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{
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{
"id": "mp-23280",
"created_at": "2022-09-04T14:48:26.010624Z",
"structure_string": "As4 Cl12\n1.0\n4.652758 0.000000 0.000000\n0.000000 10.227273 0.000000\n0.000000 0.000000 12.232531\nAs Cl\n4 12\ndirect\n0.028184 0.698978 0.787635 As\n0.528184 0.801022 0.212365 As\n0.971816 0.198978 0.712365 As\n0.471816 0.301022 0.287635 As\n0.244633 0.529900 0.864061 Cl\n0.744633 0.970100 0.135939 Cl\n0.755367 0.029900 0.635939 Cl\n0.255367 0.470100 0.364061 Cl\n0.236011 0.296289 0.130998 Cl\n0.736011 0.203711 0.869002 Cl\n0.763989 0.796289 0.369002 Cl\n0.263989 0.703711 0.630998 Cl\n0.242114 0.142842 0.374600 Cl\n0.742114 0.357158 0.625400 Cl\n0.757886 0.642842 0.125400 Cl\n0.257886 0.857158 0.874600 Cl\n",
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{
"id": "mp-1234139",
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"structure_string": "K2 Nd2 Mg1 S4 O16\n1.0\n5.464898 0.035876 -0.189341\n-0.113052 8.346518 -1.435768\n0.031791 -0.835925 9.814570\nK Nd Mg S O\n2 2 1 4 16\ndirect\n0.760808 0.134776 0.077443 K\n0.245929 0.973791 0.661667 K\n0.229478 0.586291 0.291438 Nd\n0.768719 0.393875 0.729609 Nd\n0.252076 0.795291 0.967254 Mg\n0.247209 0.346269 0.911172 S\n0.748610 0.741665 0.560105 S\n0.752705 0.627601 0.114892 S\n0.252392 0.239657 0.461962 S\n0.721363 0.569327 0.960991 O\n0.213187 0.341535 0.358507 O\n0.777371 0.632662 0.657276 O\n0.964343 0.715409 0.467220 O\n0.266240 0.067429 0.391710 O\n0.466658 0.256309 0.846456 O\n0.976524 0.736132 0.149432 O\n0.209145 0.495940 0.857711 O\n0.043674 0.269870 0.560633 O\n0.527648 0.718697 0.169527 O\n0.794342 0.491570 0.184626 O\n0.280895 0.386792 0.065922 O\n0.023683 0.240585 0.866932 O\n0.739759 0.912579 0.638483 O\n0.481660 0.299307 0.546734 O\n0.518082 0.693309 0.473726 O\n",
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{
"id": "mp-761092",
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"structure_string": "Li8 V4 O12 F4\n1.0\n4.149144 4.016662 0.000000\n-4.149144 4.016662 0.000000\n0.000000 3.831646 8.471668\nLi V O F\n8 4 12 4\ndirect\n0.313206 0.544528 0.634277 Li\n0.572657 0.801732 0.133932 Li\n0.309159 0.050971 0.640159 Li\n0.544528 0.313206 0.134277 Li\n0.801732 0.572657 0.633932 Li\n0.050971 0.309159 0.140159 Li\n0.446165 0.664903 0.875030 Li\n0.664903 0.446165 0.375030 Li\n0.192959 0.881147 0.386683 V\n0.881147 0.192959 0.886683 V\n0.114671 0.827885 0.098674 V\n0.827885 0.114671 0.598674 V\n0.836568 0.065610 0.096229 O\n0.414824 0.696582 0.382977 O\n0.065610 0.836568 0.596229 O\n0.043854 0.289977 0.647915 O\n0.299113 0.596055 0.107759 O\n0.289977 0.043854 0.147915 O\n0.719147 0.963377 0.852177 O\n0.696582 0.414824 0.882977 O\n0.963377 0.719147 0.352177 O\n0.939872 0.175712 0.397907 O\n0.596055 0.299113 0.607759 O\n0.175712 0.939872 0.897907 O\n0.815740 0.569008 0.144879 F\n0.422677 0.177104 0.364213 F\n0.569008 0.815740 0.644879 F\n0.177104 0.422677 0.864213 F\n",
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"formula_full": "Li8 V4 O12 F4",
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{
"id": "mp-1233813",
