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{
"id": "mp-1176442",
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"structure_string": "Na12 Fe6 P6 C6 O42\n1.0\n5.248347 0.000000 0.000000\n0.055796 8.954159 0.000000\n0.002887 0.018716 19.595433\nNa Fe P C O\n12 6 6 6 42\ndirect\n0.235428 0.915615 0.920078 Na\n0.236066 0.918953 0.586395 Na\n0.219632 0.904002 0.248818 Na\n0.749264 0.735898 0.504857 Na\n0.748523 0.735054 0.838327 Na\n0.254423 0.263127 0.164143 Na\n0.250306 0.265589 0.341121 Na\n0.253909 0.261083 0.999065 Na\n0.251246 0.264069 0.671468 Na\n0.763067 0.078737 0.419685 Na\n0.763885 0.080867 0.753037 Na\n0.754058 0.065186 0.082906 Na\n0.217128 0.654478 0.746248 Fe\n0.217262 0.654520 0.412538 Fe\n0.212009 0.660185 0.082568 Fe\n0.782533 0.346068 0.912677 Fe\n0.783067 0.345630 0.579792 Fe\n0.782056 0.352245 0.249120 Fe\n0.292532 0.577651 0.248765 P\n0.288983 0.575464 0.582393 P\n0.288708 0.575799 0.916568 P\n0.711140 0.424557 0.749110 P\n0.712832 0.425878 0.082139 P\n0.711817 0.424069 0.416542 P\n0.270768 0.933939 0.417982 C\n0.270465 0.934168 0.751175 C\n0.269911 0.939070 0.083085 C\n0.729526 0.065736 0.584587 C\n0.731025 0.065140 0.917381 C\n0.728511 0.069897 0.250405 C\n0.704665 0.925030 0.912602 O\n0.702988 0.925629 0.579383 O\n0.698217 0.931807 0.250599 O\n0.045287 0.870437 0.419824 O\n0.045088 0.870519 0.753053 O\n0.046705 0.875833 0.082918 O\n0.464711 0.840734 0.419981 O\n0.464717 0.841218 0.753389 O\n0.465278 0.850668 0.082954 O\n0.237160 0.677159 0.644955 O\n0.240776 0.674725 0.979811 O\n0.224307 0.675357 0.853582 O\n0.234467 0.672788 0.185381 O\n0.224137 0.674067 0.519297 O\n0.230769 0.675286 0.311722 O\n0.872576 0.567937 0.752228 O\n0.872631 0.567413 0.419308 O\n0.874473 0.566821 0.082597 O\n0.576095 0.530587 0.578978 O\n0.575353 0.529547 0.912264 O\n0.574807 0.526859 0.249965 O\n0.424150 0.469737 0.745752 O\n0.424800 0.468567 0.412403 O\n0.420353 0.462728 0.083173 O\n0.126455 0.432352 0.918331 O\n0.133808 0.430120 0.250045 O\n0.128050 0.431914 0.585491 O\n0.762795 0.322417 0.811543 O\n0.775781 0.325981 0.686066 O\n0.769669 0.323752 0.019277 O\n0.762623 0.322031 0.478955 O\n0.780385 0.324214 0.353940 O\n0.774437 0.322519 0.145003 O\n0.536283 0.157595 0.919150 O\n0.535258 0.158499 0.586922 O\n0.535430 0.167582 0.250512 O\n0.956091 0.128891 0.919638 O\n0.954934 0.129209 0.586598 O\n0.956206 0.134502 0.249910 O\n0.297685 0.073909 0.413549 O\n0.296995 0.074182 0.746172 O\n0.291686 0.083161 0.083089 O\n",
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{
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"created_at": "2022-09-04T14:39:27.240452Z",
"structure_string": "Ba4 W2 C8 O16\n1.0\n6.126342 -0.017034 0.571883\n0.502508 7.935270 3.868021\n-0.057801 -0.097240 9.816840\nBa W C O\n4 2 8 16\ndirect\n0.212124 0.142491 0.564943 Ba\n0.787876 0.857509 0.435057 Ba\n0.719438 0.471844 0.201242 Ba\n0.280562 0.528156 0.798758 Ba\n0.750631 0.047367 0.004407 W\n0.249369 0.952633 0.995593 W\n0.385909 0.216198 0.186393 C\n0.614091 0.783802 0.813607 C\n0.327037 0.680705 0.379009 C\n0.672963 0.319295 0.620991 C\n0.132734 0.224972 0.183532 C\n0.867266 0.775028 0.816468 C\n0.179657 0.581790 0.329774 C\n0.820343 0.418210 0.670226 C\n0.025915 0.145916 0.308211 O\n0.974085 0.854084 0.691789 O\n0.473436 0.133415 0.312319 O\n0.526564 0.866585 0.687681 O\n0.269978 0.457427 0.308482 O\n0.730022 0.542573 0.691518 O\n0.490329 0.301912 0.063113 O\n0.509671 0.698088 0.936887 O\n0.240358 0.744215 0.466471 O\n0.759642 0.255785 0.533529 O\n0.474001 0.312676 0.668599 O\n0.525999 0.687324 0.331401 O\n0.047088 0.319577 0.060739 O\n0.952912 0.680423 0.939261 O\n0.021876 0.372201 0.681614 O\n0.978124 0.627799 0.318386 O\n",
