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{
"id": "jvasp-54929",
"created_at": "2022-09-04T14:38:11.260518Z",
"updated_at": "2022-09-04T14:38:11.260546Z",
"structure_string": "Ca4 Zn4 Cu2 P6\n1.0\n2.026239 -3.509547 0.000000\n2.026239 3.509547 -0.000000\n0.000000 0.000000 21.427027\nCa Zn Cu P\n4 4 2 6\ndirect\n0.000000 0.000000 0.658923 Ca\n0.000000 0.000000 0.341077 Ca\n0.000000 0.000000 0.158923 Ca\n0.000000 0.000000 0.841077 Ca\n0.333333 0.666667 0.956847 Zn\n0.666667 0.333333 0.456847 Zn\n0.666667 0.333333 0.043153 Zn\n0.333333 0.666667 0.543153 Zn\n0.666667 0.333333 0.750000 Cu\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.576332 P\n0.333333 0.666667 0.423669 P\n0.333333 0.666667 0.750000 P\n0.666667 0.333333 0.923669 P\n0.333333 0.666667 0.076331 P\n0.666667 0.333333 0.250000 P\n",
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"structure_string": "Li4 Fe3 Co1 O8\n1.0\n5.070396 -0.005557 0.003128\n-0.031055 5.460676 -0.001055\n-0.013624 -0.028888 6.363736\nLi Fe Co O\n4 3 1 8\ndirect\n0.994292 0.083994 0.625880 Li\n0.498934 0.418462 0.123279 Li\n0.994707 0.582287 0.876617 Li\n0.499045 0.915814 0.374612 Li\n0.004677 0.082431 0.122781 Fe\n0.495901 0.414932 0.629761 Fe\n0.998091 0.583444 0.375806 Fe\n0.502989 0.914787 0.870720 Co\n0.366432 0.069497 0.110125 O\n0.390540 0.091780 0.638735 O\n0.885703 0.412017 0.129643 O\n0.874527 0.423110 0.621010 O\n0.374991 0.573065 0.381582 O\n0.390229 0.592215 0.862739 O\n0.887138 0.915174 0.368865 O\n0.868208 0.926989 0.887849 O\n",
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{
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"updated_at": "2022-09-04T14:38:14.672663Z",
"structure_string": "V2 Sb4 O10\n1.0\n4.682554 0.000000 -1.247466\n-0.110344 5.488084 -0.414191\n-0.044339 0.100502 9.245638\nV Sb O\n2 4 10\ndirect\n0.635293 0.250000 -0.000000 V\n0.364707 0.750000 -0.000000 V\n0.112873 0.341034 0.677023 Sb\n0.435851 0.158965 0.322977 Sb\n0.887126 0.658965 0.322977 Sb\n0.564149 0.841034 0.677023 Sb\n0.392983 0.153539 0.585080 O\n0.807903 0.346461 0.414920 O\n0.607017 0.846460 0.414920 O\n0.192097 0.653538 0.585080 O\n0.434468 0.484548 0.856939 O\n0.577528 0.015452 0.143061 O\n0.028414 0.750000 0.000000 O\n0.971586 0.250000 -0.000000 O\n0.422472 0.984547 0.856939 O\n0.565533 0.515451 0.143061 O\n",
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{
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"created_at": "2022-09-04T14:38:14.749412Z",
"updated_at": "2022-09-04T14:38:14.749437Z",
"structure_string": "Li2 V2 P2 O8 F2\n1.0\n5.174304 -0.020492 0.001662\n-0.740951 5.278286 0.009173\n-2.347359 -2.449414 6.431068\nLi V P O F\n2 2 2 8 2\ndirect\n0.264712 0.616831 0.190076 Li\n0.735287 0.383170 0.809923 Li\n0.000000 0.000000 0.000000 V\n0.000000 0.000000 0.500000 V\n0.320211 0.637742 0.763354 P\n0.679788 0.362260 0.236645 P\n0.313048 0.336805 0.659621 O\n0.686951 0.663197 0.340378 O\n0.370092 0.239610 0.078941 O\n0.754333 0.221741 0.395774 O\n0.629907 0.760392 0.921059 O\n0.245666 0.778261 0.604225 O\n0.120160 0.657367 0.886084 O\n0.879839 0.342635 0.113915 O\n0.134635 0.932841 0.266265 F\n0.865364 0.067161 0.733734 F\n",
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{
