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{
"id": "mp-1227338",
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{
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"structure_string": "K4 Li4 Zn4 P8 O28\n1.0\n0.000000 5.149560 0.000000\n-0.001942 0.000000 10.405118\n12.515298 0.000000 -0.194710\nK Li Zn P O\n4 4 4 8 28\ndirect\n0.997068 0.756646 0.005495 K\n0.002932 0.256646 0.005495 K\n0.501572 0.976546 0.505986 K\n0.498428 0.476546 0.505986 K\n0.974334 0.968838 0.249343 Li\n0.025666 0.468838 0.249343 Li\n0.950387 0.963161 0.749783 Li\n0.049613 0.463161 0.749783 Li\n0.456809 0.768720 0.749793 Zn\n0.543191 0.268720 0.749793 Zn\n0.471243 0.761077 0.249119 Zn\n0.528757 0.261077 0.249119 Zn\n0.506427 0.510457 0.114812 P\n0.493573 0.010457 0.114812 P\n0.988855 0.716279 0.384132 P\n0.011145 0.216279 0.384132 P\n0.561471 0.524247 0.879571 P\n0.438529 0.024247 0.879571 P\n0.955451 0.706734 0.618619 P\n0.044549 0.206734 0.618619 P\n0.056931 0.766668 0.506029 O\n0.943069 0.266668 0.506029 O\n0.134528 0.814151 0.313937 O\n0.865472 0.314151 0.313937 O\n0.418484 0.443712 0.792596 O\n0.581516 0.943712 0.792596 O\n0.353407 0.407582 0.177617 O\n0.646593 0.907582 0.177617 O\n0.025249 0.565917 0.622165 O\n0.974751 0.065917 0.622165 O\n0.660535 0.733753 0.620739 O\n0.339465 0.233753 0.620739 O\n0.086875 0.580267 0.370841 O\n0.913125 0.080267 0.370841 O\n0.092569 0.791122 0.704605 O\n0.907431 0.291122 0.704605 O\n0.446853 0.466914 0.991018 O\n0.553147 0.966914 0.991018 O\n0.470169 0.665679 0.878497 O\n0.529831 0.165679 0.878497 O\n0.378735 0.643521 0.130703 O\n0.621265 0.143521 0.130703 O\n0.692389 0.732422 0.373771 O\n0.307611 0.232422 0.373771 O\n0.795284 0.509418 0.133427 O\n0.204716 0.009418 0.133427 O\n0.852432 0.507168 0.877401 O\n0.147568 0.007168 0.877401 O\n",
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"formula_full": "K4 Li4 Zn4 P8 O28",
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"spacegroup": 7
},
{
"id": "mp-1034847",
"created_at": "2022-09-04T14:43:56.485782Z",
"structure_string": "Mg14 Ni1 Sn1 O16\n1.0\n8.657325 0.000000 0.000000\n0.000000 8.657325 0.000000\n0.000000 0.000000 4.351457\nMg Ni Sn O\n14 1 1 16\ndirect\n0.000000 0.500000 -0.000000 Mg\n0.500000 0.000000 -0.000000 Mg\n0.000000 0.245623 0.500000 Mg\n0.000000 0.754377 0.500000 Mg\n0.500000 0.238864 0.500000 Mg\n0.500000 0.761136 0.500000 Mg\n0.245623 0.000000 0.500000 Mg\n0.238864 0.500000 0.500000 Mg\n0.754377 0.000000 0.500000 Mg\n0.761136 0.500000 0.500000 Mg\n0.243131 0.243131 0.000000 Mg\n0.243131 0.756869 0.000000 Mg\n0.756869 0.243131 -0.000000 Mg\n0.756869 0.756869 -0.000000 Mg\n0.000000 0.000000 -0.000000 Ni\n0.500000 0.500000 -0.000000 Sn\n0.251931 0.000000 0.000000 O\n0.232394 0.500000 -0.000000 O\n0.748069 0.000000 -0.000000 O\n0.767606 0.500000 -0.000000 O\n0.250506 0.250506 0.500000 O\n0.250506 0.749494 0.500000 O\n0.749494 0.250506 0.500000 O\n0.749494 0.749494 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.251931 0.000000 O\n0.000000 0.748069 -0.000000 O\n0.500000 0.232394 -0.000000 O\n0.500000 0.767606 -0.000000 O\n",
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"formula_full": "Mg14 Ni1 Sn1 O16",
"formula_reduced": "Mg14NiSnO16",
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{
"id": "mp-768153",
