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{
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{
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"structure_string": "Ca4 Ta4 N4 O8\n1.0\n5.685519 0.000000 0.000000\n0.000000 5.565716 0.000000\n0.000000 5.520949 7.904885\nCa Ta N O\n4 4 4 8\ndirect\n0.458676 0.767350 0.745591 Ca\n0.958676 0.232650 0.754409 Ca\n0.541324 0.232650 0.254409 Ca\n0.041324 0.767350 0.245591 Ca\n0.000000 0.500000 0.000000 Ta\n0.500000 0.500000 0.500000 Ta\n0.000000 0.000000 0.500000 Ta\n0.500000 0.000000 0.000000 Ta\n0.211316 0.832746 0.957134 N\n0.711316 0.167254 0.542866 N\n0.788684 0.167254 0.042866 N\n0.288684 0.832746 0.457134 N\n0.022420 0.661804 0.750269 O\n0.522420 0.338196 0.749731 O\n0.977580 0.338196 0.249731 O\n0.477580 0.661804 0.250269 O\n0.790395 0.757491 0.451219 O\n0.290395 0.242509 0.048781 O\n0.209605 0.242509 0.548781 O\n0.709605 0.757491 0.951219 O\n",
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{
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{
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"created_at": "2022-09-04T14:48:14.321018Z",
"structure_string": "Ca2 C2 O6\n1.0\n3.830029 0.000000 0.000000\n-0.053763 5.122700 0.000000\n-1.795522 -0.622098 6.363608\nCa C O\n2 2 6\ndirect\n0.608636 0.314606 0.257693 Ca\n0.391364 0.685394 0.742307 Ca\n0.984614 0.206706 0.754269 C\n0.015386 0.793294 0.245731 C\n0.807215 0.382444 0.638922 O\n0.192785 0.617556 0.361078 O\n0.880559 0.962384 0.718219 O\n0.119441 0.037616 0.281781 O\n0.276445 0.285224 0.897971 O\n0.723555 0.714776 0.102029 O\n",
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{
"id": "mp-778999",
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"structure_string": "Ti34 N12 O48\n1.0\n10.042440 0.000000 0.000000\n0.000000 10.394718 0.000000\n0.000000 4.219425 10.665867\nTi N O\n34 12 48\ndirect\n0.250000 0.198003 0.102927 Ti\n0.577329 0.143932 0.123086 Ti\n0.922671 0.143932 0.123086 Ti\n0.060127 0.362578 0.212664 Ti\n0.439873 0.362578 0.212664 Ti\n0.929346 0.635438 0.121528 Ti\n0.570654 0.635438 0.121528 Ti\n0.250000 0.698660 0.101702 Ti\n0.576492 0.140328 0.448044 Ti\n0.750000 0.801916 0.231049 Ti\n0.069378 0.864384 0.210835 Ti\n0.430622 0.864384 0.210835 Ti\n0.923508 0.140328 0.448044 Ti\n0.250000 0.196242 0.430799 Ti\n0.427978 0.359026 0.546961 Ti\n0.072022 0.359026 0.546961 Ti\n0.927978 0.640974 0.453039 Ti\n0.750000 0.301912 0.566316 Ti\n0.572022 0.640974 0.453039 Ti\n0.250000 0.698088 0.433684 Ti\n0.569378 0.135616 0.789165 Ti\n0.250000 0.198084 0.768951 Ti\n0.076492 0.859672 0.551956 Ti\n0.750000 0.803758 0.569201 Ti\n0.930622 0.135616 0.789165 Ti\n0.423508 0.859672 0.551956 Ti\n0.939873 0.637422 0.787336 Ti\n0.560127 0.637422 0.787336 Ti\n0.750000 0.301340 0.898298 Ti\n0.429346 0.364562 0.878472 Ti\n0.070654 0.364562 0.878472 Ti\n0.750000 0.801997 0.897073 Ti\n0.077329 0.856068 0.876914 Ti\n0.422671 0.856068 0.876914 Ti\n0.750000 0.221099 0.082462 N\n0.750000 0.732684 0.087680 N\n0.250000 0.268863 0.243483 N\n0.750000 0.219236 0.440299 N\n0.250000 0.773092 0.243567 N\n0.750000 0.729646 0.424934 N\n0.250000 0.270354 0.575066 N\n0.750000 0.226908 0.756433 N\n0.250000 0.780764 0.559701 N\n0.250000 0.267316 0.912320 N\n0.750000 0.731137 0.756517 N\n0.250000 0.778901 0.917538 N\n0.120654 0.047355 0.149310 O\n0.062479 0.309892 0.063761 O\n0.379346 0.047355 0.149310 O\n0.437521 0.309892 0.063761 O\n0.608578 0.456038 0.181104 O\n0.121766 0.549463 0.150300 O\n0.065353 0.813501 0.063851 O\n0.549967 0.175727 0.274969 O\n0.378234 0.549463 0.150300 O\n0.950033 0.175727 0.274969 O\n0.891422 0.456038 0.181104 O\n0.434647 0.813501 0.063851 O\n0.062802 0.311463 0.395787 O\n0.380285 0.048390 0.487011 O\n0.119715 0.048390 