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{
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"formula_full": "Cs4 Na2 Co2 C12 N12",
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{
"id": "mp-698797",
"created_at": "2022-09-04T14:45:22.229423Z",
"structure_string": "Sr3 La9 Mn10 Cu2 O36\n1.0\n2.781697 4.745547 0.000000\n-2.781697 4.745547 0.000000\n0.000000 0.305044 27.222163\nSr La Mn Cu O\n3 9 10 2 36\ndirect\n0.665550 0.001211 0.834929 Sr\n0.333426 0.666574 0.000000 Sr\n0.998789 0.334450 0.165071 Sr\n0.999582 0.332946 0.917733 La\n0.668716 0.998694 0.332478 La\n0.667054 0.000418 0.082267 La\n0.333357 0.666643 0.500000 La\n0.333797 0.666649 0.248804 La\n0.001306 0.331284 0.667522 La\n0.000624 0.333502 0.414278 La\n0.666498 0.999376 0.585722 La\n0.333351 0.666203 0.751196 La\n0.000849 0.332650 0.792604 Mn\n0.667247 0.999634 0.958334 Mn\n0.332822 0.667221 0.124719 Mn\n0.332779 0.667178 0.875281 Mn\n0.000366 0.332753 0.041666 Mn\n0.668881 0.998296 0.458187 Mn\n0.667350 0.999151 0.207396 Mn\n0.001704 0.331119 0.541813 Mn\n0.996329 0.336887 0.291130 Mn\n0.663113 0.003671 0.708870 Mn\n0.334092 0.666163 0.374947 Cu\n0.333837 0.665908 0.625053 Cu\n0.146431 0.038644 0.842576 O\n0.555680 0.778591 0.916732 O\n0.026112 0.820096 0.923558 O\n0.631083 0.519080 0.823758 O\n0.815561 0.702869 0.009091 O\n0.124755 0.544308 0.832428 O\n0.221409 0.444320 0.083268 O\n0.513292 0.305770 0.910150 O\n0.694230 0.486708 0.089850 O\n0.297131 0.184438 0.990909 O\n0.480920 0.368917 0.176242 O\n0.792542 0.207458 0.000000 O\n0.889676 0.105466 0.251613 O\n0.179904 0.973888 0.076442 O\n0.370621 0.149886 0.259878 O\n0.961356 0.853569 0.157424 O\n0.140515 0.050081 0.341734 O\n0.455692 0.875245 0.167572 O\n0.569054 0.770862 0.419046 O\n0.848676 0.636963 0.242425 O\n0.034194 0.819046 0.428917 O\n0.632340 0.511932 0.321424 O\n0.811067 0.710921 0.511417 O\n0.099240 0.557334 0.332164 O\n0.229138 0.430946 0.580954 O\n0.529911 0.279894 0.407472 O\n0.720106 0.470089 0.592528 O\n0.289079 0.188933 0.488583 O\n0.488068 0.367660 0.678576 O\n0.769613 0.230387 0.500000 O\n0.894534 0.110324 0.748387 O\n0.180954 0.965806 0.571083 O\n0.363037 0.151324 0.757575 O\n0.949919 0.859485 0.658266 O\n0.442666 0.900760 0.667836 O\n0.850114 0.629379 0.740122 O\n",
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"formula_full": "Sr3 La9 Mn10 Cu2 O36",
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},
{
"id": "mp-1518655",
"created_at": "2022-09-04T14:45:29.655022Z",
"structure_string": "Sr1 Eu1 Cr1 In1 O6\n1.0\n-0.000000 -4.019139 -4.019139\n4.019139 0.000000 -4.019139\n4.019139 -4.019139 -0.000000\nSr Eu Cr In O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Eu\n0.000000 -0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 In\n0.762378 0.237622 0.237622 O\n0.237622 0.762378 0.762378 O\n0.762378 0.237622 0.762378 O\n0.237622 0.762378 0.237622 O\n0.762378 0.762378 0.237622 O\n0.237622 0.237622 0.762378 O\n",
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"formula_full": "Sr1 Eu1 Cr1 In1 O6",