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{
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"structure_string": "Tl4 Fe2 C10 N12 O2\n1.0\n6.368570 6.737380 0.000000\n-6.368570 6.737380 0.000000\n0.000000 2.735573 6.290794\nTl Fe C N O\n4 2 10 12 2\ndirect\n0.031323 0.966911 0.998940 Tl\n0.966911 0.031323 0.498940 Tl\n0.749787 0.520328 0.469677 Tl\n0.520328 0.749787 0.969677 Tl\n0.552346 0.139460 0.206588 Fe\n0.139460 0.552346 0.706588 Fe\n0.617338 0.938505 0.328709 C\n0.744002 0.213595 0.201120 C\n0.375241 0.070971 0.160563 C\n0.213595 0.744002 0.701120 C\n0.070971 0.375241 0.660563 C\n0.529544 0.335904 0.023507 C\n0.651613 0.102591 0.938632 C\n0.938505 0.617338 0.828709 C\n0.335904 0.529544 0.523507 C\n0.102591 0.651613 0.438632 C\n0.037421 0.266923 0.626112 N\n0.266923 0.037421 0.126112 N\n0.705470 0.077896 0.774669 N\n0.255821 0.859581 0.706560 N\n0.162999 0.459519 0.943498 N\n0.666926 0.823415 0.403901 N\n0.859581 0.255821 0.206560 N\n0.523013 0.452800 0.900921 N\n0.452800 0.523013 0.400921 N\n0.077896 0.705470 0.274669 N\n0.459519 0.162999 0.443498 N\n0.823415 0.666926 0.903901 N\n0.396560 0.173796 0.609402 O\n0.173796 0.396560 0.109402 O\n",
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"density_atomic": 0.05557159032667866,
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{
"id": "mp-1205779",
"created_at": "2022-09-04T14:39:27.233457Z",
"structure_string": "Er3 Mg3 In3\n1.0\n3.769812 -6.529507 0.000000\n3.769812 6.529507 0.000000\n0.000000 0.000000 4.612717\nEr Mg In\n3 3 3\ndirect\n0.575623 0.000000 0.000000 Er\n0.000000 0.575623 0.000000 Er\n0.424377 0.424377 0.000000 Er\n0.245508 0.000000 0.500000 Mg\n0.000000 0.245508 0.500000 Mg\n0.754492 0.754492 0.500000 Mg\n0.333333 0.666667 0.500000 In\n0.666667 0.333333 0.500000 In\n0.000000 0.000000 0.000000 In\n",
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{
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"structure_string": "Li4 Nb4 P4 O20\n1.0\n6.688059 0.000000 0.000000\n0.000000 7.498768 0.000000\n0.000000 0.000000 7.622842\nLi Nb P O\n4 4 4 20\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.250000 0.721417 0.161482 Nb\n0.750000 0.221417 0.338518 Nb\n0.250000 0.778583 0.661482 Nb\n0.750000 0.278583 0.838518 Nb\n0.750000 0.632973 0.127781 P\n0.250000 0.132973 0.372219 P\n0.750000 0.867027 0.627781 P\n0.250000 0.367027 0.872219 P\n0.250000 0.480217 0.041479 O\n0.750000 0.162516 0.096676 O\n0.563888 0.755821 0.129622 O\n0.936112 0.755821 0.129622 O\n0.250000 0.008968 0.209061 O\n0.750000 0.508968 0.290939 O\n0.063888 0.255821 0.370378 O\n0.436112 0.255821 0.370378 O\n0.250000 0.662516 0.403324 O\n0.750000 0.980217 0.458521 O\n0.250000 0.019783 0.541479 O\n0.750000 0.337484 0.596676 O\n0.563888 0.744179 0.629622 O\n0.936112 0.744179 0.629622 O\n0.250000 0.491032 0.709061 O\n0.750000 0.991032 0.790939 O\n0.063888 0.244179 0.870378 O\n0.436112 0.244179 0.870378 O\n0.250000 0.837484 0.903324 O\n0.750000 0.519783 0.958521 O\n",
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{
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{
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{
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{
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{
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