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{
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"structure_string": "Li2 Bi2 B4 O12\n1.0\n0.000000 4.590261 0.000841\n5.889940 0.000000 0.000000\n0.000000 -4.207652 -8.042395\nLi Bi B O\n2 2 4 12\ndirect\n0.500000 0.500000 0.500000 Li\n0.500000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Bi\n-0.000000 0.000000 0.500000 Bi\n0.733689 0.136069 0.741231 B\n0.266311 0.636069 0.758768 B\n0.733689 0.363931 0.241232 B\n0.266311 0.863931 0.258768 B\n0.544648 0.813050 0.405535 O\n0.455352 0.313050 0.094465 O\n0.748081 0.315391 0.394200 O\n0.009780 0.047647 0.739075 O\n0.990220 0.952353 0.260925 O\n0.748081 0.184609 0.894199 O\n0.544648 0.686950 0.905534 O\n0.455352 0.186950 0.594465 O\n0.251919 0.815391 0.105800 O\n0.009780 0.452353 0.239075 O\n0.251919 0.684609 0.605800 O\n0.990220 0.547647 0.760924 O\n",
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{
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"structure_string": "Nb6 Fe2 S12\n1.0\n2.893412 -5.011537 0.000000\n2.893412 5.011537 -0.000000\n0.000000 -0.000000 11.604244\nNb Fe S\n6 2 12\ndirect\n0.666667 0.333332 0.495921 Nb\n0.333332 0.666667 0.995920 Nb\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.666667 0.333332 0.004079 Nb\n0.333332 0.666667 0.504079 Nb\n0.333332 0.666667 0.250000 Fe\n0.666667 0.333332 0.750000 Fe\n0.337235 0.331588 0.863099 S\n0.331588 0.994353 0.363100 S\n0.662764 0.668411 0.363100 S\n0.337235 0.005647 0.636900 S\n0.668411 0.662764 0.636900 S\n0.662764 0.994353 0.136900 S\n0.994353 0.331588 0.636900 S\n0.005646 0.668412 0.136900 S\n0.994353 0.662764 0.863099 S\n0.331588 0.337235 0.136900 S\n0.668412 0.005646 0.863099 S\n0.005647 0.337235 0.363100 S\n",
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{
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"created_at": "2022-09-04T14:37:00.228565Z",
"updated_at": "2022-09-04T14:37:00.228593Z",
"structure_string": "Cu2 Bi2 P4 Se12\n1.0\n6.613762 -0.000000 -0.000000\n-3.306880 5.727685 0.000000\n-0.000000 0.000000 13.294790\nCu Bi P Se\n2 2 4 12\ndirect\n0.000000 0.000000 0.750000 Cu\n0.000000 0.000000 0.250000 Cu\n0.333333 0.666668 0.750000 Bi\n0.666667 0.333333 0.250000 Bi\n0.666667 0.333333 0.836424 P\n0.666667 0.333333 0.663576 P\n0.333333 0.666668 0.163576 P\n0.333333 0.666668 0.336424 P\n0.296816 0.325691 0.118270 Se\n0.971123 0.674310 0.618270 Se\n0.028877 0.703185 0.118270 Se\n0.703185 0.674310 0.881730 Se\n0.325691 0.028877 0.881730 Se\n0.703184 0.028877 0.618270 Se\n0.971123 0.296816 0.881730 Se\n0.028877 0.325691 0.381730 Se\n0.325691 0.296816 0.618270 Se\n0.674309 0.971124 0.118270 Se\n0.296816 0.971124 0.381730 Se\n0.674309 0.703185 0.381730 Se\n",
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{
