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{
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"structure_string": "Ba1 Li1 Al3 P2 H2 O14\n1.0\n5.228896 3.307577 -3.602365\n-5.230775 3.307631 3.598975\n0.264604 -0.005867 7.628712\nBa Li Al P H O\n1 1 3 2 2 14\ndirect\n0.000304 0.995900 0.992398 Ba\n0.456248 0.534909 0.758118 Li\n0.996133 0.995453 0.482677 Al\n0.501129 0.000892 0.488780 Al\n0.993181 0.492869 0.487044 Al\n0.280102 0.712411 0.863853 P\n0.714614 0.275914 0.120965 P\n0.329344 0.666291 0.341539 H\n0.675718 0.320992 0.644884 H\n0.348442 0.642397 0.095627 O\n0.630100 0.357167 0.884895 O\n0.133768 0.855918 0.757262 O\n0.857281 0.132495 0.206125 O\n0.135864 0.488904 0.774156 O\n0.504580 0.858793 0.775258 O\n0.495124 0.116609 0.210561 O\n0.875523 0.496982 0.209020 O\n0.320019 0.674300 0.463276 O\n0.687743 0.307138 0.528904 O\n0.789453 0.971405 0.583854 O\n0.023091 0.204694 0.582826 O\n0.976655 0.784103 0.391538 O\n0.209681 0.017324 0.392868 O\n",
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{
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"structure_string": "Na24 Ta8 S32\n1.0\n0.000000 13.742743 14.362802\n4.014252 0.000000 14.362802\n4.014252 13.742743 0.000000\nNa Ta S\n24 8 32\ndirect\n0.669110 0.830890 0.830890 Na\n0.419110 0.580890 0.580890 Na\n0.184557 0.315443 0.315443 Na\n0.934557 0.065443 0.065443 Na\n0.448888 0.544070 0.054775 Na\n0.952267 0.054775 0.544070 Na\n0.195225 0.297733 0.801112 Na\n0.705930 0.801112 0.297733 Na\n0.002215 0.442321 0.738655 Na\n0.816809 0.738655 0.442321 Na\n0.511345 0.433191 0.247785 Na\n0.807679 0.247785 0.433191 Na\n0.807540 0.971740 0.883103 Na\n0.337617 0.883103 0.971740 Na\n0.366897 0.912383 0.442460 Na\n0.278260 0.442460 0.912383 Na\n0.513660 0.232481 0.936705 Na\n0.317154 0.936705 0.232481 Na\n0.313295 0.932846 0.736340 Na\n0.017519 0.736340 0.932846 Na\n0.897599 0.916243 0.378763 Na\n0.807394 0.378763 0.916243 Na\n0.871237 0.442606 0.352401 Na\n0.333757 0.352401 0.442606 Na\n0.113107 0.899615 0.641318 Ta\n0.345959 0.641318 0.899615 Ta\n0.608682 0.904041 0.136893 Ta\n0.350385 0.136893 0.904041 Ta\n0.109516 0.620753 0.410595 Ta\n0.859136 0.410595 0.620753 Ta\n0.839405 0.390864 0.140484 Ta\n0.629247 0.140484 0.390864 Ta\n0.818831 0.177469 0.849636 S\n0.154064 0.849636 0.177469 S\n0.400364 0.095936 0.431169 S\n0.072531 0.431169 0.095936 S\n0.168066 0.704213 0.641219 S\n0.486502 0.641219 0.704213 S\n0.608781 0.763498 0.081934 S\n0.545787 0.081934 0.763498 S\n0.292054 0.783053 0.361900 S\n0.562993 0.361900 0.783053 S\n0.888100 0.687007 0.957946 S\n0.466947 0.957946 0.687007 S\n0.179040 0.926872 0.707266 S\n0.186821 0.707266 0.926872 S\n0.542734 0.063179 0.070960 S\n0.323128 0.070960 0.063179 S\n0.898386 0.913074 0.600783 S\n0.587757 0.600783 0.913074 S\n0.649217 0.662243 0.351614 S\n0.336926 0.351614 0.662243 S\n0.388102 0.429554 0.211730 S\n0.970614 0.211730 0.429554 S\n0.038270 0.279386 0.861898 S\n0.820446 0.861898 0.279386 S\n0.124748 0.563201 0.247683 S\n0.064369 0.247683 0.563201 S\n0.002317 0.185631 0.125252 S\n0.686799 0.125252 0.185631 S\n0.033716 0.565867 0.574891 S\n0.825526 0.574891 0.565867 S\n0.675109 0.424474 0.216284 S\n0.684133 0.216284 0.424474 S\n",
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{
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"created_at": "2022-09-04T14:39:21.346206Z",
