.000000\n0.000000 0.000000 4.644334\nBe Co Si\n2 1 1\ndirect\n0.000000 0.000000 0.768736 Be\n0.000000 0.000000 0.231264 Be\n0.500000 0.500000 0.000000 Co\n0.500000 0.500000 0.500000 Si\n",
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}
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}