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{
"id": "mp-510308",
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"formula_full": "Na36 Co8 O28",
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{
"id": "mp-5054",
"created_at": "2022-09-04T14:42:06.499489Z",
"structure_string": "Pr1 Co2 P2\n1.0\n-1.922715 1.922715 5.239394\n1.922715 -1.922715 5.239394\n1.922715 1.922715 -5.239394\nPr Co P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.750000 0.250000 0.500000 Co\n0.250000 0.750000 0.500000 Co\n0.642389 0.642389 0.000000 P\n0.357611 0.357611 0.000000 P\n",
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{
"id": "mp-1650011",
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"structure_string": "Li12 Co4 Si4 B4 O28\n1.0\n0.179774 -0.000114 5.022475\n16.804437 -0.000257 0.680855\n-0.000093 6.231780 -0.000135\nLi Co Si B O\n12 4 4 4 28\ndirect\n0.768462 0.052235 0.249991 Li\n0.756975 0.553497 0.249982 Li\n0.231174 0.449099 0.749999 Li\n0.243597 0.945333 0.749999 Li\n0.252917 0.123561 0.004349 Li\n0.252401 0.626151 0.002619 Li\n0.253002 0.123612 0.495520 Li\n0.252528 0.626219 0.497187 Li\n0.747507 0.376645 0.505889 Li\n0.747237 0.874758 0.501000 Li\n0.747413 0.376571 0.993954 Li\n0.747166 0.874731 0.998939 Li\n0.800046 0.658647 0.750010 Co\n0.200252 0.838722 0.250001 Co\n0.808425 0.162738 0.749972 Co\n0.191467 0.337464 0.249982 Co\n0.722877 0.213611 0.249972 Si\n0.722088 0.712981 0.250013 Si\n0.277548 0.286809 0.749981 Si\n0.279780 0.784522 0.749991 Si\n0.734313 0.019260 0.750028 B\n0.707500 0.522812 0.749996 B\n0.266985 0.480391 0.250006 B\n0.284708 0.979363 0.250017 B\n0.370615 0.053374 0.250014 O\n0.362798 0.553123 0.249920 O\n0.633016 0.447828 0.750003 O\n0.638568 0.946338 0.749990 O\n0.994211 0.038343 0.749980 O\n0.965297 0.547905 0.750132 O\n0.007005 0.461223 0.250050 O\n0.025637 0.957849 0.249998 O\n0.550685 0.088729 0.750175 O\n0.523571 0.590273 0.749819 O\n0.450554 0.410959 0.250071 O\n0.471928 0.911972 0.250036 O\n0.400337 0.231623 0.250122 O\n0.396900 0.731541 0.250109 O\n0.600270 0.268895 0.750220 O\n0.605777 0.763205 0.750010 O\n0.147350 0.199961 0.749931 O\n0.136176 0.701246 0.750059 O\n0.853456 0.300375 0.249979 O\n0.857141 0.798090 0.249962 O\n0.834809 0.152953 0.056485 O\n0.821337 0.651500 0.052092 O\n0.834837 0.152982 0.443529 O\n0.821537 0.651509 0.447895 O\n0.165879 0.347616 0.556702 O\n0.184027 0.846630 0.553951 O\n0.165793 0.347596 0.943303 O\n0.184123 0.846629 0.946067 O\n",
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"density_atomic": 0.09901016141574515,
"volume": 525.1986185705852,
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"formula_full": "Li12 Co4 Si4 B4 O28",
"formula_reduced": "Li3CoSiBO7",
"formula_anonymous": "ABCD3E7",
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{
"id": "mp-1026402",
"created_at": "2022-09-04T14:42:06.616066Z",
"structure_string": "Hf1 Mg14 Bi1\n1.0\n6.387068 -0.000000 0.000000\n-3.193534 5.531362 -0.000000\n-0.000000 -0.000000 10.489636\nHf Mg Bi\n1 14 1\ndirect\n0.166667 0.333333 0.625000 Hf\n0.164275 0.832137 0.125000 Mg\n0.170542 0.835270 0.625000 Mg\n0.667863 0.335725 0.125000 Mg\n0.664730 0.329458 0.625000 Mg\n0.667863 0.832137 0.125000 Mg\n0.664730 0.835270 0.625000 Mg\n0.331016 0.168984 0.380869 Mg\n0.331016 0.168984 0.869131 Mg\n0.331016 0.662033 0.380869 Mg\n0.331016 0.662033 0.869131 Mg\n0.837967 0.168984 0.380869 Mg\n0.837967 0.168984 0.869131 Mg\n0.833333 0.666667 0.379074 Mg\n0.833333 0.666667 0.870926 Mg\n0.166667 0.333333 0.125000 Bi\n",
