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{
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{
"id": "mp-559880",
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"structure_string": "K8 Ag24 Sn12 S40\n1.0\n6.443604 0.000000 0.000000\n0.000000 13.518240 0.000000\n0.000000 0.000000 24.760954\nK Ag Sn S\n8 24 12 40\ndirect\n0.074672 0.214367 0.820617 K\n0.925328 0.714367 0.820617 K\n0.425328 0.785633 0.320617 K\n0.074672 0.285633 0.179383 K\n0.425328 0.714367 0.679383 K\n0.574672 0.214367 0.679383 K\n0.925328 0.785633 0.179383 K\n0.574672 0.285633 0.320617 K\n0.418877 0.585294 0.040759 Ag\n0.550839 0.290212 0.100348 Ag\n0.491265 0.528847 0.407856 Ag\n0.050839 0.290212 0.399652 Ag\n0.949161 0.790212 0.399652 Ag\n0.491265 0.971153 0.592144 Ag\n0.991265 0.528847 0.092144 Ag\n0.581123 0.414706 0.959241 Ag\n0.550839 0.209788 0.899652 Ag\n0.581123 0.085294 0.040759 Ag\n0.449161 0.790212 0.100348 Ag\n0.918877 0.585294 0.459241 Ag\n0.918877 0.914706 0.540759 Ag\n0.081123 0.085294 0.459241 Ag\n0.508735 0.471153 0.592144 Ag\n0.008735 0.471153 0.907856 Ag\n0.991265 0.971153 0.907856 Ag\n0.418877 0.914706 0.959241 Ag\n0.008735 0.028847 0.092144 Ag\n0.949161 0.709788 0.600348 Ag\n0.508735 0.028847 0.407856 Ag\n0.081123 0.414706 0.540759 Ag\n0.449161 0.709788 0.899652 Ag\n0.050839 0.209788 0.600348 Ag\n0.550052 0.441625 0.799306 Sn\n0.475262 0.750000 0.500000 Sn\n0.050052 0.058375 0.299306 Sn\n0.050052 0.441625 0.700694 Sn\n0.024738 0.250000 0.000000 Sn\n0.949948 0.941625 0.700694 Sn\n0.449948 0.941625 0.799306 Sn\n0.550052 0.058375 0.200694 Sn\n0.449948 0.558375 0.200694 Sn\n0.975262 0.750000 0.000000 Sn\n0.524738 0.250000 0.500000 Sn\n0.949948 0.558375 0.299306 Sn\n0.302180 0.122271 0.540313 S\n0.662709 0.967478 0.121063 S\n0.197820 0.622271 0.959687 S\n0.662709 0.532522 0.878937 S\n0.410256 0.767999 0.803822 S\n0.337291 0.467478 0.121063 S\n0.261192 0.671750 0.431142 S\n0.310647 0.001824 0.711836 S\n0.589744 0.232001 0.196178 S\n0.738808 0.328250 0.568858 S\n0.802180 0.122271 0.959687 S\n0.910256 0.732001 0.303822 S\n0.197820 0.877729 0.040313 S\n0.837291 0.467478 0.378937 S\n0.589744 0.267999 0.803822 S\n0.238808 0.171750 0.068858 S\n0.302180 0.377729 0.459687 S\n0.089744 0.267999 0.696178 S\n0.337291 0.032522 0.878937 S\n0.837291 0.032522 0.621063 S\n0.761192 0.671750 0.068858 S\n0.697820 0.877729 0.459687 S\n0.162709 0.532522 0.621063 S\n0.738808 0.171750 0.431142 S\n0.910256 0.767999 0.696178 S\n0.261192 0.828250 0.568858 S\n0.689353 0.501824 0.711836 S\n0.189353 0.998176 0.211836 S\n0.162709 0.967478 0.378937 S\n0.089744 0.232001 0.303822 S\n0.810647 0.001824 0.788164 S\n0.310647 0.498176 0.288164 S\n0.802180 0.377729 0.040313 S\n0.689353 0.998176 0.288164 S\n0.410256 0.732001 0.196178 S\n0.238808 0.328250 0.931142 S\n0.697820 0.622271 0.540313 S\n0.810647 0.498176 0.211836 S\n0.189353 0.501824 0.788164 S\n0.761192 0.828250 0.931142 S\n",
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{
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"created_at": "2022-09-04T14:47:09.221680Z",
"structure_string": "Sr2 Lu1 U1 O6\n1.0\n-4.304012 -4.304012 0.000000\n-4.304012 0.000000 -4.304012\n0.000000 -4.304012 -4.304012\nSr Lu U O\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 U\n0.748297 0.748297 0.251703 O\n0.251703 0.251703 0.748297 O\n0.748297 0.251703 0.748297 O\n0.251703 0.748297 0.251703 O\n0.251703 0.748297 0.748297 O\n0.748297 0.251703 0.251703 O\n",
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{
"id": "mp-1177235",
