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{
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{
"id": "mp-1214014",
"created_at": "2022-09-04T14:41:35.306414Z",
"structure_string": "Cs8 Na4 U4 Br24\n1.0\n11.687164 0.000000 0.000000\n0.000000 11.687164 0.000000\n0.000000 0.000000 11.687164\nCs Na U Br\n8 4 4 24\ndirect\n0.249147 0.249147 0.249147 Cs\n0.750853 0.750853 0.750853 Cs\n0.250853 0.750853 0.749147 Cs\n0.750853 0.749147 0.250853 Cs\n0.749147 0.249147 0.250853 Cs\n0.249147 0.250853 0.749147 Cs\n0.749147 0.250853 0.750853 Cs\n0.250853 0.749147 0.249147 Cs\n0.500000 0.500000 0.500000 Na\n0.000000 0.500000 0.000000 Na\n0.500000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.000000 0.000000 0.000000 U\n0.500000 0.000000 0.500000 U\n0.000000 0.500000 0.500000 U\n0.500000 0.500000 0.000000 U\n0.993154 0.247303 0.006632 Br\n0.006846 0.752697 0.993368 Br\n0.506846 0.752697 0.506632 Br\n0.006846 0.747303 0.493368 Br\n0.006632 0.993154 0.247303 Br\n0.493154 0.247303 0.493368 Br\n0.993154 0.252697 0.506632 Br\n0.993368 0.006846 0.752697 Br\n0.493154 0.252697 0.993368 Br\n0.506632 0.506846 0.752697 Br\n0.506846 0.747303 0.006632 Br\n0.493368 0.493154 0.247303 Br\n0.493368 0.006846 0.747303 Br\n0.506632 0.993154 0.252697 Br\n0.993368 0.493154 0.252697 Br\n0.006632 0.506846 0.747303 Br\n0.247303 0.006632 0.993154 Br\n0.752697 0.993368 0.006846 Br\n0.747303 0.493368 0.006846 Br\n0.252697 0.506632 0.993154 Br\n0.252697 0.993368 0.493154 Br\n0.747303 0.006632 0.506846 Br\n0.752697 0.506632 0.506846 Br\n0.247303 0.493368 0.493154 Br\n",
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{
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"elements": [
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"density": 7.057096696193689,
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"formula_full": "La1 Ho4 C10",
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},
{
"id": "mp-1217941",
"created_at": "2022-09-04T14:41:35.314427Z",
"structure_string": "Ta2 Fe8 Si2\n1.0\n2.393762 -4.146118 0.000000\n2.393762 4.146118 0.000000\n0.000000 0.000000 7.514759\nTa Fe Si\n2 8 2\ndirect\n0.666667 0.333333 0.920625 Ta\n0.333333 0.666667 0.079375 Ta\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.829441 0.170559 0.256079 Fe\n0.829441 0.658881 0.256079 Fe\n0.341119 0.170559 0.256079 Fe\n0.170559 0.829441 0.743921 Fe\n0.170559 0.341119 0.743921 Fe\n0.658881 0.829441 0.743921 Fe\n0.333333 0.666667 0.442525 Si\n0.666667 0.333333 0.557475 Si\n",
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"formula_full": "Ta2 Fe8 Si2",
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{
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"structure_string": "Mg4 Si8\n1.0\n3.782960 0.000000 0.000000\n0.000000 6.291519 0.000000\n0.000000 2.887134 9.954638\nMg Si\n4 8\ndirect\n0.229919 0.183724 0.761190 Mg\n0.225262 0.342965 0.246539 Mg\n0.725262 0.657035 0.753461 Mg\n0.729919 0.816276 0.238810 Mg\n0.238637 0.588884 0.435180 Si\n0.704432 0.938033 0.949656 Si\n0.227586 0.444680 0.948143 Si\n0.864539 0.036851 0.559955 Si\n0.364539 0.963149 0.440045 Si\n0.727586 0.555320 0.051857 Si\n0.204432 0.061967 0.050344 Si\n0.738637 0.411116 0.564820 Si\n",
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"formula_full": "Mg4 Si8",
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"spacegroup": 4
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{
"id": "mp-1246913",
"created_at": "2022-09-04T14:41:35.323412Z",
"structure_string": "Mn1 Pb2 N2\n1.0\n3.135381 -0.035002 -0.597814\n-1.598003 2.767822 0.000000\n-1.504153 -0.868424 10.584681\nMn Pb N\n1 2 2\ndirect\n0.000000 0.000000 0.500000 Mn\n0.882057 0.441029 0.182066 Pb\n0.117943 0.558971 0.817934 Pb\n0.801191 0.400596 0.592941 N\n0.198809 0.599404 0.407059 N\n",
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{
"id": "mp-1196185",
"created_at": "2022-09-04T14:41:35.325953Z",
