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{
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{
"id": "mp-556356",
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"structure_string": "Na4 Sr2 Al8 Si8 O32\n1.0\n-4.278267 4.983988 8.463048\n4.278267 -4.983988 8.463048\n4.278267 4.983988 -8.463048\nNa Sr Al Si O\n4 2 8 8 32\ndirect\n0.580406 0.362772 0.133860 Na\n0.728912 0.862772 0.782366 Na\n0.080406 0.946546 0.217634 Na\n0.228912 0.446546 0.866140 Na\n0.654031 0.654031 0.000000 Sr\n0.154031 0.154031 0.000000 Sr\n0.372402 0.994090 0.239703 Al\n0.760459 0.088041 0.227240 Al\n0.254387 0.494090 0.621688 Al\n0.360801 0.588041 0.327582 Al\n0.260459 0.033219 0.672418 Al\n0.860801 0.533219 0.772760 Al\n0.754387 0.132699 0.760297 Al\n0.872402 0.632699 0.378312 Al\n0.553057 0.761854 0.318362 Si\n0.053057 0.734695 0.791203 Si\n0.943492 0.261854 0.208797 Si\n0.443492 0.234695 0.681638 Si\n0.444636 0.821562 0.774696 Si\n0.046866 0.669940 0.225304 Si\n0.546866 0.321562 0.376926 Si\n0.944636 0.169940 0.623074 Si\n0.418588 0.393479 0.268225 O\n0.125254 0.150363 0.731775 O\n0.416928 0.623467 0.224742 O\n0.342157 0.972162 0.816641 O\n0.625254 0.893479 0.974891 O\n0.842157 0.025516 0.369995 O\n0.458297 0.757933 0.594749 O\n0.940842 0.655556 0.280298 O\n0.875258 0.155556 0.714714 O\n0.375258 0.660544 0.719702 O\n0.163184 0.863548 0.405251 O\n0.389018 0.416699 0.740505 O\n0.898725 0.123467 0.206539 O\n0.351946 0.074267 0.433559 O\n0.633007 0.282766 0.801740 O\n0.889018 0.148513 0.972319 O\n0.655521 0.472162 0.630005 O\n0.676194 0.648513 0.259495 O\n0.981026 0.782766 0.649759 O\n0.663184 0.257933 0.299636 O\n0.958297 0.363548 0.700364 O\n0.851946 0.418387 0.277679 O\n0.140708 0.574267 0.722321 O\n0.918588 0.650363 0.025109 O\n0.440842 0.160544 0.285286 O\n0.155521 0.525516 0.183359 O\n0.176194 0.916699 0.027681 O\n0.916928 0.692186 0.793461 O\n0.398725 0.192186 0.775258 O\n0.640708 0.918387 0.566441 O\n0.133007 0.331267 0.350241 O\n0.481026 0.831267 0.198260 O\n",
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"formula_full": "Na4 Sr2 Al8 Si8 O32",
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"spacegroup": 45
},
{
"id": "mp-1233090",
"created_at": "2022-09-04T14:45:16.409448Z",
"structure_string": "Ca1 Mn4 Ag4 O16\n1.0\n5.596707 -0.276372 0.034731\n-0.607614 8.008648 0.196465\n0.060313 0.232785 8.608695\nCa Mn Ag O\n1 4 4 16\ndirect\n0.700876 0.455708 0.185951 Ca\n0.774218 0.103356 0.297427 Mn\n0.266230 0.642779 0.206853 Mn\n0.733323 0.367494 0.791213 Mn\n0.227790 0.879997 0.698486 Mn\n0.279721 0.102646 0.047559 Ag\n0.704202 0.699190 0.517143 Ag\n0.244064 0.320720 0.509790 Ag\n0.715506 0.878631 0.953157 Ag\n0.909684 0.037728 0.138358 O\n0.515522 0.186136 0.241051 O\n0.260760 0.037471 0.572423 O\n0.280940 0.494438 0.083645 O\n0.763706 0.516173 0.916766 O\n0.491758 0.821776 0.743397 O\n0.742301 0.971765 0.450059 O\n0.061816 0.720883 0.628983 O\n0.581680 0.198144 0.876578 O\n0.093601 0.935818 0.857566 O\n0.422118 0.821431 0.131940 O\n0.993542 0.322963 0.734499 O\n0.987262 0.672689 0.255487 O\n0.585058 0.430697 0.638311 O\n0.938293 0.290234 0.340798 O\n0.423948 0.572613 0.362247 O\n",
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"formula_full": "Ca1 Mn4 Ag4 O16",
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{
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"created_at": "2022-09-04T14:45:16.514830Z",
"structure_string": "K2 Li1 Sc1 F6\n1.0\n0.000000 4.144804 4.144804\n4.144804 0.000000 4.144804\n4.144804 4.144804 0.000000\nK Li Sc F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Sc\n0.245587 0.245587 0.754413 F\n0.245587 0.754413 0.754413 F\n0.754413 0.754413 0.245587 F\n0.245587 0.754413 0.245587 F\n0.754413 0.245587 0.754413 F\n0.754413 0.245587 0.245587 F\n",
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"spacegroup": 225
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{
"id": "mp-1232253",
"created_at": "2022-09-04T14:45:16.412716Z",
