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{
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{
"id": "mp-1043786",
"created_at": "2022-09-04T14:42:09.581641Z",
"structure_string": "La4 Mg4 Ti4 Fe4 O24\n1.0\n0.000015 5.371725 -0.002419\n-5.532604 -0.002606 7.717181\n5.532675 -0.002574 7.717232\nLa Mg Ti Fe O\n4 4 4 4 24\ndirect\n0.992465 0.107436 0.143316 La\n0.992465 0.607434 0.643318 La\n0.492469 0.143303 0.607439 La\n0.492464 0.643304 0.107444 La\n0.526023 0.850782 0.401592 Mg\n0.526023 0.350782 0.901592 Mg\n0.026019 0.901591 0.850781 Mg\n0.026019 0.401591 0.350781 Mg\n0.001568 0.996414 0.502220 Ti\n0.001571 0.496412 0.002224 Ti\n0.501568 0.002219 0.996412 Ti\n0.501568 0.502220 0.496408 Ti\n0.000823 0.251842 0.749728 Fe\n0.500806 0.749722 0.751833 Fe\n0.000823 0.751836 0.249735 Fe\n0.500806 0.249724 0.251829 Fe\n0.631903 0.367046 0.387809 O\n0.631903 0.867045 0.887809 O\n0.131900 0.887796 0.367045 O\n0.131903 0.387795 0.867046 O\n0.196091 0.374256 0.567883 O\n0.196091 0.874255 0.067884 O\n0.696099 0.067882 0.374260 O\n0.696100 0.567882 0.874260 O\n0.186495 0.179222 0.380495 O\n0.186496 0.679222 0.880496 O\n0.686493 0.880496 0.179213 O\n0.686491 0.380495 0.679213 O\n0.919738 0.101199 0.644148 O\n0.919740 0.601201 0.144148 O\n0.419740 0.644161 0.601197 O\n0.419743 0.144162 0.101198 O\n0.270204 0.913627 0.638348 O\n0.270204 0.413629 0.138344 O\n0.770200 0.638361 0.413628 O\n0.770201 0.138359 0.913629 O\n0.274694 0.106045 0.836606 O\n0.274691 0.606044 0.336607 O\n0.774696 0.836605 0.606040 O\n0.774700 0.336604 0.106041 O\n",
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{
"id": "mp-1104025",
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"structure_string": "Np1 C4 O8\n1.0\n-4.285485 4.285485 3.361109\n4.285485 -4.285485 3.361109\n4.285485 4.285485 -3.361109\nNp C O\n1 4 8\ndirect\n0.000000 0.000000 0.000000 Np\n0.179823 0.064020 0.689413 C\n0.374607 0.490410 0.310587 C\n0.935980 0.625393 0.115803 C\n0.509590 0.820177 0.884197 C\n0.063020 0.150511 0.699000 O\n0.451511 0.364019 0.301000 O\n0.849489 0.548489 0.912508 O\n0.635981 0.936980 0.087492 O\n0.576402 0.780270 0.735066 O\n0.045205 0.841337 0.264934 O\n0.219730 0.954795 0.796132 O\n0.158663 0.423598 0.203868 O\n",
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"formula_full": "Np1 C4 O8",
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"updated_at": "2021-11-28T01:35:34.396000Z",
"spacegroup": 82
},
{
"id": "mp-1212825",