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{
"id": "mp-1104131",
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"structure_string": "Nb2 P2 O10\n1.0\n6.491658 0.000000 0.000000\n0.000000 6.491658 0.000000\n0.000000 0.000000 4.267160\nNb P O\n2 2 10\ndirect\n0.500000 0.000000 0.222479 Nb\n0.000000 0.500000 0.777521 Nb\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.500000 P\n0.500000 0.000000 0.805827 O\n0.000000 0.500000 0.194173 O\n0.020781 0.806286 0.706172 O\n0.979219 0.193714 0.706172 O\n0.693714 0.520781 0.706172 O\n0.306286 0.479219 0.706172 O\n0.479219 0.693714 0.293828 O\n0.520781 0.306286 0.293828 O\n0.806286 0.979219 0.293828 O\n0.193714 0.020781 0.293828 O\n",
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{
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{
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{
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{
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],
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"formula_full": "U8 Ni6 O52 F28",
"formula_reduced": "U4Ni3(O13F7)2",
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"updated_at": "2021-11-28T01:35:36.268000Z",
"spacegroup": 14
},
{
"id": "mp-1235649",
"created_at": "2022-09-04T14:42:07.044172Z",
"structure_string": "Ba2 Li1 Mn2 P4 O14\n1.0\n5.484527 0.018846 -0.136726\n-0.475039 7.799823 -1.554469\n-0.099647 -0.068966 7.649274\nBa Li Mn P O\n2 1 2 4 14\ndirect\n0.202764 0.773343 0.957333 Ba\n0.809675 0.206335 0.078533 Ba\n0.860032 0.198401 0.654586 Li\n0.227668 0.600708 0.428453 Mn\n0.661184 0.459113 0.554772 Mn\n0.706921 0.733653 0.225687 P\n0.315852 0.251554 0.790359 P\n0.716158 0.830739 0.617304 P\n0.267457 0.182804 0.393724 P\n0.541430 0.236628 0.382095 O\n0.449703 0.772832 0.641848 O\n0.810761 0.993881 0.744828 O\n0.176844 0.028290 0.254265 O\n0.097821 0.334155 0.394702 O\n0.888428 0.680561 0.624611 O\n0.733129 0.871417 0.418809 O\n0.242306 0.130846 0.588851 O\n0.104959 0.371129 0.823917 O\n0.918705 0.614211 0.221949 O\n0.569284 0.341611 0.775361 O\n0.453805 0.638292 0.217033 O\n0.327748 0.130450 0.920369 O\n0.717368 0.842259 0.082279 O\n",
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"formula_full": "Ba2 Li1 Mn2 P4 O14",
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{
"id": "mp-756844",
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"structure_string": "Li3 Mn4 Sn1 O8\n1.0\n-3.539425 -4.341694 -2.558072\n-5.340654 1.681749 -2.558433\n5.404269 1.619126 -2.724456\nLi Mn Sn O\n3 4 1 8\ndirect\n0.000248 0.000136 0.500269 Li\n0.000042 0.500265 0.000285 Li\n0.500163 0.000154 0.000191 Li\n0.999657 0.499815 0.499812 Mn\n0.500146 0.999430 0.499849 Mn\n0.499939 0.499605 0.499685 Mn\n0.000116 0.999941 0.999581 Mn\n0.499889 0.500095 0.999884 Sn\n0.257535 0.258243 0.746164 O\n0.742375 0.741851 0.253796 O\n0.750419 0.749030 0.734260 O\n0.249609 0.250934 0.266167 O\n0.253408 0.732597 0.232477 O\n0.732368 0.253227 0.232265 O\n0.267457 0.747022 0.767598 O\n0.746631 0.267655 0.767717 O\n",
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{
"id": "mp-571664",
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"structure_string": "Zr4 Rh2\n1.0\n-3.271866 3.271866 2.831174\n3.271866 -3.271866 2.831174\n3.271866 3.271866 -2.831174\nZr Rh\n4 2\ndirect\n0.165483 0.334517 0.500000 Zr\n0.834517 0.665483 0.500000 Zr\n0.334517 0.834517 0.169033 Zr\n0.665483 0.165483 0.830967 Zr\n0.750000 0.750000 0.000000 Rh\n0.250000 0.250000 0.000000 Rh\n",
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}
]
}