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"structure_string": "Li4 V3 Ni2 Sb3 O16\n1.0\n3.058934 5.322484 0.000000\n-3.058934 5.322484 0.000000\n0.000000 0.080900 9.810402\nLi V Ni Sb O\n4 3 2 3 16\ndirect\n0.662656 0.662656 0.124995 Li\n0.992565 0.992565 0.009019 Li\n0.993638 0.993638 0.493779 Li\n0.328622 0.328622 0.601021 Li\n0.832223 0.832223 0.784056 V\n0.170618 0.662066 0.285793 V\n0.662066 0.170618 0.285793 V\n0.673395 0.673395 0.488915 Ni\n0.341056 0.341056 0.026311 Ni\n0.338471 0.831461 0.783872 Sb\n0.831461 0.338471 0.783872 Sb\n0.170376 0.170376 0.285348 Sb\n0.318881 0.845805 0.399196 O\n0.514669 0.514669 0.666501 O\n0.661999 0.661999 0.898007 O\n0.004546 0.004546 0.678832 O\n0.005765 0.005765 0.187137 O\n0.845805 0.318881 0.399196 O\n0.513664 0.966780 0.672118 O\n0.966780 0.513664 0.672118 O\n0.155590 0.155590 0.896693 O\n0.841632 0.841632 0.394582 O\n0.034996 0.478729 0.162703 O\n0.478729 0.034996 0.162703 O\n0.327931 0.327931 0.398665 O\n0.159742 0.689941 0.891944 O\n0.482048 0.482048 0.167033 O\n0.689941 0.159742 0.891944 O\n",
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{
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{
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"structure_string": "Li3 Ni4 O8\n1.0\n4.201567 3.956903 0.000000\n-4.201567 3.956903 0.000000\n0.000000 3.894638 4.045978\nLi Ni O\n3 4 8\ndirect\n0.500000 0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.500000 0.000000 0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.773136 0.226864 0.500000 O\n0.778456 0.778456 0.969352 O\n0.777247 0.222753 0.000000 O\n0.776914 0.776914 0.465424 O\n0.223086 0.223086 0.534576 O\n0.222753 0.777247 0.000000 O\n0.221544 0.221544 0.030648 O\n0.226864 0.773136 0.500000 O\n",
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{
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{
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"structure_string": "Zn2 Sn3 O8\n1.0\n3.108478 5.058955 0.000000\n-3.108478 5.058955 0.000000\n0.000000 1.026686 5.363628\nZn Sn O\n2 3 8\ndirect\n0.297667 0.297667 0.083533 Zn\n0.702333 0.702333 0.916467 Zn\n0.000000 0.000000 0.000000 Sn\n0.742784 0.257216 0.500000 Sn\n0.257216 0.742784 0.500000 Sn\n0.609557 0.609557 0.622793 O\n0.390443 0.390443 0.377207 O\n0.103973 0.103973 0.634390 O\n0.896027 0.896027 0.365610 O\n0.105119 0.646844 0.865207 O\n0.646844 0.105119 0.865207 O\n0.353156 0.894881 0.134793 O\n0.894881 0.353156 0.134793 O\n",
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{
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"structure_string": "Be4 Cu2\n1.0\n0.000000 2.994083 2.994083\n2.994083 0.000000 2.994083\n2.994083 2.994083 0.000000\nBe Cu\n4 2\ndirect\n0.125000 0.125000 0.125000 Be\n0.625000 0.125000 0.125000 Be\n0.125000 0.625000 0.125000 Be\n0.125000 0.125000 0.625000 Be\n0.500000 0.500000 0.500000 Cu\n0.750000 0.750000 0.750000 Cu\n",
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{
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"formula_full": "Li1 Fe8 O12",
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"updated_at": "2021-11-28T01:37:59.467000Z",
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},
{
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"formula_full": "Tc2 C10 I2 O10",
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},
{
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"created_at": "2022-09-04T14:47:09.202814Z",
"structure_string": "Li4 Bi2 As2 C2 O14\n1.0\n7.172602 0.000000 0.000000\n0.000000 5.139045 0.000000\n0.000000 0.048518 9.344002\nLi Bi As C O\n4 2 2 2 14\ndirect\n0.056957 0.213454 0.789928 Li\n0.443043 0.213454 0.789928 Li\n0.556957 0.786546 0.210072 Li\n0.943043 0.786546 0.210072 Li\n0.750000 0.778611 0.639952 Bi\n0.250000 0.221389 0.360048 Bi\n0.250000 0.727672 0.613236 As\n0.750000 0.272328 0.386764 As\n0.750000 0.743886 0.930979 C\n0.250000 0.256114 0.069021 C\n0.250000 0.261457 0.932692 O\n0.750000 0.967779 0.859820 O\n0.750000 0.532280 0.853361 O\n0.059410 0.879073 0.688021 O\n0.440590 0.879073 0.688021 O\n0.750000 0.227350 0.571899 O\n0.250000 0.399079 0.641472 O\n0.750000 0.600921 0.358528 O\n0.250000 0.772650 0.428101 O\n0.559410 0.120927 0.311979 O\n0.940590 0.120927 0.311979 O\n0.250000 0.467720 0.146639 O\n0.250000 0.032221 0.140180 O\n0.750000 0.738543 0.067308 O\n",
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"formula_full": "Li4 Bi2 As2 C2 O14",
"formula_reduced": "Li2BiAsCO7",
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}
]
}