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"structure_string": "Er6 Sc2 S12\n1.0\n3.873949 0.000000 0.000000\n0.000000 10.880451 0.000000\n0.000000 3.636483 10.536859\nEr Sc S\n6 2 12\ndirect\n0.250000 0.568021 0.830929 Er\n0.750000 0.431979 0.169071 Er\n0.250000 0.315567 0.501963 Er\n0.750000 0.684433 0.498037 Er\n0.250000 0.841704 0.081491 Er\n0.750000 0.158296 0.918509 Er\n0.250000 0.959635 0.685139 Sc\n0.750000 0.040365 0.314861 Sc\n0.250000 0.520542 0.613451 S\n0.750000 0.479458 0.386549 S\n0.250000 0.082499 0.101684 S\n0.750000 0.917501 0.898316 S\n0.250000 0.604190 0.061364 S\n0.750000 0.395810 0.938636 S\n0.250000 0.250332 0.279238 S\n0.750000 0.749668 0.720762 S\n0.250000 0.898053 0.462248 S\n0.750000 0.101947 0.537752 S\n0.250000 0.184577 0.748279 S\n0.750000 0.815423 0.251721 S\n",
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"spacegroup": 11
},
{
"id": "mp-1174671",
"created_at": "2022-09-04T14:42:06.622409Z",
"structure_string": "Li8 Mn2 Co4 O14\n1.0\n5.021670 0.000000 0.000000\n-0.864426 5.043648 0.000000\n-1.543373 -2.176379 9.814162\nLi Mn Co O\n8 2 4 14\ndirect\n0.299176 0.576860 0.062397 Li\n0.426317 0.860393 0.359245 Li\n0.843027 0.713779 0.209869 Li\n0.004530 0.002242 0.507270 Li\n0.589239 0.133628 0.655501 Li\n0.157627 0.285668 0.789158 Li\n0.702791 0.421827 0.923001 Li\n0.435728 0.858675 0.862157 Li\n0.999085 0.998384 0.996692 Mn\n0.137037 0.289877 0.282428 Mn\n0.283980 0.577707 0.581168 Co\n0.566978 0.145046 0.140020 Co\n0.710111 0.437595 0.432861 Co\n0.855421 0.705965 0.721664 Co\n0.060504 0.667106 0.900207 O\n0.216537 0.961492 0.173213 O\n0.661752 0.822459 0.042157 O\n0.784911 0.102387 0.311304 O\n0.337522 0.231043 0.448757 O\n0.927213 0.360829 0.600398 O\n0.514154 0.498743 0.741268 O\n0.479408 0.473873 0.247140 O\n0.647368 0.766126 0.533352 O\n0.067244 0.616412 0.384110 O\n0.208611 0.897363 0.672137 O\n0.814662 0.063014 0.832680 O\n0.349403 0.201072 0.977898 O\n0.919664 0.330435 0.111948 O\n",
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"formula_full": "Li8 Mn2 Co4 O14",
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{
"id": "mp-29979",
"created_at": "2022-09-04T14:42:06.625138Z",
"structure_string": "Nb6 B6 C2\n1.0\n1.640567 -14.448459 0.000000\n1.640567 14.448459 0.000000\n0.000000 0.000000 3.142215\nNb B C\n6 6 2\ndirect\n0.546763 0.453237 0.250000 Nb\n0.453237 0.546763 0.750000 Nb\n0.212583 0.787417 0.250000 Nb\n0.787417 0.212583 0.750000 Nb\n0.637890 0.362110 0.750000 Nb\n0.362110 0.637890 0.250000 Nb\n0.984552 0.015448 0.250000 B\n0.015448 0.984552 0.750000 B\n0.112113 0.887887 0.250000 B\n0.887887 0.112113 0.750000 B\n0.920960 0.079040 0.250000 B\n0.079040 0.920960 0.750000 B\n0.287787 0.712213 0.250000 C\n0.712213 0.287787 0.750000 C\n",
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},
{
"id": "mp-1043255",
"created_at": "2022-09-04T14:42:06.627575Z",