"structure_string": "Li4 Cr2 P6 O20\n1.0\n3.596761 7.126173 0.000000\n-3.596761 7.126173 0.000000\n0.000000 5.745413 7.654929\nLi Cr P O\n4 2 6 20\ndirect\n0.716545 0.742374 0.959081 Li\n0.742374 0.716545 0.459081 Li\n0.257626 0.283455 0.540919 Li\n0.283455 0.257626 0.040919 Li\n0.336297 0.663703 0.750000 Cr\n0.663703 0.336297 0.250000 Cr\n0.802817 0.433240 0.816370 P\n0.433240 0.802817 0.316370 P\n0.957235 0.042765 0.750000 P\n0.042765 0.957235 0.250000 P\n0.566760 0.197183 0.683630 P\n0.197183 0.566760 0.183630 P\n0.978736 0.807615 0.843539 O\n0.807615 0.978736 0.343539 O\n0.557080 0.982360 0.804366 O\n0.716140 0.466212 0.990034 O\n0.632696 0.594778 0.716646 O\n0.982360 0.557080 0.304366 O\n0.825297 0.182554 0.877780 O\n0.466212 0.716140 0.490034 O\n0.594778 0.632696 0.216646 O\n0.817446 0.174703 0.622220 O\n0.182554 0.825297 0.377780 O\n0.405222 0.367304 0.783354 O\n0.533788 0.283860 0.509966 O\n0.174703 0.817446 0.122220 O\n0.017640 0.442920 0.695634 O\n0.367304 0.405222 0.283354 O\n0.283860 0.533788 0.009966 O\n0.442920 0.017640 0.195634 O\n0.192385 0.021264 0.656461 O\n0.021264 0.192385 0.156461 O\n",
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"formula_full": "Li4 Cr2 P6 O20",
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{
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"structure_string": "Na1 Mg30 Fe1 O32\n1.0\n8.558770 0.000000 0.000000\n0.000000 8.558770 0.000000\n0.000000 0.000000 8.477711\nNa Mg Fe O\n1 30 1 32\ndirect\n0.000000 0.000000 0.500000 Na\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.253158 0.000000 0.251909 Mg\n0.253158 0.000000 0.748091 Mg\n0.746842 0.000000 0.251909 Mg\n0.746842 0.000000 0.748091 Mg\n0.250076 0.500000 0.250580 Mg\n0.250076 0.500000 0.749420 Mg\n0.749924 0.500000 0.250580 Mg\n0.749924 0.500000 0.749420 Mg\n0.000000 0.253158 0.251909 Mg\n0.000000 0.253158 0.748091 Mg\n0.500000 0.250076 0.250580 Mg\n0.500000 0.250076 0.749420 Mg\n0.000000 0.746842 0.251909 Mg\n0.000000 0.746842 0.748091 Mg\n0.500000 0.749924 0.250580 Mg\n0.500000 0.749924 0.749420 Mg\n0.249966 0.249966 0.000000 Mg\n0.249005 0.249005 0.500000 Mg\n0.750034 0.249966 0.000000 Mg\n0.750995 0.249005 0.500000 Mg\n0.249966 0.750034 0.000000 Mg\n0.249005 0.750995 0.500000 Mg\n0.750034 0.750034 0.000000 Mg\n0.750995 0.750995 0.500000 Mg\n0.000000 0.000000 0.000000 Fe\n0.000000 0.251206 0.000000 O\n0.000000 0.261128 0.500000 O\n0.500000 0.249719 0.000000 O\n0.500000 0.251766 0.500000 O\n0.000000 0.748794 0.000000 O\n0.000000 0.738872 0.500000 O\n0.500000 0.750281 0.000000 O\n0.500000 0.748234 0.500000 O\n0.248869 0.248869 0.249540 O\n0.248869 0.248869 0.750460 O\n0.751131 0.248869 0.249540 O\n0.751131 0.248869 0.750460 O\n0.248869 0.751131 0.249540 O\n0.248869 0.751131 0.750460 O\n0.751131 0.751131 0.249540 O\n0.751131 0.751131 0.750460 O\n0.000000 0.000000 0.223882 O\n0.000000 0.000000 0.776118 O\n0.500000 0.000000 0.246811 O\n0.500000 0.000000 0.753189 O\n0.000000 0.500000 0.246811 O\n0.000000 0.500000 0.753189 O\n0.500000 0.500000 0.248780 O\n0.500000 0.500000 0.751220 O\n0.251206 0.000000 0.000000 O\n0.261128 0.000000 0.500000 O\n0.748794 0.000000 0.000000 O\n0.738872 0.000000 0.500000 O\n0.249719 0.500000 0.000000 O\n0.251766 0.500000 0.500000 O\n0.750281 0.500000 0.000000 O\n0.748234 0.500000 0.500000 O\n",
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{
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{
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