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"structure_string": "Sc12 P8\n1.0\n3.723256 0.000000 0.000000\n0.000000 10.175488 0.000000\n0.000000 0.000000 10.030300\nSc P\n12 8\ndirect\n0.250000 0.224088 0.799042 Sc\n0.750001 0.451966 0.633191 Sc\n0.250000 0.548034 0.366809 Sc\n0.750001 0.626141 0.938078 Sc\n0.250000 0.373859 0.061922 Sc\n0.750001 0.126141 0.561922 Sc\n0.250000 0.873859 0.438078 Sc\n0.250000 0.724088 0.700958 Sc\n0.750001 0.275912 0.299042 Sc\n0.750001 0.951966 0.866809 Sc\n0.750001 0.775913 0.200958 Sc\n0.250000 0.048034 0.133191 Sc\n0.750001 0.685443 0.504028 P\n0.250000 0.314557 0.495972 P\n0.750001 0.185443 0.995972 P\n0.250000 0.814558 0.004028 P\n0.750001 0.510358 0.180320 P\n0.250000 0.489642 0.819680 P\n0.750001 0.010358 0.319680 P\n0.250000 0.989642 0.680321 P\n",
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{
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"created_at": "2022-09-04T14:36:32.170892Z",
"updated_at": "2022-09-04T14:36:32.170915Z",
"structure_string": "Mg4 Ti2 Ir2 O12\n1.0\n0.000000 5.142560 0.011432\n5.312342 0.000000 0.000000\n0.000000 -5.113236 -7.516085\nMg Ti Ir O\n4 2 2 12\ndirect\n0.247860 0.945291 0.253351 Mg\n0.752140 0.445291 0.246650 Mg\n0.247860 0.554708 0.753351 Mg\n0.752140 0.054709 0.746650 Mg\n0.000000 0.500000 0.000000 Ti\n-0.000000 0.000000 0.500000 Ti\n0.500000 0.500000 0.500000 Ir\n0.500000 0.000000 0.000000 Ir\n0.102656 0.812627 0.928353 O\n0.256863 0.321511 0.937153 O\n0.897344 0.312627 0.571648 O\n0.622471 0.069586 0.252337 O\n0.377529 0.930413 0.747664 O\n0.897344 0.187373 0.071648 O\n0.743137 0.678489 0.062848 O\n0.256863 0.178489 0.437152 O\n0.743137 0.821511 0.562849 O\n0.622471 0.430413 0.752337 O\n0.102657 0.687372 0.428353 O\n0.377529 0.569586 0.247664 O\n",
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{
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"created_at": "2022-09-04T14:36:10.081145Z",
"updated_at": "2022-09-04T14:36:10.081162Z",
"structure_string": "Li5 Mn3 Nb2 O10\n1.0\n5.311830 0.069730 0.035580\n1.032521 5.121436 0.000193\n2.608117 2.102202 7.251939\nLi Mn Nb O\n5 3 2 10\ndirect\n0.528490 0.780376 0.399617 Li\n0.506277 0.602252 0.786374 Li\n0.000000 0.500000 0.500000 Li\n0.493724 0.397748 0.213626 Li\n0.471511 0.219624 0.600382 Li\n0.500000 -0.000000 -0.000000 Mn\n0.989403 0.306937 0.899043 Mn\n0.010598 0.693063 0.100957 Mn\n0.993071 0.092952 0.323151 Nb\n0.006930 0.907048 0.676849 Nb\n0.248852 0.336166 0.058269 O\n0.233062 0.952985 0.846363 O\n0.751148 0.663835 0.941731 O\n0.747433 0.837740 0.548848 O\n0.257885 0.775445 0.243052 O\n0.230010 0.561284 0.654859 O\n0.769991 0.438717 0.345140 O\n0.742116 0.224555 0.756948 O\n0.252567 0.162260 0.451152 O\n0.766939 0.047015 0.153636 O\n",
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{
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"structure_string": "Rb4 P4 O12\n1.0\n4.233310 0.000000 0.000000\n0.000000 6.423038 -0.706396\n0.000000 -0.052701 12.135439\nRb P O\n4 4 12\ndirect\n0.140447 0.777583 0.091796 Rb\n0.859553 0.222418 0.908204 Rb\n0.359553 0.277583 0.591796 Rb\n0.640447 0.722418 0.408204 Rb\n0.493623 0.318712 0.177968 P\n0.993623 0.181288 0.322032 P\n0.506376 0.681288 0.822032 P\n0.006377 0.818713 0.677968 P\n0.755042 0.651434 0.718435 O\n0.255042 0.848567 0.781565 O\n0.852776 0.026833 0.675770 O\n0.337954 0.212440 0.076347 O\n0.837954 0.287560 0.423653 O\n0.662046 0.787560 0.923653 O\n0.162046 0.712441 0.576347 O\n0.647224 0.526833 0.175769 O\n0.147224 0.973168 0.324230 O\n0.352776 0.473168 0.824230 O\n0.744958 0.151434 0.218435 O\n0.244958 0.348566 0.281565 O\n",
