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{
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{
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{
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"structure_string": "Mn6 Fe6 P12 O48\n1.0\n5.989178 0.000000 0.000000\n0.000000 9.883229 0.000000\n0.000000 0.012677 14.721732\nMn Fe P O\n6 6 12 48\ndirect\n0.500000 0.716695 0.978722 Mn\n0.500000 0.218074 0.853543 Mn\n0.000000 0.782868 0.813344 Mn\n0.500000 0.718679 0.645258 Mn\n0.500000 0.219691 0.519869 Mn\n0.500000 0.716890 0.311644 Mn\n0.000000 0.275154 0.679225 Fe\n0.000000 0.777101 0.486043 Fe\n0.000000 0.276033 0.345646 Fe\n0.500000 0.226173 0.179710 Fe\n0.000000 0.776090 0.153401 Fe\n0.000000 0.274006 0.012716 Fe\n0.000000 0.597750 0.971891 P\n0.000000 0.095181 0.861257 P\n0.500000 0.901275 0.806491 P\n0.500000 0.400833 0.693421 P\n0.000000 0.599080 0.639148 P\n0.000000 0.097189 0.528456 P\n0.500000 0.901510 0.473078 P\n0.500000 0.402589 0.360955 P\n0.000000 0.596984 0.305073 P\n0.000000 0.097620 0.195794 P\n0.500000 0.899743 0.139456 P\n0.500000 0.401682 0.026715 P\n0.000000 0.445632 0.950144 O\n0.200925 0.670418 0.923763 O\n0.799075 0.670418 0.923763 O\n0.500000 0.381077 0.923040 O\n0.500000 0.881296 0.910028 O\n0.198533 0.169601 0.910844 O\n0.801467 0.169601 0.910844 O\n0.000000 0.944072 0.885058 O\n0.500000 0.054313 0.785833 O\n0.700800 0.830521 0.758299 O\n0.299200 0.830521 0.758299 O\n0.000000 0.117561 0.759114 O\n0.000000 0.620560 0.742256 O\n0.703139 0.329474 0.740138 O\n0.296861 0.329474 0.740138 O\n0.500000 0.553909 0.713570 O\n0.000000 0.448818 0.617215 O\n0.198445 0.673645 0.590067 O\n0.801555 0.673645 0.590067 O\n0.500000 0.382395 0.589286 O\n0.500000 0.882475 0.577520 O\n0.801570 0.172748 0.577915 O\n0.198430 0.172748 0.577915 O\n0.000000 0.947096 0.552643 O\n0.500000 0.054563 0.453120 O\n0.703726 0.830821 0.427133 O\n0.296274 0.830821 0.427133 O\n0.000000 0.119670 0.426353 O\n0.000000 0.619770 0.407513 O\n0.296416 0.331019 0.407514 O\n0.703584 0.331019 0.407514 O\n0.500000 0.555579 0.382957 O\n0.000000 0.447141 0.281203 O\n0.198546 0.672323 0.256165 O\n0.801454 0.672323 0.256165 O\n0.500000 0.383114 0.257514 O\n0.500000 0.880452 0.243844 O\n0.799268 0.173200 0.243186 O\n0.200732 0.173200 0.243186 O\n0.000000 0.947257 0.218764 O\n0.500000 0.052232 0.119957 O\n0.703480 0.828217 0.093467 O\n0.296520 0.828217 0.093467 O\n0.000000 0.119909 0.092858 O\n0.000000 0.618635 0.074620 O\n0.299695 0.328235 0.074776 O\n0.700305 0.328235 0.074776 O\n0.500000 0.553140 0.048198 O\n",
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{
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"created_at": "2022-09-04T14:40:43.771900Z",
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{
