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{
"id": "jvasp-107504",
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"structure_string": "Fe3 Co1 N1\n1.0\n3.739332 0.000000 0.000000\n0.000000 3.739332 0.000000\n0.000000 0.000000 3.739332\nFe Co N\n3 1 1\ndirect\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 N\n",
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{
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"structure_string": "Li2 V2 Ni2 O8\n1.0\n4.668330 0.000000 2.028107\n-0.000000 6.159700 0.000000\n-0.003284 -0.000000 5.089843\nLi V Ni O\n2 2 2 8\ndirect\n0.335428 0.750000 0.335427 Li\n0.664573 0.250000 0.664572 Li\n0.352307 0.250000 0.352306 V\n0.647694 0.750000 0.647693 V\n0.000000 0.500000 -0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.234783 0.025708 0.234783 O\n0.234783 0.474292 0.234783 O\n0.765218 0.974292 0.765217 O\n0.765218 0.525708 0.765217 O\n0.731904 0.250000 0.233935 O\n0.766066 0.750000 0.268097 O\n0.233935 0.250000 0.731903 O\n0.268098 0.750000 0.766065 O\n",
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{
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"updated_at": "2022-09-04T14:35:59.822465Z",
"structure_string": "Li8 Mn2 O4 F4\n1.0\n4.066266 3.516193 -0.000000\n-4.066266 3.516193 -0.000000\n0.000000 0.000000 6.582743\nLi Mn O F\n8 2 4 4\ndirect\n0.165838 0.834161 0.500000 Li\n0.165838 0.834161 0.000000 Li\n0.579755 0.895507 0.250000 Li\n0.104492 0.420244 0.750000 Li\n0.420244 0.104492 0.750000 Li\n0.895507 0.579755 0.250000 Li\n0.834161 0.165838 0.000000 Li\n0.834161 0.165838 0.500000 Li\n0.382382 0.382382 0.250000 Mn\n0.617617 0.617617 0.750000 Mn\n0.252324 0.697357 0.250000 O\n0.302642 0.747675 0.750000 O\n0.747675 0.302642 0.750000 O\n0.697357 0.252324 0.250000 O\n0.799920 0.799920 0.029549 F\n0.200079 0.200079 0.529549 F\n0.799920 0.799920 0.470451 F\n0.200079 0.200079 0.970451 F\n",
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"formula_full": "Li8 Mn2 O4 F4",
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{
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"structure_string": "Si1 Pb1 O3\n1.0\n3.739414 0.000000 0.000000\n0.000000 3.739414 0.000000\n-0.000000 -0.000000 3.739414\nSi Pb O\n1 1 3\ndirect\n0.499999 0.499999 0.499999 Si\n0.000000 0.000000 0.000000 Pb\n0.499999 0.499999 0.000000 O\n0.499999 0.000000 0.499999 O\n0.000000 0.499999 0.499999 O\n",
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{
"id": "jvasp-31654",
"created_at": "2022-09-04T14:37:08.017911Z",
"updated_at": "2022-09-04T14:37:08.017935Z",
"structure_string": "Li16 Ta4 N12\n1.0\n4.699694 -0.000000 1.345393\n1.504069 7.996149 3.627148\n-0.007761 0.011190 8.908235\nLi Ta N\n16 4 12\ndirect\n0.840530 0.250000 0.250000 Li\n0.159469 0.750000 0.750000 Li\n0.340530 0.250000 0.250000 Li\n0.225566 0.524434 0.024434 Li\n0.274434 0.975566 0.475566 Li\n0.774433 0.475566 0.975566 Li\n0.725565 0.024434 0.524434 Li\n0.560843 0.949769 0.879572 Li\n0.890183 0.550231 0.620429 Li\n0.939156 0.120429 0.050231 Li\n0.609816 0.379572 0.449769 Li\n0.439157 0.050231 0.120429 Li\n0.109817 0.449769 0.379572 Li\n0.060843 0.879572 0.949770 Li\n0.390183 0.620429 0.550231 Li\n0.659469 0.750000 0.750000 Li\n0.919105 0.830894 0.330894 Ta\n0.419106 0.330894 0.830894 Ta\n0.080894 0.169106 0.669106 Ta\n0.580894 0.669106 0.169106 Ta\n0.520256 0.539737 0.788674 N\n0.348667 0.960264 0.711327 N\n0.020257 0.788674 0.539737 N\n0.848666 0.711327 0.960264 N\n0.479743 0.460263 0.211327 N\n0.651333 0.039737 0.288674 N\n0.749999 0.131791 0.868209 N\n0.250000 0.368209 0.631792 N\n0.250000 0.868209 0.131791 N\n0.749999 0.631791 0.368209 N\n0.151333 0.288674 0.039737 N\n0.979742 0.211327 0.460263 N\n",
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{
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"updated_at": "2022-09-04T14:35:59.869069Z",