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{
"id": "mp-760793",
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"structure_string": "Li10 Cr3 P6 O24 F6\n1.0\n5.083088 -8.804166 0.000000\n5.083088 8.804166 0.000000\n0.000000 0.000000 6.507819\nLi Cr P O F\n10 3 6 24 6\ndirect\n0.666667 0.333333 0.581118 Li\n0.873975 0.706481 0.475609 Li\n0.832505 0.126025 0.475609 Li\n0.000000 0.000000 0.286769 Li\n0.293519 0.167495 0.475609 Li\n0.967939 0.507470 0.745539 Li\n0.492530 0.460468 0.745539 Li\n0.333333 0.666667 0.834358 Li\n0.333333 0.666667 0.359518 Li\n0.539532 0.032061 0.745539 Li\n0.837857 0.667128 0.001742 Cr\n0.829271 0.162143 0.001742 Cr\n0.332872 0.170729 0.001742 Cr\n0.708057 0.841981 0.739069 P\n0.158019 0.866075 0.739069 P\n0.133925 0.291943 0.739069 P\n0.956877 0.479315 0.264749 P\n0.520685 0.477562 0.264749 P\n0.522438 0.043123 0.264749 P\n0.694764 0.594244 0.228056 O\n0.787612 0.813343 0.927121 O\n0.791628 0.845016 0.542144 O\n0.993859 0.726652 0.774048 O\n0.732793 0.006141 0.774048 O\n0.154984 0.946612 0.542144 O\n0.186657 0.974269 0.927121 O\n0.025731 0.212388 0.927121 O\n0.899479 0.305236 0.228056 O\n0.053388 0.208372 0.542144 O\n0.879570 0.495510 0.457097 O\n0.904570 0.527253 0.065234 O\n0.405756 0.100521 0.228056 O\n0.273348 0.267207 0.774048 O\n0.183683 0.461728 0.738888 O\n0.472747 0.377318 0.065234 O\n0.504490 0.384060 0.457097 O\n0.278045 0.816317 0.738888 O\n0.538272 0.721955 0.738888 O\n0.615940 0.120430 0.457097 O\n0.622682 0.095430 0.065234 O\n0.129134 0.567211 0.274511 O\n0.432789 0.561922 0.274511 O\n0.438078 0.870866 0.274511 O\n0.704441 0.528138 0.792409 F\n0.967204 0.802168 0.209832 F\n0.834964 0.032796 0.209832 F\n0.823697 0.295559 0.792409 F\n0.197832 0.165036 0.209832 F\n0.471862 0.176303 0.792409 F\n",
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"formula_full": "Li10 Cr3 P6 O24 F6",
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{
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"structure_string": "Ca4 La4 Mn4 Nb4 O24\n1.0\n0.000004 5.824630 -0.000012\n-5.631484 -0.000020 8.057840\n5.637415 -0.000013 8.082270\nCa La Mn Nb O\n4 4 4 4 24\ndirect\n0.552620 0.880203 0.367920 Ca\n0.552608 0.380191 0.867916 Ca\n0.947380 0.880195 0.867912 Ca\n0.947383 0.380197 0.367927 Ca\n0.448708 0.120576 0.632096 La\n0.448708 0.620582 0.132091 La\n0.051284 0.120577 0.132095 La\n0.051292 0.620576 0.632093 La\n0.502478 0.749273 0.750418 Mn\n0.997514 0.749272 0.250419 Mn\n0.502448 0.249281 0.250420 Mn\n0.997545 0.249275 0.750425 Mn\n0.502908 0.000604 0.001001 Nb\n0.502905 0.500603 0.500999 Nb\n0.997088 0.000603 0.501000 Nb\n0.997088 0.500601 0.001002 Nb\n0.808396 0.120193 0.329564 O\n0.808399 0.620197 0.829564 O\n0.691596 0.120196 0.829561 O\n0.691596 0.620194 0.329561 O\n0.187398 0.879514 0.670568 O\n0.187396 0.379514 0.170568 O\n0.312603 0.879514 0.170569 O\n0.312600 0.379513 0.670570 O\n0.285787 0.063134 0.378643 O\n0.285785 0.563134 0.878641 O\n0.214216 0.063135 0.878641 O\n0.214208 0.563134 0.378639 O\n0.710099 0.934847 0.621816 O\n0.710100 0.434845 0.121819 O\n0.789997 0.934873 0.121780 O\n0.789895 0.434848 0.621816 O\n0.958496 0.829821 0.430799 O\n0.958497 0.329822 0.930797 O\n0.541495 0.329820 0.430803 O\n0.541497 0.829821 0.930799 O\n0.037024 0.171829 0.567190 O\n0.037023 0.671830 0.067189 O\n0.462972 0.671834 0.567183 O\n0.462968 0.171830 0.067186 O\n",
