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{
"id": "mp-768141",
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"structure_string": "Na4 Dy2 P2 C2 O14\n1.0\n7.010467 0.000000 0.000000\n0.000000 5.228624 0.000000\n0.000000 0.141128 9.274897\nNa Dy P C O\n4 2 2 2 14\ndirect\n0.498485 0.232017 0.790249 Na\n0.001515 0.232017 0.790249 Na\n0.501515 0.767983 0.209751 Na\n0.998485 0.767983 0.209751 Na\n0.750000 0.776168 0.630511 Dy\n0.250000 0.223832 0.369489 Dy\n0.250000 0.705733 0.582466 P\n0.750000 0.294267 0.417534 P\n0.750000 0.731559 0.927855 C\n0.250000 0.268441 0.072145 C\n0.250000 0.300056 0.937575 O\n0.750000 0.958227 0.863659 O\n0.750000 0.536411 0.837336 O\n0.068571 0.815220 0.653384 O\n0.431429 0.815220 0.653384 O\n0.750000 0.219602 0.583162 O\n0.250000 0.407112 0.591700 O\n0.750000 0.592888 0.408300 O\n0.250000 0.780398 0.416838 O\n0.568571 0.184780 0.346616 O\n0.931429 0.184780 0.346616 O\n0.250000 0.463589 0.162664 O\n0.250000 0.041773 0.136341 O\n0.750000 0.699944 0.062425 O\n",
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{
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"structure_string": "Li8 Mn4 C4 S4 O28\n1.0\n0.478098 -0.001084 4.929380\n9.377808 -0.002551 0.412536\n-0.003440 13.010328 -0.002539\nLi Mn C S O\n8 4 4 4 28\ndirect\n0.208528 0.164559 0.257433 Li\n0.208504 0.164516 0.757414 Li\n0.208554 0.164489 0.492586 Li\n0.208397 0.164536 0.992638 Li\n0.791520 0.835468 0.007446 Li\n0.791533 0.835550 0.507425 Li\n0.791463 0.835510 0.242656 Li\n0.791598 0.835388 0.742630 Li\n0.748122 0.362322 0.874728 Mn\n0.251456 0.637758 0.625009 Mn\n0.749161 0.362305 0.374949 Mn\n0.250846 0.637671 0.125067 Mn\n0.724234 0.076929 0.374941 C\n0.724134 0.076702 0.874918 C\n0.275931 0.923135 0.125115 C\n0.275906 0.923152 0.625111 C\n0.773251 0.400929 0.124922 S\n0.773385 0.400950 0.624916 S\n0.226731 0.599162 0.375040 S\n0.226500 0.598997 0.874989 S\n0.306996 0.056503 0.125056 O\n0.306992 0.056569 0.625072 O\n0.693087 0.943614 0.375049 O\n0.693134 0.943319 0.875044 O\n0.964861 0.118597 0.374905 O\n0.964608 0.118450 0.874884 O\n0.035340 0.881461 0.125114 O\n0.035397 0.881480 0.625108 O\n0.511701 0.179270 0.374913 O\n0.511371 0.178948 0.874866 O\n0.488504 0.820848 0.125135 O\n0.488542 0.820924 0.625098 O\n0.134761 0.455887 0.374948 O\n0.134275 0.455826 0.874925 O\n0.865534 0.544118 0.125068 O\n0.865552 0.544098 0.625051 O\n0.468056 0.423539 0.124982 O\n0.468206 0.423484 0.624945 O\n0.531920 0.576706 0.375099 O\n0.531770 0.576385 0.875091 O\n0.874145 0.315187 0.032763 O\n0.874393 0.315197 0.532738 O\n0.874509 0.315010 0.216937 O\n0.874659 0.314898 0.716893 O\n0.125364 0.685016 0.283047 O\n0.125611 0.684900 0.782993 O\n0.125460 0.684883 0.467197 O\n0.125495 0.684857 0.967146 O\n",
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"formula_full": "Li8 Mn4 C4 S4 O28",
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},
{
"id": "mp-755726",
"created_at": "2022-09-04T14:43:14.865113Z",
"structure_string": "Li4 Fe2 P2 C2 O14\n1.0\n5.110154 0.000000 0.000000\n-0.052389 6.374255 0.000000\n-0.466477 -0.780165 8.493080\nLi Fe P C O\n4 2 2 2 14\ndirect\n0.746327 0.079869 0.834442 Li\n0.834334 0.588129 0.731444 Li\n0.165666 0.411871 0.268556 Li\n0.253673 0.920131 0.165558 Li\n0.219774 0.273403 0.659815 Fe\n0.780226 0.726597 0.340185 Fe\n0.319850 0.753449 0.572245 P\n0.680150 0.246551 0.427755 P\n0.261478 0.255213 0.956221 C\n0.738522 0.744787 0.043779 C\n0.465586 0.277319 0.872336 O\n0.036997 0.281600 0.879226 O\n0.723426 0.793400 0.902517 O\n0.219811 0.586294 0.677309 O\n0.256234 0.971119 0.653346 O\n0.819929 0.279993 0.595666 O\n0.621174 0.729882 0.556096 O\n0.378826 0.270118 0.443904 O\n0.180071 0.720007 0.404334 O\n0.780189 0.413706 0.322691 O\n0.743766 0.028881 0.346654 O\n0.276574 0.206600 0.097483 O\n0.534414 0.722681 0.127664 O\n0.963003 0.718400 0.120774 O\n",