"structure_string": "Ce6 Mg6 S18\n1.0\n6.845610 0.000000 0.000000\n-3.422805 5.928472 0.000000\n0.000000 0.000000 17.554691\nCe Mg S\n6 6 18\ndirect\n0.000000 0.000000 0.353852 Ce\n0.000000 0.000000 0.646148 Ce\n0.666667 0.333333 0.687185 Ce\n0.666667 0.333333 0.979481 Ce\n0.333333 0.666667 0.020519 Ce\n0.333333 0.666667 0.312815 Ce\n0.000000 0.000000 0.154026 Mg\n0.000000 0.000000 0.845974 Mg\n0.666667 0.333333 0.487359 Mg\n0.666667 0.333333 0.179307 Mg\n0.333333 0.666667 0.820693 Mg\n0.333333 0.666667 0.512641 Mg\n0.975687 0.350082 0.583279 S\n0.024313 0.649918 0.416721 S\n0.649918 0.625605 0.583279 S\n0.350082 0.374395 0.416721 S\n0.374395 0.024313 0.583279 S\n0.625605 0.975687 0.416721 S\n0.642354 0.683415 0.916612 S\n0.690980 0.983251 0.750054 S\n0.316585 0.958938 0.916612 S\n0.016749 0.707728 0.750054 S\n0.041062 0.357646 0.916612 S\n0.292272 0.309020 0.750054 S\n0.309020 0.016749 0.249946 S\n0.357646 0.316585 0.083388 S\n0.983251 0.292272 0.249946 S\n0.683415 0.041062 0.083388 S\n0.707728 0.690980 0.249946 S\n0.958938 0.642354 0.083388 S\n",
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"volume": 712.4397060768083,
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"formula_full": "Ce6 Mg6 S18",
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{
"id": "mp-1093818",
"created_at": "2022-09-04T14:45:16.423123Z",
"structure_string": "Li1 Cd2 Ir1\n1.0\n-5.439470 5.741305 8.115416\n5.439470 -5.741305 8.115416\n5.439470 5.741305 -8.115416\nLi Cd Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.252124 0.252124 Cd\n0.000000 0.747876 0.747876 Cd\n0.000000 0.500000 0.500000 Ir\n",
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"formula_full": "Li1 Cd2 Ir1",
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{
"id": "mp-758185",
"created_at": "2022-09-04T14:45:16.429405Z",
"structure_string": "Li12 V8 O16 F8\n1.0\n2.983928 5.197835 0.000000\n-2.983928 5.197835 0.000000\n0.000000 0.103190 14.880709\nLi V O F\n12 8 16 8\ndirect\n0.302305 0.876405 0.830188 Li\n0.332372 0.839664 0.332806 Li\n0.496670 0.496670 0.953891 Li\n0.876405 0.302305 0.830188 Li\n0.839664 0.332372 0.332806 Li\n0.666947 0.666947 0.690479 Li\n0.837711 0.837711 0.840099 Li\n0.833461 0.833461 0.334081 Li\n0.023261 0.492904 0.962897 Li\n0.492904 0.023261 0.962897 Li\n0.167450 0.635519 0.711047 Li\n0.635519 0.167450 0.711047 Li\n0.495867 0.495867 0.495120 V\n0.002663 0.002663 0.508885 V\n0.666694 0.666694 0.163510 V\n0.002173 0.497406 0.497467 V\n0.170500 0.170500 0.166779 V\n0.497406 0.002173 0.497467 V\n0.166974 0.668302 0.169005 V\n0.668302 0.166974 0.169005 V\n0.342220 0.834809 0.101193 O\n0.334721 0.818905 0.565298 O\n0.504502 0.504502 0.239331 O\n0.818905 0.334721 0.565298 O\n0.834809 0.342220 0.101193 O\n0.010739 0.010739 0.243569 O\n0.666002 0.666002 0.422246 O\n0.833636 0.833636 0.103599 O\n0.832832 0.832832 0.565216 O\n0.985340 0.505977 0.240830 O\n0.157694 0.157694 0.427736 O\n0.336550 0.336550 0.564534 O\n0.323082 0.323082 0.100186 O\n0.505977 0.985340 0.240830 O\n0.166565 0.683133 0.427135 O\n0.683133 0.166565 0.427135 O\n0.505580 0.505580 0.742684 F\n0.985914 0.985914 0.753447 F\n0.672548 0.672548 0.923918 F\n0.967261 0.515928 0.756173 F\n0.166251 0.166251 0.915568 F\n0.515928 0.967261 0.756173 F\n0.167548 0.673705 0.911854 F\n0.673705 0.167548 0.911854 F\n",
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{
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"structure_string": "Rb2 Al1 Tl1 F6\n1.0\n0.000000 4.528080 4.528080\n4.528080 0.000000 4.528080\n4.528080 4.528080 0.000000\nRb Al Tl F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Tl\n0.203558 0.203558 0.796442 F\n0.203558 0.796442 0.796442 F\n0.796442 0.796442 0.203558 F\n0.203558 0.796442 0.203558 F\n0.796442 0.203558 0.796442 F\n0.796442 0.203558 0.203558 F\n",
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{
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{
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{
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{
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