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{
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"structure_string": "Zn4 Fe4 O12\n1.0\n0.000000 5.004141 0.000367\n5.063949 0.000000 0.000000\n0.000000 -5.003550 -7.286794\nZn Fe O\n4 4 12\ndirect\n0.254199 0.044863 0.250006 Zn\n0.254198 0.455137 0.750006 Zn\n0.745801 0.544863 0.249993 Zn\n0.745800 0.955137 0.749993 Zn\n0.500000 0.000000 -0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.499999 0.500000 0.500000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.755230 0.188783 0.939343 O\n0.376543 0.311216 0.060660 O\n0.623456 0.688784 0.939339 O\n0.244769 0.811217 0.060656 O\n0.376543 0.188784 0.560660 O\n0.865262 0.944100 0.249996 O\n0.134738 0.444100 0.250003 O\n0.134737 0.055900 0.750003 O\n0.244769 0.688783 0.560656 O\n0.865261 0.555900 0.749996 O\n0.755230 0.311217 0.439344 O\n0.623456 0.811216 0.439339 O\n",
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{
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"updated_at": "2022-09-04T14:36:32.053025Z",
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"structure_string": "Tm2 Ag2 P4 Se12\n1.0\n3.301898 -5.719055 0.000000\n3.301898 5.719055 0.000000\n0.000000 0.000000 13.493315\nTm Ag P Se\n2 2 4 12\ndirect\n0.000000 0.000000 0.750000 Tm\n0.000000 0.000000 0.250000 Tm\n0.333333 0.666667 0.750000 Ag\n0.666667 0.333333 0.250000 Ag\n0.666667 0.333333 0.665301 P\n0.666667 0.333333 0.834698 P\n0.333333 0.666667 0.334698 P\n0.333333 0.666667 0.165302 P\n0.980718 0.320387 0.616130 Se\n0.980718 0.660332 0.883869 Se\n0.679613 0.019282 0.883869 Se\n0.339669 0.320387 0.883869 Se\n0.320387 0.339669 0.383870 Se\n0.320387 0.980718 0.116130 Se\n0.019282 0.679613 0.383870 Se\n0.019282 0.339669 0.116130 Se\n0.339669 0.019282 0.616130 Se\n0.660332 0.679613 0.116130 Se\n0.660332 0.980718 0.383870 Se\n0.679613 0.660332 0.616130 Se\n",
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"structure_string": "Li4 V4 F12\n1.0\n6.041004 -0.000000 0.000000\n-0.000000 6.041004 -0.000000\n-0.000000 0.000000 6.041004\nLi V F\n4 4 12\ndirect\n0.877007 0.877007 0.877007 Li\n0.122993 0.377007 0.622992 Li\n0.622992 0.122993 0.377007 Li\n0.377007 0.622992 0.122993 Li\n0.163266 0.163266 0.163266 V\n0.336734 0.836734 0.663266 V\n0.663266 0.336734 0.836734 V\n0.836734 0.663266 0.336734 V\n0.870379 0.991407 0.225800 F\n0.629620 0.008592 0.725800 F\n0.774199 0.370380 0.508592 F\n0.508592 0.774199 0.370380 F\n0.491407 0.274200 0.129620 F\n0.274200 0.129620 0.491407 F\n0.370380 0.508592 0.774199 F\n0.129620 0.491407 0.274200 F\n0.725800 0.629620 0.008592 F\n0.008592 0.725800 0.629620 F\n0.225800 0.870379 0.991407 F\n0.991407 0.225800 0.870379 F\n",
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]
}