"created_at": "2022-09-04T14:48:19.820450Z",
"structure_string": "Mg1 Ag14 Pb6 O18\n1.0\n-3.145877 5.467305 6.481420\n3.030276 5.241416 -6.352698\n-6.224724 -0.013914 -6.438771\nMg Ag Pb O\n1 14 6 18\ndirect\n0.854053 0.999233 0.879650 Mg\n0.805229 0.220269 0.590689 Ag\n0.171915 0.333223 0.835217 Ag\n0.589904 0.768099 0.808694 Ag\n0.495809 0.003802 0.493623 Ag\n0.139202 0.908917 0.921287 Ag\n0.235061 0.729762 0.731353 Ag\n0.424065 0.577470 0.582416 Ag\n0.589622 0.429882 0.420263 Ag\n0.728361 0.262061 0.231005 Ag\n0.945935 0.072768 0.172185 Ag\n0.015615 0.522113 0.499196 Ag\n0.835631 0.662662 0.172409 Ag\n0.172185 0.839361 0.337834 Ag\n0.494747 0.466490 0.023014 Ag\n0.499054 0.158539 0.834400 Pb\n0.837048 0.493885 0.842594 Pb\n0.175282 0.174206 0.499394 Pb\n0.832880 0.843356 0.507721 Pb\n0.174398 0.495898 0.173015 Pb\n0.499954 0.837160 0.165563 Pb\n0.760451 0.188773 0.831944 O\n0.549198 0.425366 0.820636 O\n0.903780 0.121333 0.453599 O\n0.225421 0.146586 0.766514 O\n0.842443 0.824741 0.774727 O\n0.450743 0.882636 0.892333 O\n0.119497 0.515813 0.908833 O\n0.440789 0.190957 0.563439 O\n0.821981 0.574451 0.553973 O\n0.524819 0.105664 0.097250 O\n0.195700 0.446462 0.442621 O\n0.913254 0.479312 0.126241 O\n0.563264 0.816296 0.436160 O\n0.165815 0.231800 0.235649 O\n0.765449 0.856325 0.212420 O\n0.440213 0.558638 0.193993 O\n0.105658 0.899981 0.521567 O\n0.233566 0.769146 0.158283 O\n",
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],
"chemical_system": "Ag-Mg-O-Pb",
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"density_atomic": 0.06088899272592754,
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"formula_full": "Mg1 Ag14 Pb6 O18",
"formula_reduced": "MgAg14(PbO3)6",
"formula_anonymous": "AB6C14D18",
"energy": -184.64448498,
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{
"id": "mp-557756",
"created_at": "2022-09-04T14:48:23.916029Z",
"structure_string": "Li16 Zn4 P8 O32\n1.0\n10.404283 0.000000 0.000000\n0.000000 8.209267 0.000000\n0.000000 2.078106 7.955298\nLi Zn P O\n16 4 8 32\ndirect\n0.072943 0.272313 0.477967 Li\n0.651294 0.150987 0.850471 Li\n0.151294 0.349013 0.149529 Li\n0.927057 0.727687 0.522033 Li\n0.427057 0.772313 0.477967 Li\n0.348706 0.849013 0.149529 Li\n0.164459 0.599343 0.398290 Li\n0.837945 0.157434 0.345325 Li\n0.572943 0.227687 0.522033 Li\n0.848706 0.650987 0.850471 Li\n0.337945 0.342566 0.654675 Li\n0.662055 0.657434 0.345325 Li\n0.835541 0.400657 0.601710 Li\n0.162055 0.842566 0.654675 Li\n0.664459 0.900657 0.601710 Li\n0.335541 0.099343 0.398290 Li\n0.843294 0.908708 0.092214 Zn\n0.656706 0.408708 0.092214 Zn\n0.156706 0.091292 0.907786 Zn\n0.343294 0.591292 0.907786 Zn\n0.093271 0.465678 0.767568 P\n0.906729 0.534322 0.232432 P\n0.908528 0.026695 0.711152 P\n0.408528 0.473305 0.288848 P\n0.406729 0.965678 0.767568 P\n0.591472 0.526695 0.711152 P\n0.091472 0.973305 0.288848 P\n0.593271 0.034322 0.232432 P\n0.655269 0.087725 0.383336 O\n0.349964 0.628313 0.337616 O\n0.053541 0.991192 0.755652 O\n0.946459 0.008808 0.244348 O\n0.155269 0.412275 0.616664 O\n0.849964 0.871687 0.662384 O\n0.330332 0.115832 0.804834 O\n0.600971 0.686839 0.562863 O\n0.650036 