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{
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{
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{
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{
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"structure_string": "Ba2 Fe2 P6 H4 O22\n1.0\n0.076435 -0.004311 6.973898\n7.740220 -0.030843 -0.844884\n-2.781081 8.205139 -1.747270\nBa Fe P H O\n2 2 6 4 22\ndirect\n0.330300 0.169050 0.837826 Ba\n0.668393 0.830435 0.156333 Ba\n0.493578 0.498485 0.495463 Fe\n0.002519 0.501461 0.003625 Fe\n0.779023 0.202771 0.626874 P\n0.216409 0.803247 0.376350 P\n0.898434 0.739127 0.768338 P\n0.094909 0.249868 0.223877 P\n0.290478 0.644008 0.801608 P\n0.707986 0.354207 0.195395 P\n0.652069 0.948160 0.661590 H\n0.346823 0.050690 0.334869 H\n0.981559 0.012559 0.499605 H\n0.995424 0.994168 0.982870 H\n0.373911 0.496644 0.688674 O\n0.623554 0.501035 0.308645 O\n0.851686 0.659202 0.898339 O\n0.146523 0.334198 0.096560 O\n0.661726 0.331356 0.565231 O\n0.332004 0.671635 0.438127 O\n0.067107 0.642836 0.694874 O\n0.931007 0.354584 0.300731 O\n0.845688 0.071234 0.482762 O\n0.144463 0.935128 0.512040 O\n0.719147 0.721130 0.630833 O\n0.276472 0.272500 0.362420 O\n0.625437 0.075333 0.678522 O\n0.374469 0.924169 0.321488 O\n0.260931 0.583666 0.949827 O\n0.738542 0.415743 0.047773 O\n0.410061 0.834048 0.859654 O\n0.586131 0.165037 0.136239 O\n0.955286 0.295723 0.773524 O\n0.046208 0.702665 0.224011 O\n0.990910 0.945162 0.850487 O\n0.999832 0.048734 0.139615 O\n",
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{
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{
"id": "mp-1196275",
"created_at": "2022-09-04T14:44:55.031768Z",
"structure_string": "Ba8 Fe8 O8 F40\n1.0\n7.414852 0.000000 0.000000\n0.000000 10.449648 0.000000\n0.000000 0.000000 13.538858\nBa Fe O F\n8 8 8 40\ndirect\n0.434462 0.872914 0.879673 Ba\n0.065538 0.627086 0.379673 Ba\n0.065538 0.372914 0.120327 Ba\n0.434462 0.127086 0.620327 Ba\n0.565538 0.127086 0.120327 Ba\n0.934462 0.372914 0.620327 Ba\n0.934462 0.627086 0.879673 Ba\n0.565538 0.872914 0.379673 Ba\n0.260624 0.759362 0.128765 Fe\n0.239376 0.740638 0.628765 Fe\n0.239376 0.259362 0.871235 Fe\n0.260624 0.240638 0.371235 Fe\n0.739376 0.240638 0.871235 Fe\n0.760624 0.259362 0.371235 Fe\n0.760624 0.740638 0.128765 Fe\n0.739376 0.759362 0.628765 Fe\n0.038584 0.908335 0.893402 O\n0.461416 0.591665 0.393402 O\n0.461416 0.408335 0.106598 O\n0.038584 0.091665 0.606598 O\n0.961416 0.091665 0.106598 O\n0.538584 0.408335 0.606598 O\n0.538584 0.591665 0.893402 O\n0.961416 0.908335 0.393402 O\n0.327258 0.900674 0.684629 F\n0.172742 0.599326 0.184629 F\n0.172742 0.400674 0.315371 F\n0.327258 0.099326 0.815371 F\n0.672742 0.099326 0.315371 F\n0.827258 0.400674 0.815371 F\n0.827258 0.599326 0.684629 F\n0.672742 0.900674 0.184629 F\n0.722314 0.793956 0.991247 F\n0.777686 0.706044 0.491247 F\n0.777686 0.293956 0.008753 F\n0.722314 0.206044 0.508753 F\n0.277686 0.206044 0.008753 F\n0.222314 0.293956 0.508753 F\n0.222314 0.706044 0.991247 F\n0.277686 0.793956 0.491247 F\n0.208802 0.688518 0.767577 F\n0.291198 0.811482 0.267577 F\n0.291198 0.188518 0.232423 F\n0.208802 0.311482 0.732423 F\n0.791198 0.311482 0.232423 F\n0.708802 0.188518 0.732423 F\n0.708802 0.811482 0.767577 F\n0.791198 0.688518 0.267577 F\n0.352324 0.920071 0.073712 F\n0.147676 0.579929 0.573712 F\n0.147676 0.420071 0.926288 F\n0.352324 0.079929 0.426288 F\n0.647676 0.079929 0.926288 F\n0.852324 0.420071 0.426288 F\n0.852324 0.579929 0.073712 F\n0.647676 0.920071 0.573712 F\n0.493693 0.679789 0.628250 F\n0.006307 0.820211 0.128250 F\n0.006307 0.179789 0.371750 F\n0.493693 0.320211 0.871750 F\n0.506307 0.320211 0.371750 F\n0.993693 0.179789 0.871750 F\n0.993693 0.820211 0.628250 F\n0.506307 0.679789 0.128250 F\n",
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{
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{
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}