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{
"id": "mp-1301164",
"created_at": "2022-09-04T14:48:20.241813Z",
"structure_string": "Li2 Co6 Ni2 O16\n1.0\n2.785900 -4.887913 0.004704\n5.701031 0.074411 0.004787\n0.053103 3.278037 10.000563\nLi Co Ni O\n2 6 2 16\ndirect\n0.499061 0.250053 0.249748 Li\n0.500945 0.749959 0.750252 Li\n0.499967 0.499945 0.000013 Co\n0.499991 0.999975 0.499987 Co\n0.500026 0.000022 0.999987 Co\n0.499962 0.500052 0.500008 Co\n0.000034 0.500030 0.999991 Co\n0.000025 0.999959 0.499993 Co\n0.000021 0.499747 0.499912 Ni\n0.000095 0.000063 0.000006 Ni\n0.729014 0.638027 0.095483 O\n0.728001 0.135575 0.595689 O\n0.272014 0.864405 0.404271 O\n0.271015 0.361969 0.904556 O\n0.230772 0.139554 0.094982 O\n0.233065 0.639872 0.594809 O\n0.723223 0.140602 0.095600 O\n0.718907 0.641386 0.596084 O\n0.251224 0.601163 0.102991 O\n0.245540 0.106314 0.601119 O\n0.754436 0.893770 0.398877 O\n0.748809 0.398787 0.897008 O\n0.280920 0.358732 0.403969 O\n0.276718 0.859394 0.904398 O\n0.767109 0.360306 0.405250 O\n0.769104 0.860340 0.905018 O\n",
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{
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"structure_string": "Mn12 O10 F14\n1.0\n4.739842 0.000000 0.000000\n0.016701 5.731583 0.000000\n0.023900 0.020086 15.586386\nMn O F\n12 10 14\ndirect\n0.963354 0.165575 0.580866 Mn\n0.995408 0.814401 0.748306 Mn\n0.956716 0.164958 0.917096 Mn\n0.024206 0.154871 0.255298 Mn\n0.996097 0.864257 0.421478 Mn\n0.945312 0.837584 0.084721 Mn\n0.526992 0.333886 0.411381 Mn\n0.519548 0.340263 0.079083 Mn\n0.493877 0.373673 0.753738 Mn\n0.488352 0.636593 0.915734 Mn\n0.531988 0.656532 0.579676 Mn\n0.520186 0.655847 0.249075 Mn\n0.805506 0.108653 0.361619 O\n0.763238 0.105353 0.029118 O\n0.781972 0.904684 0.525711 O\n0.792349 0.894985 0.199425 O\n0.705943 0.390114 0.857770 O\n0.709650 0.599571 0.690257 O\n0.718562 0.389623 0.522181 O\n0.702385 0.594848 0.021431 O\n0.279724 0.609586 0.808128 O\n0.313677 0.373716 0.304893 O\n0.738844 0.118946 0.700373 F\n0.757753 0.888642 0.858691 F\n0.757405 0.608396 0.361307 F\n0.766990 0.403808 0.190918 F\n0.236281 0.370903 0.975274 F\n0.240180 0.380359 0.642437 F\n0.271211 0.634913 0.473510 F\n0.268912 0.613373 0.135338 F\n0.221630 0.124852 0.803898 F\n0.251418 0.135798 0.475593 F\n0.229920 0.892672 0.633852 F\n0.211572 0.865777 0.970940 F\n0.256660 0.123321 0.142557 F\n0.256177 0.868670 0.318324 F\n",
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"formula_full": "Mn12 O10 F14",
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{
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"created_at": "2022-09-04T14:48:20.216645Z",
"structure_string": "Li3 Mn6 P6 O24\n1.0\n7.504107 0.000000 0.000000\n-3.703363 6.570684 0.000000\n-0.058705 -0.077186 9.579344\nLi Mn P O\n3 6 6 24\ndirect\n0.243062 0.190199 0.244544 Li\n0.046157 0.808112 0.743275 Li\n0.792085 0.036499 0.247210 Li\n0.601687 0.552283 0.038880 Mn\n0.949594 0.414477 0.026935 Mn\n0.458859 0.039212 0.013486 Mn\n0.412930 0.956971 0.520621 Mn\n0.049438 0.451111 0.530001 Mn\n0.555628 0.603073 0.544602 Mn\n0.996145 0.000210 0.493022 P\n0.997214 0.999605 0.993713 P\n0.673537 0.339087 0.729760 P\n0.665741 0.346563 0.327373 P\n0.329801 0.650206 0.827577 P\n0.336996 0.664047 0.230738 P\n0.000285 0.008316 0.334283 O\n0.987975 0.989851 0.837168 O\n0.880556 0.775451 0.053483 O\n0.695940 0.545408 0.396967 O\n0.513776 0.399848 0.680620 O\n0.889635 0.504706 0.685980 O\n0.682241 0.370563 0.160622 O\n0.669944 0.335567 0.897324 O\n0.452619 0.169183 0.360490 O\n0.219630 0.095184 0.054459 O\n0.110349 0.889624 0.550666 O\n0.834354 0.297940 0.370805 O\n0.614974 0.127968 0.674802 O\n0.895295 0.120480 0.058164 O\n0.287974 0.826581 0.859204 O\n0.502647 0.875609 0.180857 O\n0.125946 0.611571 0.173044 O\n0.333233 0.665133 0.396330 O\n0.349309 0.647340 0.661848 O\n0.533751 0.688733 0.894522 O\n0.766455 0.888256 0.542066 O\n0.150340 0.448885 0.880137 O\n0.388694 0.495783 0.184493 O\n0.103617 0.219567 0.553069 O\n",