0.371687 0.662384 O\n0.896936 0.684556 0.071737 O\n0.952709 0.521799 0.725424 O\n0.103064 0.315444 0.928263 O\n0.547291 0.021799 0.725424 O\n0.344731 0.912275 0.616664 O\n0.452709 0.978201 0.274576 O\n0.844731 0.587725 0.383336 O\n0.666853 0.560600 0.863648 O\n0.169668 0.615832 0.804834 O\n0.669668 0.884168 0.195166 O\n0.166853 0.939400 0.136352 O\n0.830332 0.384168 0.195166 O\n0.446459 0.491192 0.755652 O\n0.100971 0.813161 0.437137 O\n0.833147 0.060600 0.863648 O\n0.047291 0.478201 0.274576 O\n0.396936 0.815444 0.928263 O\n0.333147 0.439400 0.136352 O\n0.553541 0.508808 0.244348 O\n0.603064 0.184556 0.071737 O\n0.150036 0.128313 0.337616 O\n0.899029 0.186839 0.562863 O\n0.399029 0.313161 0.437137 O\n",
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{
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"structure_string": "Bi4 F20\n1.0\n10.281911 0.000000 0.000000\n0.000000 5.640760 0.000000\n0.000000 3.055980 7.738240\nBi F\n4 20\ndirect\n0.751923 0.118581 0.596777 Bi\n0.251923 0.881419 0.903223 Bi\n0.248077 0.881419 0.403223 Bi\n0.748077 0.118581 0.096777 Bi\n0.874862 0.409162 0.567345 F\n0.374862 0.590838 0.932655 F\n0.125138 0.590838 0.432655 F\n0.625138 0.409162 0.067345 F\n0.610130 0.367460 0.483131 F\n0.110130 0.632540 0.016869 F\n0.389870 0.632540 0.516869 F\n0.889870 0.367460 0.983131 F\n0.396425 0.128148 0.792325 F\n0.896425 0.871852 0.707675 F\n0.603575 0.871852 0.207675 F\n0.103575 0.128148 0.292325 F\n0.130579 0.174602 0.872095 F\n0.630579 0.825398 0.627905 F\n0.869421 0.825398 0.127905 F\n0.369421 0.174602 0.372095 F\n0.685811 0.116603 0.846472 F\n0.185811 0.883397 0.653528 F\n0.314189 0.883397 0.153528 F\n0.814189 0.116603 0.346472 F\n",
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{
"id": "mp-1042781",
"created_at": "2022-09-04T14:48:25.420369Z",
"structure_string": "Ca3 Fe4 Sb6 O24\n1.0\n6.925325 0.000000 0.000000\n-3.274839 8.095111 0.000000\n-0.981231 -3.692862 9.471137\nCa Fe Sb O\n3 4 6 24\ndirect\n0.500000 0.000000 0.500000 Ca\n0.438940 0.465225 0.812216 Ca\n0.561060 0.534775 0.187784 Ca\n0.230220 0.637728 0.597854 Fe\n0.769780 0.362272 0.402146 Fe\n0.962400 0.813866 0.007185 Fe\n0.037600 0.186134 0.992815 Fe\n0.886705 0.389121 0.758289 Sb\n0.113295 0.610879 0.241711 Sb\n0.798708 0.777071 0.660224 Sb\n0.447228 0.077933 0.885498 Sb\n0.201292 0.222929 0.339776 Sb\n0.552772 0.922067 0.114502 Sb\n0.773848 0.927327 0.569406 O\n0.226152 0.072673 0.430594 O\n0.597575 0.246239 0.794048 O\n0.402425 0.753761 0.205952 O\n0.729287 0.287313 0.565881 O\n0.270713 0.712687 0.434119 O\n0.917742 0.621648 0.561148 O\n0.082258 0.378352 0.438852 O\n0.358971 0.255996 0.985039 O\n0.641029 0.744004 0.014961 O\n0.831024 0.467909 0.259011 O\n0.168976 0.532091 0.740989 O\n0.512579 0.625218 0.658112 O\n0.039360 0.070065 0.143078 O\n0.960640 0.929935 0.856922 O\n0.674040 0.102556 0.296686 O\n0.325960 0.897444 0.703314 O\n0.967255 0.710889 0.147374 O\n0.032745 0.289111 0.852626 O\n0.825260 0.590303 0.843470 O\n0.174740 0.409697 0.156530 O\n0.699901 0.088296 0.001833 O\n0.300099 0.911704 0.998167 O\n0.487421 0.374782 0.341888 O\n",
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}
]
}