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"structure_string": "Ta4 Cr8 Si10\n1.0\n-2.575703 3.724638 8.151298\n2.575703 -3.724638 8.151298\n2.575703 3.724638 -8.151298\nTa Cr Si\n4 8 10\ndirect\n0.810094 0.560094 0.750000 Ta\n0.189906 0.939906 0.750000 Ta\n0.189906 0.439906 0.250000 Ta\n0.810094 0.060094 0.250000 Ta\n0.189053 0.939307 0.249746 Cr\n0.810947 0.060693 0.750254 Cr\n0.310439 0.560693 0.749746 Cr\n0.689561 0.439307 0.250254 Cr\n0.766212 0.643570 0.122642 Cr\n0.233788 0.356430 0.877358 Cr\n0.479072 0.856430 0.622642 Cr\n0.520928 0.143570 0.377358 Cr\n0.500000 0.250000 0.750000 Si\n0.500000 0.750000 0.250000 Si\n0.106072 0.796927 0.309145 Si\n0.893928 0.203073 0.690855 Si\n0.512219 0.703073 0.809145 Si\n0.487781 0.296927 0.190855 Si\n0.969347 0.559894 0.409453 Si\n0.030653 0.440106 0.590547 Si\n0.849559 0.940106 0.909453 Si\n0.150441 0.059894 0.090547 Si\n",
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{
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"structure_string": "Sr4 Mn2 Mo2 O12\n1.0\n-5.626014 0.004912 0.002193\n-0.005228 5.624655 -0.001974\n0.003256 0.004573 -8.265340\nSr Mn Mo O\n4 2 2 12\ndirect\n0.500227 0.000516 0.254654 Sr\n0.000156 0.500250 0.745238 Sr\n0.999752 0.499774 0.254756 Sr\n0.499618 0.999629 0.745323 Sr\n0.500132 0.500084 0.499988 Mn\n0.999955 0.999904 0.000153 Mn\n0.499887 0.499946 0.999999 Mo\n0.999986 0.000031 0.499977 Mo\n0.997238 0.003314 0.266450 O\n0.497783 0.502829 0.764064 O\n0.502333 0.496924 0.235754 O\n0.003191 0.996796 0.733602 O\n0.205724 0.318334 0.999882 O\n0.709070 0.782609 0.499965 O\n0.793892 0.681602 0.000175 O\n0.291112 0.217469 0.500068 O\n0.681836 0.205406 0.998531 O\n0.217001 0.707908 0.498577 O\n0.318090 0.794580 0.001432 O\n0.783018 0.292096 0.501413 O\n",
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{
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{
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{
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"structure_string": "Ca4 Cr8 O16\n1.0\n5.138117 0.000017 0.000025\n0.000020 5.982896 -0.000012\n0.000055 -0.000023 11.167432\nCa Cr O\n4 8 16\ndirect\n0.852687 0.250009 0.750004 Ca\n0.147302 0.750010 0.250028 Ca\n0.537671 0.250009 0.249979 Ca\n0.462355 0.750007 0.750003 Ca\n0.507767 0.749875 0.009050 Cr\n0.492400 0.249895 0.990945 Cr\n0.999891 0.500180 0.500012 Cr\n0.999970 0.000070 0.499997 Cr\n0.507549 0.750133 0.490965 Cr\n0.492289 0.250088 0.509039 Cr\n0.000046 0.999926 0.999993 Cr\n0.000088 0.499813 0.000004 Cr\n0.844779 0.750126 0.401452 O\n0.844970 0.749866 0.098570 O\n0.155109 0.250127 0.598539 O\n0.155150 0.249866 0.901434 O\n0.178338 0.750123 0.590072 O\n0.178581 0.749871 0.909949 O\n0.821500 0.250118 0.409920 O\n0.821575 0.249876 0.090050 O\n0.663213 0.503373 0.601215 O\n0.663344 0.996605 0.898778 O\n0.336641 0.003396 0.398776 O\n0.336797 0.496628 0.101227 O\n0.336623 0.496790 0.398780 O\n0.336767 0.003184 0.101222 O\n0.663229 0.996843 0.601202 O\n0.663370 0.503194 0.898795 O\n",
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{
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{
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}