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{
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"structure_string": "Ca1 Nd1 Hf1 Cr1 O6\n1.0\n-0.000000 -3.990405 -3.990405\n3.990405 -0.000000 -3.990405\n3.990405 -3.990405 0.000000\nCa Nd Hf Cr O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ca\n0.250000 0.250000 0.250000 Nd\n0.500000 0.500000 0.500000 Hf\n0.000000 -0.000000 0.000000 Cr\n0.754369 0.245631 0.245631 O\n0.245631 0.754369 0.754369 O\n0.754369 0.245631 0.754369 O\n0.245631 0.754369 0.245631 O\n0.754369 0.754369 0.245631 O\n0.245631 0.245631 0.754369 O\n",
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"formula_full": "Ca1 Nd1 Hf1 Cr1 O6",
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{
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"structure_string": "Sr2 Mg2 Cr2 P4 O16\n1.0\n5.659491 0.000000 0.000000\n-1.026370 6.770428 0.000000\n-1.985987 -3.497431 8.468462\nSr Mg Cr P O\n2 2 2 4 16\ndirect\n0.202562 0.747893 0.054569 Sr\n0.797438 0.252107 0.945431 Sr\n0.344293 0.743563 0.648435 Mg\n0.655707 0.256437 0.351565 Mg\n0.092506 0.295095 0.548462 Cr\n0.907494 0.704905 0.451538 Cr\n0.155635 0.188257 0.235185 P\n0.844365 0.811743 0.764815 P\n0.539444 0.724562 0.298256 P\n0.460556 0.275438 0.701744 P\n0.930579 0.665286 0.889962 O\n0.440537 0.264944 0.212764 O\n0.901364 0.042132 0.760165 O\n0.265455 0.420092 0.687791 O\n0.559463 0.735056 0.787236 O\n0.450312 0.155169 0.585728 O\n0.549688 0.844831 0.414272 O\n0.388922 0.129368 0.872776 O\n0.098636 0.957868 0.239835 O\n0.611078 0.870632 0.127224 O\n0.069421 0.334714 0.110038 O\n0.971596 0.188830 0.395242 O\n0.028404 0.811170 0.604758 O\n0.268156 0.575731 0.353199 O\n0.734545 0.579908 0.312209 O\n0.731844 0.424269 0.646801 O\n",
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{
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"structure_string": "Cs2 Cu1 Pb1 N6 O12\n1.0\n0.000000 5.557889 5.557889\n5.557889 0.000000 5.557889\n5.557889 5.557889 0.000000\nCs Cu Pb N O\n2 1 1 6 12\ndirect\n0.250000 0.250000 0.250000 Cs\n0.750000 0.750000 0.750000 Cs\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Pb\n0.805525 0.194475 0.194475 N\n0.194475 0.805525 0.805525 N\n0.194475 0.194475 0.805525 N\n0.805525 0.805525 0.194475 N\n0.194475 0.805525 0.194475 N\n0.805525 0.194475 0.805525 N\n0.842689 0.157311 0.349563 O\n0.157311 0.842689 0.650437 O\n0.349563 0.650437 0.842689 O\n0.650437 0.349563 0.157311 O\n0.157311 0.349563 0.842689 O\n0.349563 0.157311 0.650437 O\n0.842689 0.650437 0.157311 O\n0.650437 0.842689 0.349563 O\n0.349563 0.842689 0.157311 O\n0.842689 0.349563 0.650437 O\n0.157311 0.650437 0.349563 O\n0.650437 0.157311 0.842689 O\n",
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