"structure_string": "V4 Cu9 Cl2 O18\n1.0\n6.472952 -0.002293 -0.690742\n-2.805280 7.585029 -2.196033\n0.005475 0.045425 9.298450\nV Cu Cl O\n4 9 2 18\ndirect\n0.110260 0.583488 0.350026 V\n0.889740 0.416512 0.649974 V\n0.675536 0.750227 0.148796 V\n0.324464 0.249773 0.851204 V\n0.859087 0.282284 0.970031 Cu\n0.140913 0.717716 0.029969 Cu\n0.582325 0.454366 0.357577 Cu\n0.417675 0.545634 0.642423 Cu\n0.830690 0.168493 0.312244 Cu\n0.169310 0.831507 0.687756 Cu\n0.500000 0.000000 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.348222 0.130470 0.276652 Cl\n0.651778 0.869530 0.723348 Cl\n0.608665 0.560995 0.193165 O\n0.391335 0.439005 0.806835 O\n0.860607 0.408238 0.340586 O\n0.139393 0.591762 0.659414 O\n0.659787 0.463720 0.580886 O\n0.340213 0.536280 0.419114 O\n0.909760 0.219436 0.535516 O\n0.090240 0.780564 0.464484 O\n0.891656 0.415558 0.833553 O\n0.108344 0.584442 0.166447 O\n0.122072 0.225618 0.967724 O\n0.877928 0.774382 0.032276 O\n0.809138 0.110328 0.094160 O\n0.190862 0.889672 0.905840 O\n0.549360 0.218277 0.950486 O\n0.450640 0.781723 0.049514 O\n0.786532 0.931437 0.316510 O\n0.213468 0.068563 0.683490 O\n",
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"formula_full": "V4 Cu9 Cl2 O18",
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{
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"structure_string": "Y4 Ge1 O8 F2\n1.0\n5.645532 0.000000 0.000000\n-2.239881 6.013849 0.000000\n-2.342569 -0.907941 6.448944\nY Ge O F\n4 1 8 2\ndirect\n0.861043 0.715219 0.865098 Y\n0.123272 0.272587 0.139395 Y\n0.551051 0.940354 0.255588 Y\n0.449747 0.073886 0.748333 Y\n0.090761 0.443340 0.636937 Ge\n0.934140 0.263466 0.397251 O\n0.102231 0.723823 0.646553 O\n0.519016 0.578632 0.216916 O\n0.419777 0.432963 0.755543 O\n0.151842 0.636496 0.169299 O\n0.893129 0.348223 0.802925 O\n0.733713 0.964858 0.012159 O\n0.257951 0.041313 0.988971 O\n0.649186 0.876839 0.599445 F\n0.358841 0.122902 0.406689 F\n",
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{
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{
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"structure_string": "Sr1 Eu1 Ti1 In1 O6\n1.0\n-0.000000 -4.067275 -4.067275\n4.067275 0.000000 -4.067275\n4.067275 -4.067275 -0.000000\nSr Eu Ti In O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 Ti\n-0.000000 0.000000 0.000000 In\n0.739588 0.260412 0.260412 O\n0.260412 0.739588 0.739588 O\n0.739588 0.260412 0.739588 O\n0.260412 0.739588 0.260412 O\n0.739588 0.739588 0.260412 O\n0.260412 0.260412 0.739588 O\n",
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{
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"structure_string": "Mg1 V3 Co1 Sn2 P6 O24\n1.0\n9.701720 0.677352 0.480651\n4.231710 -7.375435 0.033528\n4.231893 -2.438421 -6.914355\nMg V Co Sn P O\n1 3 1 2 6 24\ndirect\n0.677037 0.443345 0.449171 Mg\n0.017296 0.661256 0.665025 V\n0.462705 0.846134 0.843512 V\n0.998475 0.330618 0.336209 V\n0.520867 0.160382 0.151817 Co\n0.912495 0.032040 0.029242 Sn\n0.365155 0.542503 0.538944 Sn\n0.262760 0.242526 0.530825 P\n0.261033 0.960372 0.243563 P\n0.263209 0.532636 0.958384 P\n0.754097 0.466466 0.035197 P\n0.756410 0.030669 0.750397 P\n0.758743 0.748085 0.464233 P\n0.107397 0.126461 0.246190 O\n0.116105 0.512959 0.131414 O\n0.111135 0.235543 0.519477 O\n0.318698 0.070441 0.692982 O\n0.394550 0.289857 0.345100 O\n0.196713 0.424984 0.589733 O\n0.313963 0.922528 0.065765 O\n0.199254 0.782234 0.423130 O\n0.609533 0.635946 0.015270 O\n0.198187 0.590468 0.781560 O\n0.725282 0.291482 0.053892 O\n0.615754 0.006833 0.740094 O\n0.393223 0.967936 0.288633 O\n0.318910 0.694438 0.914366 O\n0.806063 0.420122 0.206432 O\n0.398979 0.351476 0.957009 O\n0.807416 0.202405 0.575525 O\n0.721925 0.053376 0.936671 O\n0.816282 0.569613 0.417907 O\n0.611718 0.738351 0.633275 O\n0.727489 0.930403 0.289229 O\n0.908508 0.746317 0.493912 O\n0.909772 0.492153 0.862274 O\n0.912865 0.860708 0.745519 O\n",
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{
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}