0.487011 O\n0.437198 0.311463 0.395787 O\n0.881574 0.951246 0.183675 O\n0.618426 0.951246 0.183675 O\n0.933976 0.687942 0.270659 O\n0.566024 0.687942 0.270659 O\n0.118531 0.547006 0.484861 O\n0.881469 0.452994 0.515139 O\n0.062954 0.809469 0.395176 O\n0.937046 0.190531 0.604824 O\n0.562954 0.190531 0.604824 O\n0.618531 0.452994 0.515139 O\n0.381469 0.547006 0.484861 O\n0.437046 0.809469 0.395176 O\n0.118426 0.048754 0.816325 O\n0.066024 0.312058 0.729341 O\n0.937198 0.688537 0.604213 O\n0.619715 0.951610 0.512989 O\n0.562802 0.688537 0.604213 O\n0.880285 0.951610 0.512989 O\n0.381574 0.048754 0.816325 O\n0.433976 0.312058 0.729341 O\n0.878234 0.450537 0.849700 O\n0.565353 0.186499 0.936149 O\n0.621766 0.450537 0.849700 O\n0.108578 0.543962 0.818896 O\n0.934647 0.186499 0.936149 O\n0.391422 0.543962 0.818896 O\n0.450033 0.824273 0.725031 O\n0.049967 0.824273 0.725031 O\n0.562479 0.690108 0.936239 O\n0.879346 0.952645 0.850690 O\n0.620654 0.952645 0.850690 O\n0.937521 0.690108 0.936239 O\n",
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{
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"structure_string": "Na7 Mn4 Fe8 P12 O48\n1.0\n6.348906 6.852912 0.000000\n-6.348906 6.852912 0.000000\n0.000000 5.907472 10.543697\nNa Mn Fe P O\n7 4 8 12 48\ndirect\n0.249299 0.001196 0.874160 Na\n0.750279 0.499413 0.376366 Na\n0.998804 0.750701 0.125840 Na\n0.500587 0.249721 0.623634 Na\n0.110262 0.889738 0.500000 Na\n0.878502 0.605424 0.758082 Na\n0.394576 0.121498 0.241918 Na\n0.888990 0.111010 0.000000 Mn\n0.393659 0.606341 0.500000 Mn\n0.603757 0.891821 0.748896 Mn\n0.108179 0.396243 0.251104 Mn\n0.224732 0.661179 0.778204 Fe\n0.725156 0.156860 0.281410 Fe\n0.338821 0.775268 0.221796 Fe\n0.843140 0.274844 0.718590 Fe\n0.283028 0.341947 0.969682 Fe\n0.772914 0.839774 0.470827 Fe\n0.160226 0.227086 0.529173 Fe\n0.658053 0.716972 0.030318 Fe\n0.079005 0.047788 0.197751 P\n0.580368 0.541261 0.701922 P\n0.952212 0.920995 0.802249 P\n0.458739 0.419632 0.298078 P\n0.421318 0.956831 0.545091 P\n0.921735 0.455556 0.052735 P\n0.544444 0.078265 0.947265 P\n0.043169 0.578682 0.454909 P\n0.340154 0.659846 0.000000 P\n0.840824 0.159176 0.500000 P\n0.159924 0.340609 0.751729 P\n0.659391 0.840076 0.248271 P\n0.989890 0.934175 0.912306 O\n0.488376 0.437585 0.410008 O\n0.065825 0.010110 0.087694 O\n0.562415 0.511624 0.589992 O\n0.509707 0.064356 0.836130 O\n0.008737 0.564780 0.343377 O\n0.435220 0.991263 0.656623 O\n0.935644 0.490293 0.163870 O\n0.054729 0.809116 0.741800 O\n0.562989 0.299321 0.251148 O\n0.190884 0.945271 0.258200 O\n0.700679 0.437011 0.748852 O\n0.437178 0.189357 0.004913 O\n0.945888 0.693408 0.511841 O\n0.306592 0.054112 0.488159 O\n0.810643 0.562822 0.995087 O\n0.861708 0.284109 0.098246 O\n0.365393 0.783443 0.590648 O\n0.715891 0.138292 0.901754 O\n0.216557 0.634607 0.409352 O\n0.635649 0.709939 0.666684 O\n0.142675 0.219201 0.151004 O\n0.780799 0.857325 0.848996 O\n0.290061 0.364351 0.333316 O\n0.916154 0.028345 0.301520 O\n0.418227 0.508581 0.811097 O\n0.971655 0.083846 0.698480 O\n0.491419 0.581773 0.188903 O\n0.584060 0.986349 0.437854 O\n0.083666 0.480047 0.945614 O\n0.519953 0.916334 0.054386 O\n0.013651 0.415940 0.562146 O\n0.272433 0.739814 0.895032 O\n0.765418 0.237034 0.398799 O\n0.260186 0.727567 0.104968 O\n0.762966 0.234582 0.601201 O\n0.227556 0.263258 0.857969 O\n0.731794 0.759844 0.348586 O\n0.240156 0.268206 0.651414 O\n0.736742 0.772444 0.142031 O\n0.193239 0.518946 0.689890 O\n0.695481 0.019061 0.187088 O\n0.980939 0.304519 0.812912 O\n0.481054 0.806761 0.310110 O\n0.301386 0.482554 0.060645 O\n0.804750 0.982409 0.564860 O\n0.517446 0.698614 0.939355 O\n0.017591 0.195250 0.435140 O\n",
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