"created_at": "2022-09-04T14:42:15.685801Z",
"structure_string": "Li4 As2 P2 C2 O14\n1.0\n6.541741 0.000000 0.000000\n0.000000 5.097453 0.000000\n0.000000 0.612735 8.922373\nLi As P C O\n4 2 2 2 14\ndirect\n0.457856 0.240376 0.768448 Li\n0.042144 0.240376 0.768448 Li\n0.542144 0.759624 0.231552 Li\n0.957856 0.759624 0.231552 Li\n0.750000 0.820402 0.646911 As\n0.250000 0.179598 0.353089 As\n0.250000 0.746021 0.604435 P\n0.750000 0.253979 0.395565 P\n0.750000 0.724568 0.930322 C\n0.250000 0.275432 0.069678 C\n0.250000 0.257779 0.930830 O\n0.750000 0.953084 0.839057 O\n0.750000 0.514066 0.858583 O\n0.062972 0.884575 0.671775 O\n0.437028 0.884575 0.671775 O\n0.750000 0.189873 0.573168 O\n0.250000 0.449046 0.634542 O\n0.750000 0.550954 0.365458 O\n0.250000 0.810127 0.426832 O\n0.562972 0.115425 0.328225 O\n0.937028 0.115425 0.328225 O\n0.250000 0.485934 0.141417 O\n0.250000 0.046916 0.160943 O\n0.750000 0.742221 0.069170 O\n",
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"elements": [
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{
"id": "mp-1210133",
"created_at": "2022-09-04T14:42:56.636709Z",
"structure_string": "Na4 Ga4 P8 O28\n1.0\n7.923065 0.000000 0.000000\n0.000000 7.374088 0.000000\n0.000000 3.610737 8.867380\nNa Ga P O\n4 4 8 28\ndirect\n0.525008 0.710394 0.297148 Na\n0.474992 0.289606 0.702852 Na\n0.025008 0.289606 0.202852 Na\n0.974992 0.710394 0.797148 Na\n0.993199 0.741928 0.249149 Ga\n0.006801 0.258072 0.750851 Ga\n0.493199 0.258072 0.250851 Ga\n0.506801 0.741928 0.749149 Ga\n0.289526 0.671966 0.046341 P\n0.710474 0.328034 0.953659 P\n0.789526 0.328034 0.453659 P\n0.210474 0.671966 0.546341 P\n0.745698 0.925917 0.455526 P\n0.254302 0.074083 0.544474 P\n0.245698 0.074083 0.044474 P\n0.754302 0.925917 0.955526 P\n0.347821 0.876591 0.059933 O\n0.652179 0.123409 0.940067 O\n0.847821 0.123409 0.440067 O\n0.152179 0.876591 0.559933 O\n0.915831 0.469808 0.348709 O\n0.084169 0.530192 0.651291 O\n0.415831 0.530192 0.151291 O\n0.584169 0.469808 0.848709 O\n0.605637 0.364155 0.396891 O\n0.394363 0.635845 0.603109 O\n0.105637 0.635845 0.103109 O\n0.894363 0.364155 0.896891 O\n0.866540 0.815426 0.394180 O\n0.133460 0.184574 0.605820 O\n0.366540 0.184574 0.105820 O\n0.633460 0.815426 0.894180 O\n0.786932 0.808939 0.122694 O\n0.213068 0.191061 0.877306 O\n0.286932 0.191061 0.377306 O\n0.713068 0.808939 0.622694 O\n0.583565 0.989147 0.360988 O\n0.416435 0.010853 0.639012 O\n0.083565 0.010853 0.139012 O\n0.916435 0.989147 0.860988 O\n0.702730 0.306850 0.118737 O\n0.297270 0.693150 0.881263 O\n0.202730 0.693150 0.381263 O\n0.797270 0.306850 0.618737 O\n",
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"formula_full": "Na4 Ga4 P8 O28",
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{
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"structure_string": "Zn2 H4 S2 O10\n1.0\n3.888532 3.451218 0.000000\n-3.888532 3.451218 0.000000\n0.000000 3.261616 6.888994\nZn H S O\n2 4 2 10\ndirect\n0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.000000 Zn\n0.629460 0.545964 0.795956 H\n0.454036 0.370540 0.704044 H\n0.370540 0.454036 0.204044 H\n0.545964 0.629460 0.295956 H\n0.094411 0.905589 0.750000 S\n0.905589 0.094411 0.250000 S\n0.226406 0.817638 0.899084 O\n0.182362 0.773594 0.600916 O\n0.773594 0.182362 0.100916 O\n0.817638 0.226406 0.399084 O\n0.178025 0.212468 0.658381 O\n0.787532 0.821975 0.841619 O\n0.821975 0.787532 0.341619 O\n0.212468 0.178025 0.158381 O\n0.615797 0.384203 0.750000 O\n0.384203 0.615797 0.250000 O\n",