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"structure_string": "Sr4 Si4 N8\n1.0\n0.000000 5.539043 0.010519\n7.344466 0.000000 0.000000\n0.000000 -2.317197 -5.509421\nSr Si N\n4 4 8\ndirect\n0.323525 0.074274 0.660227 Sr\n0.176474 0.574275 0.339773 Sr\n0.676474 0.925726 0.339773 Sr\n0.823525 0.425726 0.660227 Sr\n0.930345 0.858121 0.892993 Si\n0.069653 0.141879 0.107007 Si\n0.569653 0.358121 0.107007 Si\n0.430346 0.641880 0.892993 Si\n0.111062 0.720308 0.783284 N\n0.388937 0.220308 0.216715 N\n0.888937 0.279693 0.216715 N\n0.611062 0.779693 0.783284 N\n0.919332 0.088463 0.791311 N\n0.419332 0.411537 0.791311 N\n0.080667 0.911538 0.208689 N\n0.580666 0.588463 0.208689 N\n",
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{
"id": "jvasp-45242",
"created_at": "2022-09-04T14:38:04.495542Z",
"updated_at": "2022-09-04T14:38:04.495563Z",
"structure_string": "Li4 V4 O8\n1.0\n0.000000 4.090868 4.090868\n4.008845 -0.178484 4.269352\n4.008845 4.269352 -0.178484\nLi V O\n4 4 8\ndirect\n0.197103 0.052897 0.052897 Li\n0.000000 0.499999 0.000000 Li\n0.000000 0.000000 0.499999 Li\n0.802899 0.947102 0.947102 Li\n0.500001 0.499999 0.000000 V\n0.500001 0.499999 0.499999 V\n0.000001 0.499999 0.499999 V\n0.500001 0.000000 0.499999 V\n0.266473 0.244916 0.244916 O\n0.743697 0.244916 0.244916 O\n0.250118 0.281581 0.718183 O\n0.250118 0.718183 0.281581 O\n0.749884 0.718418 0.281816 O\n0.749884 0.281816 0.718418 O\n0.256305 0.755083 0.755083 O\n0.733529 0.755083 0.755083 O\n",
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"formula_full": "Li4 V4 O8",
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{
"id": "jvasp-12586",
"created_at": "2022-09-04T14:38:05.355568Z",
"updated_at": "2022-09-04T14:38:05.355588Z",
"structure_string": "P4 H4 F8\n1.0\n4.403690 0.000000 0.000000\n0.000000 6.255547 0.000000\n0.000000 0.000000 7.669685\nP H F\n4 4 8\ndirect\n0.716918 0.406786 0.924456 P\n0.216918 0.093214 0.075543 P\n0.283082 0.906786 0.575543 P\n0.783082 0.593214 0.424456 P\n0.507841 0.554788 0.000475 H\n0.007841 0.945212 -0.000475 H\n0.492159 0.054788 0.499525 H\n0.992159 0.445212 0.500475 H\n0.964752 0.625119 0.241889 F\n0.464752 0.874881 0.758111 F\n0.035248 0.125119 0.258111 F\n0.535248 0.374881 0.741888 F\n0.545738 0.414546 0.351028 F\n0.045738 0.085454 0.648971 F\n0.454262 0.914547 0.148972 F\n0.954262 0.585454 0.851028 F\n",
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{
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"created_at": "2022-09-04T14:38:06.143588Z",
"updated_at": "2022-09-04T14:38:06.143609Z",
"structure_string": "Li4 Ga4 Se8\n1.0\n6.615319 0.000000 0.000000\n0.000000 6.909057 0.000000\n0.000000 0.000000 8.238141\nLi Ga Se\n4 4 8\ndirect\n0.120287 0.911983 0.622022 Li\n0.620287 0.088017 0.377978 Li\n0.620287 0.588017 0.122022 Li\n0.120287 0.411983 0.877978 Li\n0.622584 0.574566 0.625934 Ga\n0.122584 0.425434 0.374065 Ga\n0.122584 0.925435 0.125934 Ga\n0.622584 0.074566 0.874065 Ga\n0.502953 0.908937 0.631127 Se\n0.002953 0.091063 0.368873 Se\n0.002953 0.591064 0.131127 Se\n0.502953 0.408937 0.868872 Se\n0.992176 0.069713 0.878454 Se\n0.492176 0.930287 0.121546 Se\n0.492176 0.430287 0.378454 Se\n0.992176 0.569713 0.621546 Se\n",
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{
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"created_at": "2022-09-04T14:38:12.570516Z",