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"formula_full": "Li3 Mn6 P6 O24",
"formula_reduced": "LiMn2(PO4)2",
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{
"id": "mp-1195086",
"created_at": "2022-09-04T14:48:20.219064Z",
"structure_string": "Sb20 I4 O28\n1.0\n6.914361 0.000000 0.000000\n0.000000 11.915781 0.000000\n0.000000 0.000000 13.049072\nSb I O\n20 4 28\ndirect\n0.980776 0.160800 0.768817 Sb\n0.480776 0.660800 0.731183 Sb\n0.922941 0.180807 0.245203 Sb\n0.422941 0.680807 0.254797 Sb\n0.444324 0.016204 0.756052 Sb\n0.944324 0.516204 0.743948 Sb\n0.444324 0.983796 0.243948 Sb\n0.944324 0.483796 0.256052 Sb\n0.922941 0.819193 0.754797 Sb\n0.422941 0.319193 0.745203 Sb\n0.980776 0.839200 0.231183 Sb\n0.480776 0.339200 0.268817 Sb\n0.290153 0.829634 0.940811 Sb\n0.790153 0.329634 0.559189 Sb\n0.279013 0.832554 0.550476 Sb\n0.779013 0.332554 0.949524 Sb\n0.790153 0.670366 0.440811 Sb\n0.290153 0.170366 0.059189 Sb\n0.779013 0.667446 0.050476 Sb\n0.279013 0.167446 0.449524 Sb\n0.740824 0.000000 0.000000 I\n0.240824 0.500000 0.500000 I\n0.826050 0.000000 0.500000 I\n0.326050 0.500000 0.000000 I\n0.285567 0.166128 0.754940 O\n0.785567 0.666128 0.745060 O\n0.285567 0.833872 0.245060 O\n0.785567 0.333872 0.254940 O\n0.480477 0.789841 0.828760 O\n0.980477 0.289841 0.671240 O\n0.517114 0.762055 0.612584 O\n0.017114 0.262055 0.887416 O\n0.559881 0.746835 0.374075 O\n0.059881 0.246835 0.125925 O\n0.616054 0.747783 0.159857 O\n0.116054 0.247783 0.340143 O\n0.059881 0.753165 0.874075 O\n0.559881 0.253165 0.625925 O\n0.116054 0.752217 0.659857 O\n0.616054 0.252217 0.840143 O\n0.980477 0.710159 0.328760 O\n0.480477 0.210159 0.171240 O\n0.017114 0.737945 0.112584 O\n0.517114 0.237945 0.387416 O\n0.239850 0.969739 0.857330 O\n0.739850 0.469739 0.642670 O\n0.293174 0.972788 0.633588 O\n0.793174 0.472788 0.866412 O\n0.293174 0.027212 0.366412 O\n0.793174 0.527212 0.133588 O\n0.239850 0.030261 0.142670 O\n0.739850 0.530261 0.357330 O\n",
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{
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"structure_string": "V4 O7 F5\n1.0\n5.269605 0.000000 0.000000\n-2.605152 4.659105 0.000000\n-0.010481 -2.904994 8.540559\nV O F\n4 7 5\ndirect\n0.745412 0.212383 0.264108 V\n0.507340 0.450003 0.509983 V\n0.206912 0.700691 0.752288 V\n0.955861 0.982079 0.014960 V\n0.811264 0.642947 0.119637 O\n0.694432 0.884659 0.374934 O\n0.843211 0.167471 0.082154 O\n0.847075 0.596415 0.662381 O\n0.313256 0.137851 0.624632 O\n0.204029 0.389089 0.867559 O\n0.657439 0.347789 0.411903 O\n0.343907 0.679320 0.586558 F\n0.334598 0.102619 0.152679 F\n0.171121 0.431585 0.338553 F\n0.187455 0.854052 0.908274 F\n0.676685 0.921045 0.829395 F\n",
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{
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{
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{
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{
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"structure_string": "Lu3 Al9 Ni6\n1.0\n4.470813 -7.743675 0.000000\n4.470813 7.743675 0.000000\n0.000000 0.000000 4.024314\nLu Al Ni\n3 9 6\ndirect\n0.000000 0.000000 0.000000 Lu\n0.666667 0.333333 0.500000 Lu\n0.333333 0.666667 0.500000 Lu\n0.500000 0.500000 0.000000 Al\n0.500000 0.000000 0.000000 Al\n0.000000 0.500000 0.000000 Al\n0.702923 0.702923 0.500000 Al\n0.297077 0.000000 0.500000 Al\n0.000000 0.297077 0.500000 Al\n0.297077 0.297077 0.500000 Al\n0.702923 0.000000 0.500000 Al\n0.000000 0.702923 0.500000 Al\n0.817140 0.182860 0.000000 Ni\n0.817140 0.634281 0.000000 Ni\n0.365719 0.182860 0.000000 Ni\n0.182860 0.817140 0.000000 Ni\n0.634281 0.817140 0.000000 Ni\n0.182860 0.365719 0.000000 Ni\n",
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}
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}