"structure_string": "Ca2 Co4 O10\n1.0\n3.722666 -0.000039 0.000000\n-1.861390 5.555209 0.000000\n0.000000 0.000000 11.190366\nCa Co O\n2 4 10\ndirect\n0.901483 0.802921 0.750000 Ca\n0.098518 0.197080 0.250000 Ca\n0.209732 0.419427 0.595132 Co\n0.790269 0.580574 0.404867 Co\n0.790269 0.580574 0.095133 Co\n0.209732 0.419427 0.904868 Co\n0.720883 0.441795 0.250000 O\n0.279118 0.558206 0.750000 O\n0.222429 0.444897 0.071203 O\n0.777573 0.555104 0.928797 O\n0.777573 0.555104 0.571203 O\n0.222429 0.444897 0.428796 O\n0.062014 0.124096 0.620335 O\n0.937986 0.875903 0.379665 O\n0.062014 0.124096 0.879665 O\n0.937986 0.875903 0.120336 O\n",
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{
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"structure_string": "Nb8 Se4 F56\n1.0\n17.597017 0.000000 0.000000\n0.000000 7.823616 0.000000\n0.000000 2.155218 8.788339\nNb Se F\n8 4 56\ndirect\n0.818594 0.778509 0.228434 Nb\n0.318594 0.221491 0.271566 Nb\n0.181406 0.221491 0.771566 Nb\n0.681406 0.778509 0.728434 Nb\n0.538665 0.215909 0.672155 Nb\n0.038665 0.784091 0.827845 Nb\n0.461335 0.784091 0.327845 Nb\n0.961335 0.215909 0.172155 Nb\n0.862934 0.164761 0.628925 Se\n0.362934 0.835239 0.871075 Se\n0.137066 0.835239 0.371075 Se\n0.637066 0.164761 0.128925 Se\n0.667312 0.178513 0.307633 F\n0.167312 0.821487 0.192367 F\n0.332688 0.821487 0.692367 F\n0.832688 0.178513 0.807633 F\n0.700917 0.320365 0.032440 F\n0.200917 0.679635 0.467560 F\n0.299083 0.679635 0.967560 F\n0.799083 0.320365 0.532440 F\n0.566514 0.318511 0.128213 F\n0.066514 0.681489 0.371787 F\n0.433486 0.681489 0.871787 F\n0.933486 0.318511 0.628213 F\n0.757037 0.972124 0.661571 F\n0.257037 0.027876 0.838429 F\n0.242963 0.027876 0.338429 F\n0.742963 0.972124 0.161571 F\n0.600606 0.619380 0.794777 F\n0.100606 0.380620 0.705223 F\n0.399394 0.380620 0.205223 F\n0.899394 0.619380 0.294777 F\n0.758098 0.608185 0.767330 F\n0.258098 0.391815 0.732670 F\n0.241902 0.391815 0.232670 F\n0.741902 0.608185 0.267330 F\n0.678209 0.843069 0.919271 F\n0.178209 0.156931 0.580729 F\n0.321791 0.156931 0.080729 F\n0.821791 0.843069 0.419271 F\n0.662337 0.782984 0.520676 F\n0.162337 0.217016 0.979324 F\n0.337663 0.217016 0.479324 F\n0.837663 0.782984 0.020676 F\n0.600938 0.989983 0.676222 F\n0.100938 0.010017 0.823778 F\n0.399062 0.010017 0.323778 F\n0.899062 0.989983 0.176222 F\n0.456396 0.047106 0.757681 F\n0.956396 0.952894 0.742319 F\n0.543604 0.952894 0.242319 F\n0.043604 0.047106 0.257681 F\n0.627918 0.345926 0.607475 F\n0.127918 0.654074 0.892525 F\n0.372082 0.654074 0.392525 F\n0.872082 0.345926 0.107475 F\n0.476485 0.407709 0.679638 F\n0.976485 0.592291 0.820362 F\n0.523515 0.592291 0.320362 F\n0.023515 0.407709 0.179638 F\n0.575515 0.178179 0.884336 F\n0.075515 0.821821 0.615664 F\n0.424485 0.821821 0.115664 F\n0.924485 0.178179 0.384336 F\n0.512149 0.203605 0.473179 F\n0.012149 0.796395 0.026821 F\n0.487851 0.796395 0.526821 F\n0.987851 0.203605 0.973179 F\n",
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"formula_full": "Nb8 Se4 F56",
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}
]
}