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{
"id": "mp-772765",
"created_at": "2022-09-04T14:41:27.515358Z",
"structure_string": "K4 Pr2 P2 C2 O14\n1.0\n7.395958 0.000000 0.000000\n0.000000 5.824771 0.000000\n0.000000 0.539468 10.021237\nK Pr P C O\n4 2 2 2 14\ndirect\n0.009496 0.241577 0.780936 K\n0.490504 0.241577 0.780936 K\n0.509496 0.758423 0.219064 K\n0.990504 0.758423 0.219064 K\n0.750000 0.775621 0.629099 Pr\n0.250000 0.224379 0.370901 Pr\n0.250000 0.709444 0.575276 P\n0.750000 0.290556 0.424724 P\n0.750000 0.730533 0.917063 C\n0.250000 0.269467 0.082937 C\n0.250000 0.297395 0.958015 O\n0.750000 0.934824 0.853871 O\n0.750000 0.553930 0.837957 O\n0.075949 0.782926 0.648172 O\n0.424051 0.782926 0.648172 O\n0.750000 0.176851 0.571040 O\n0.250000 0.441810 0.565078 O\n0.750000 0.558190 0.434922 O\n0.250000 0.823149 0.428960 O\n0.575949 0.217074 0.351828 O\n0.924051 0.217074 0.351828 O\n0.250000 0.446070 0.162043 O\n0.250000 0.065176 0.146129 O\n0.750000 0.702605 0.041985 O\n",
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{
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"structure_string": "Li16 U4 F32\n1.0\n5.893483 0.000000 0.000000\n0.000000 9.964803 0.000000\n0.000000 0.000000 10.127885\nLi U F\n16 4 32\ndirect\n0.129532 0.100539 0.579628 Li\n0.629532 0.399461 0.420372 Li\n0.870468 0.899461 0.079628 Li\n0.370468 0.600539 0.920372 Li\n0.129532 0.100539 0.920372 Li\n0.629532 0.399461 0.079628 Li\n0.621224 0.127939 0.554014 Li\n0.121224 0.372061 0.445986 Li\n0.378776 0.872061 0.054014 Li\n0.878776 0.627939 0.945986 Li\n0.378776 0.872061 0.445986 Li\n0.878776 0.627939 0.554014 Li\n0.621224 0.127939 0.945986 Li\n0.121224 0.372061 0.054014 Li\n0.870468 0.899461 0.420372 Li\n0.370468 0.600539 0.579628 Li\n0.131163 0.637123 0.250000 U\n0.631163 0.862877 0.750000 U\n0.868837 0.362877 0.750000 U\n0.368837 0.137123 0.250000 U\n0.889595 0.518175 0.384117 F\n0.889595 0.518175 0.115883 F\n0.610405 0.018175 0.384117 F\n0.110405 0.481825 0.615883 F\n0.374200 0.238020 0.031484 F\n0.874200 0.261980 0.968516 F\n0.625800 0.761980 0.531484 F\n0.389595 0.981825 0.884117 F\n0.625800 0.761980 0.968516 F\n0.125800 0.738020 0.031484 F\n0.374200 0.238020 0.468516 F\n0.874200 0.261980 0.531484 F\n0.121867 0.302265 0.250000 F\n0.621867 0.197735 0.750000 F\n0.878133 0.697735 0.750000 F\n0.378133 0.802265 0.250000 F\n0.624561 0.297978 0.250000 F\n0.124561 0.202022 0.750000 F\n0.375439 0.702022 0.750000 F\n0.875439 0.797978 0.250000 F\n0.110405 0.481825 0.884117 F\n0.610405 0.018175 0.115883 F\n0.637807 0.483930 0.610651 F\n0.137807 0.016070 0.389349 F\n0.362193 0.516070 0.110651 F\n0.862193 0.983930 0.889349 F\n0.362193 0.516070 0.389349 F\n0.862193 0.983930 0.610651 F\n0.637807 0.483930 0.889349 F\n0.137807 0.016070 0.110651 F\n0.125800 0.738020 0.468516 F\n0.389595 0.981825 0.615883 F\n",
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{
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{
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{
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}