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"formula_full": "Li4 Fe2 P2 C2 O14",
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"spacegroup": 2
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{
"id": "mp-768089",
"created_at": "2022-09-04T14:43:15.132816Z",
"structure_string": "Na8 Ni4 P4 C4 O28\n1.0\n-6.638336 0.000000 0.000000\n0.090287 10.142022 0.000000\n-0.042164 -4.953568 -9.054060\nNa Ni P C O\n8 4 4 4 28\ndirect\n0.481736 0.264881 0.256023 Na\n0.015496 0.265329 0.255121 Na\n0.971669 0.740550 0.255942 Na\n0.736443 0.910695 0.067654 Na\n0.009070 0.251010 0.749510 Na\n0.491532 0.249233 0.747864 Na\n0.989770 0.738510 0.738268 Na\n0.513710 0.737230 0.734028 Na\n0.749003 0.351978 0.066223 Ni\n0.258635 0.651806 0.430842 Ni\n0.750445 0.350920 0.565841 Ni\n0.254994 0.650933 0.935916 Ni\n0.250387 0.424057 0.071929 P\n0.751242 0.581367 0.434588 P\n0.250488 0.422231 0.570337 P\n0.752473 0.578871 0.928053 P\n0.248437 0.926827 0.105675 C\n0.248456 0.926127 0.602620 C\n0.752576 0.076188 0.393768 C\n0.749438 0.070024 0.899205 C\n0.747130 0.135170 0.043717 O\n0.063207 0.325890 0.057788 O\n0.437783 0.330627 0.061371 O\n0.748380 0.432061 0.289041 O\n0.251285 0.457130 0.437469 O\n0.759401 0.542551 0.057767 O\n0.242341 0.573300 0.216901 O\n0.939999 0.675818 0.447197 O\n0.562884 0.676097 0.456909 O\n0.242330 0.829102 0.152067 O\n0.251646 0.826812 0.648585 O\n0.247944 0.868048 0.461038 O\n0.761807 0.938108 0.307208 O\n0.751987 0.927842 0.823964 O\n0.246170 0.066819 0.189193 O\n0.246822 0.064978 0.688973 O\n0.748660 0.136602 0.536711 O\n0.747273 0.174453 0.345691 O\n0.748857 0.160311 0.843925 O\n0.061956 0.326901 0.557046 O\n0.437416 0.328712 0.559253 O\n0.753483 0.426776 0.783584 O\n0.250049 0.457476 0.938809 O\n0.753510 0.545301 0.567748 O\n0.249755 0.573486 0.715632 O\n0.566798 0.673741 0.936649 O\n0.936430 0.679896 0.940889 O\n0.258852 0.866902 0.962339 O\n",
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"formula_full": "Na8 Ni4 P4 C4 O28",
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{
"id": "mp-773453",
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"structure_string": "K4 Fe2 P2 C2 O14\n1.0\n6.837335 0.000000 0.000000\n0.000000 5.580824 0.000000\n0.000000 0.230424 9.667915\nK Fe P C O\n4 2 2 2 14\ndirect\n0.479089 0.244782 0.757426 K\n0.020911 0.244782 0.757426 K\n0.520911 0.755218 0.242574 K\n0.979089 0.755218 0.242574 K\n0.750000 0.769413 0.640593 Fe\n0.250000 0.230587 0.359407 Fe\n0.250000 0.718659 0.567282 P\n0.750000 0.281341 0.432718 P\n0.750000 0.730644 0.901411 C\n0.250000 0.269356 0.098589 C\n0.250000 0.291688 0.970119 O\n0.750000 0.938052 0.832604 O\n0.750000 0.547683 0.816102 O\n0.063101 0.755544 0.654907 O\n0.436899 0.755544 0.654907 O\n0.750000 0.104306 0.560458 O\n0.250000 0.453449 0.514905 O\n0.750000 0.546551 0.485095 O\n0.250000 0.895694 0.439542 O\n0.563101 0.244456 0.345093 O\n0.936899 0.244456 0.345093 O\n0.250000 0.452317 0.183898 O\n0.250000 0.061948 0.167396 O\n0.750000 0.708312 0.029881 O\n",
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{