"updated_at": "2022-09-04T14:38:12.570532Z",
"structure_string": "Li6 Bi2 O8\n1.0\n0.000000 5.207343 -0.072786\n6.359369 0.000000 0.000000\n0.000000 -1.650728 -5.064245\nLi Bi O\n6 2 8\ndirect\n-0.000001 0.612395 0.749999 Li\n-0.000000 0.387605 0.250000 Li\n0.499999 0.842461 0.750000 Li\n0.499999 0.433234 0.750000 Li\n0.500000 0.566766 0.250000 Li\n0.500000 0.157539 0.250000 Li\n-0.000001 0.150711 0.749999 Bi\n-0.000000 0.849289 0.250000 Bi\n0.252673 0.375536 0.985850 O\n0.238905 0.108138 0.482501 O\n0.252673 0.624464 0.485850 O\n0.238904 0.891863 0.982500 O\n0.747326 0.375536 0.514149 O\n0.761094 0.891863 0.517499 O\n0.747326 0.624464 0.014150 O\n0.761095 0.108138 0.017499 O\n",
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{
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"created_at": "2022-09-04T14:38:13.403645Z",
"updated_at": "2022-09-04T14:38:13.403676Z",
"structure_string": "Ti2 Bi4 O10\n1.0\n0.000000 5.630243 0.000000\n-7.910049 2.815121 -0.000872\n-0.000652 0.000000 5.527545\nTi Bi O\n2 4 10\ndirect\n0.314167 0.996631 0.736213 Ti\n0.689201 0.996631 0.236213 Ti\n0.956745 0.657375 0.756199 Bi\n0.385880 0.657376 0.256199 Bi\n0.617496 0.335885 0.756200 Bi\n0.046619 0.335885 0.256200 Bi\n0.254165 0.805489 0.658882 O\n0.940344 0.805489 0.158882 O\n0.242995 0.491559 0.485196 O\n0.265446 0.491559 0.985195 O\n0.760374 0.501699 0.985198 O\n0.737927 0.501699 0.485199 O\n0.063022 0.187770 0.658882 O\n0.749208 0.187770 0.158883 O\n0.599350 0.996633 0.563417 O\n0.404017 0.996633 0.063417 O\n",
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{
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"created_at": "2022-09-04T14:38:13.277632Z",
"updated_at": "2022-09-04T14:38:13.277658Z",
"structure_string": "Li3 Ti1 Cu4 O8\n1.0\n-0.280048 2.907168 -5.625562\n1.363174 -2.582986 -5.625562\n-5.077882 1.471160 -3.101741\nLi Ti Cu O\n3 1 4 8\ndirect\n0.000000 -0.000000 0.500000 Li\n0.500000 -0.000000 0.500000 Li\n0.499999 0.500000 0.500000 Li\n0.499999 0.500000 0.000001 Ti\n-0.000001 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 -0.000000 0.000000 Cu\n-0.000001 0.500000 0.000001 Cu\n0.471910 0.286804 0.814896 O\n0.989549 0.238252 0.714859 O\n0.523394 0.704408 0.714859 O\n0.966057 0.795018 0.828960 O\n0.033942 0.204982 0.171040 O\n0.476604 0.295592 0.285142 O\n0.010450 0.761748 0.285142 O\n0.528089 0.713195 0.185105 O\n",
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{
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"created_at": "2022-09-04T14:38:11.053355Z",
"updated_at": "2022-09-04T14:38:11.053378Z",
"structure_string": "Rb2 Pb4 Br10\n1.0\n7.565556 0.000000 -3.796652\n-1.905289 7.321716 -3.796652\n-0.041312 -0.053439 9.353913\nRb Pb Br\n2 4 10\ndirect\n0.250000 0.250000 0.500000 Rb\n0.750001 0.750000 0.500001 Rb\n0.336743 0.163257 0.000000 Pb\n0.163257 0.663257 0.000000 Pb\n0.663257 0.836744 0.000001 Pb\n0.836744 0.336743 0.000001 Pb\n0.208721 0.708721 0.724519 Br\n0.484203 0.984204 0.275482 Br\n0.000000 0.000000 0.000000 Br\n0.500000 0.500000 0.000000 Br\n0.791279 0.291279 0.275481 Br\n0.984204 0.791279 0.275482 Br\n0.291279 0.484203 0.275481 Br\n0.015797 0.208721 0.724519 Br\n0.515797 0.015797 0.724519 Br\n0.708722 0.515797 0.724520 Br\n",
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}
]
}