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"structure_string": "Ba2 Na2 Sc2 Si4 O14\n1.0\n5.691537 0.000000 0.000000\n0.000000 6.914137 0.000000\n0.000000 2.972450 8.420604\nBa Na Sc Si O\n2 2 2 4 14\ndirect\n0.250000 0.794317 0.533773 Ba\n0.750000 0.205683 0.466227 Ba\n0.750000 0.230600 0.998388 Na\n0.250000 0.769400 0.001612 Na\n0.750000 0.798448 0.265245 Sc\n0.250000 0.201552 0.734755 Sc\n0.750000 0.860179 0.843261 Si\n0.250000 0.139821 0.156739 Si\n0.750000 0.552742 0.680668 Si\n0.250000 0.447258 0.319332 Si\n0.750000 0.615007 0.847450 O\n0.250000 0.384993 0.152550 O\n0.991103 0.965728 0.748896 O\n0.491103 0.034272 0.251104 O\n0.008897 0.034272 0.251104 O\n0.508897 0.965728 0.748896 O\n0.750000 0.863496 0.024258 O\n0.250000 0.136504 0.975742 O\n0.750000 0.761771 0.523731 O\n0.250000 0.238229 0.476269 O\n0.513286 0.418877 0.686760 O\n0.013286 0.581123 0.313240 O\n0.486714 0.581123 0.313240 O\n0.986714 0.418877 0.686760 O\n",
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{
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"structure_string": "Na4 Fe2 B2 As2 O14\n1.0\n9.184511 0.000000 0.063041\n0.000000 6.860825 0.000000\n0.171241 0.000000 5.395942\nNa Fe B As O\n4 2 2 2 14\ndirect\n0.220416 0.996573 0.236094 Na\n0.220416 0.503427 0.236094 Na\n0.779584 0.496573 0.763906 Na\n0.779584 0.003427 0.763906 Na\n0.344117 0.750000 0.782191 Fe\n0.655883 0.250000 0.217809 Fe\n0.079243 0.750000 0.725807 B\n0.920757 0.250000 0.274193 B\n0.425677 0.250000 0.723879 As\n0.574323 0.750000 0.276121 As\n0.064768 0.250000 0.303601 O\n0.139913 0.750000 0.955886 O\n0.184869 0.750000 0.535000 O\n0.322819 0.049235 0.798712 O\n0.322819 0.450765 0.798712 O\n0.411045 0.750000 0.129087 O\n0.467700 0.250000 0.406168 O\n0.532300 0.750000 0.593832 O\n0.588955 0.250000 0.870913 O\n0.677181 0.549235 0.201288 O\n0.677181 0.950765 0.201288 O\n0.815131 0.250000 0.465000 O\n0.860087 0.250000 0.044114 O\n0.935232 0.750000 0.696399 O\n",
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{
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"structure_string": "Li8 Fe4 P4 C4 O28\n1.0\n6.504183 0.000000 0.000000\n0.105606 9.374184 0.000000\n0.064191 4.630356 8.995830\nLi Fe P C O\n8 4 4 4 28\ndirect\n0.253050 0.332266 0.570218 Li\n0.256464 0.833633 0.068616 Li\n0.033016 0.988396 0.734900 Li\n0.464153 0.488412 0.234811 Li\n0.968071 0.513443 0.762658 Li\n0.969999 0.012170 0.262164 Li\n0.734466 0.167205 0.927733 Li\n0.747501 0.666900 0.430492 Li\n0.745676 0.734498 0.936375 Fe\n0.754197 0.234502 0.435749 Fe\n0.259415 0.764824 0.564458 Fe\n0.261448 0.264906 0.064509 Fe\n0.246634 0.651327 0.928437 P\n0.244363 0.151394 0.428934 P\n0.759843 0.847929 0.571758 P\n0.752283 0.348000 0.071425 P\n0.759788 0.330583 0.629565 C\n0.755481 0.830725 0.130040 C\n0.228929 0.169808 0.871075 C\n0.252400 0.669781 0.370201 C\n0.760004 0.935355 0.988157 O\n0.740515 0.434987 0.488587 O\n0.216774 0.132638 0.765923 O\n0.756272 0.179753 0.655662 O\n0.275965 0.634021 0.264627 O\n0.726009 0.681849 0.155528 O\n0.065531 0.753400 0.943886 O\n0.439488 0.741913 0.937440 O\n0.061495 0.248548 0.447896 O\n0.435211 0.246422 0.435892 O\n0.772691 0.862087 0.717639 O\n0.236511 0.978301 0.561181 O\n0.721123 0.362267 0.216450 O\n0.256613 0.478561 0.060998 O\n0.781223 0.520199 0.940722 O\n0.226201 0.638311 0.782624 O\n0.782275 0.020037 0.439419 O\n0.232789 0.138029 0.282913 O\n0.563217 0.767057 0.554014 O\n0.935668 0.737328 0.564480 O\n0.937525 0.240713 0.075059 O\n0.565529 0.264059 0.042134 O\n0.226199 0.320289 0.845886 O\n0.781219 0.367731 0.734252 O\n0.226944 0.819293 0.345204 O\n0.779864 0.866315 0.235352 O\n0.257868 0.564729 0.511835 O\n0.248126 0.065107 0.012122 O\n",
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