"structure_string": "Li2 Cr2 P4 O14\n1.0\n3.210634 4.099120 -0.012891\n-3.210634 4.099120 0.012891\n-1.918991 0.000000 8.749491\nLi Cr P O\n2 2 4 14\ndirect\n0.697326 0.698010 0.000176 Li\n0.301990 0.302674 0.500176 Li\n0.675987 0.675885 0.499998 Cr\n0.324115 0.324013 -0.000002 Cr\n0.216101 0.772720 0.702926 P\n0.227280 0.783900 0.202926 P\n0.783867 0.227059 0.797036 P\n0.772941 0.216133 0.297036 P\n0.617396 0.379366 0.141526 O\n0.948074 0.378252 0.888895 O\n0.607363 0.096659 0.890933 O\n0.620634 0.382604 0.641526 O\n0.000397 0.000530 0.249853 O\n0.999470 0.999603 0.749853 O\n0.379324 0.617566 0.858527 O\n0.379012 0.947585 0.111088 O\n0.096455 0.607668 0.109040 O\n0.903341 0.392637 0.390933 O\n0.052415 0.620988 0.611088 O\n0.392332 0.903545 0.609040 O\n0.382434 0.620676 0.358527 O\n0.621749 0.051926 0.388895 O\n",
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{
"id": "jvasp-120451",
"created_at": "2022-09-04T14:38:38.052101Z",
"updated_at": "2022-09-04T14:38:38.052110Z",
"structure_string": "Ag4 Te2 H8 O12\n1.0\n9.724212 0.040434 3.632690\n8.297594 5.086616 1.892416\n-0.008393 0.029688 5.525106\nAg Te H O\n4 2 8 12\ndirect\n0.666919 0.178121 0.874296 Ag\n0.874295 0.280664 0.666920 Ag\n0.071878 0.583082 0.969337 Ag\n0.969335 0.375705 0.071879 Ag\n0.245083 0.754916 0.245085 Te\n0.495084 0.004916 0.495084 Te\n0.447293 0.791059 0.443320 H\n0.458940 0.802707 0.931673 H\n0.931671 0.806682 0.458942 H\n0.443318 0.318329 0.447295 H\n0.501278 0.017863 0.024088 H\n0.793228 0.225912 0.232137 H\n0.232136 0.748723 0.793229 H\n0.024088 0.456772 0.501279 H\n0.387972 0.279933 0.593593 O\n0.525840 0.387476 0.253884 O\n0.253883 0.832801 0.525841 O\n0.862523 0.724160 0.417201 O\n0.417200 -0.003884 0.862524 O\n0.206761 0.700453 0.963496 O\n0.963495 0.129291 0.206762 O\n0.549548 0.043238 0.120708 O\n0.120708 0.286506 0.549548 O\n0.970067 0.862028 0.511498 O\n0.511496 0.656409 0.970069 O\n0.593591 0.738503 0.387974 O\n",
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{
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"created_at": "2022-09-04T14:36:20.905743Z",
"updated_at": "2022-09-04T14:36:20.905761Z",
"structure_string": "Li1 Mn2 Cr2 O8\n1.0\n5.681711 -0.009138 0.021528\n2.784026 5.029800 -0.009345\n2.760759 1.672450 4.757471\nLi Mn Cr O\n1 2 2 8\ndirect\n0.500001 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.500000 -0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Cr\n0.000001 0.500000 -0.000001 Cr\n0.240269 0.788651 0.235824 O\n0.760374 0.767370 0.767363 O\n0.790005 0.234735 0.234762 O\n0.759714 0.764178 0.211355 O\n0.240287 0.235822 0.788644 O\n0.209996 0.765264 0.765237 O\n0.239627 0.232630 0.232636 O\n0.759733 0.211349 0.764175 O\n",
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{
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"created_at": "2022-09-04T14:37:14.344823Z",
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"structure_string": "O4\n1.0\n-1.249180 -2.163637 -0.000000\n-1.249180 2.163637 0.000000\n0.000000 0.000000 -7.739838\nO\n4\ndirect\n0.666694 0.333306 0.670588 O\n0.333306 0.666694 0.329412 O\n0.333306 0.666694 0.170588 O\n0.666694 0.333306 0.829412 O\n",
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{
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"structure_string": "Mn1 Be2 Zn1\n1.0\n2.697038 0.000000 0.000000\n0.000000 2.697038 -0.000000\n0.000000 0.000000 5.751844\nMn Be Zn\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.769439 Be\n0.000000 0.000000 0.230561 Be\n0.500000 0.500000 0.500000 Zn\n",
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{
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"created_at": "2022-09-04T14:37:30.928382Z",
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"structure_string": "Li2 Mg1 Cu2 Si4 O12\n1.0\n5.234538 0.029784 -0.003597\n0.741723 5.701410 0.025720\n1.293021 0.601136 7.367845\nLi Mg Cu Si O\n2 1 2 4 12\ndirect\n0.918230 0.756796 0.413585 Li\n0.081769 0.243204 0.586416 Li\n0.000000 0.000000 0.000000 Mg\n0.494240 0.835232 0.183604 Cu\n0.505759 0.164768 0.816396 Cu\n0.304037 0.774445 0.626587 Si\n0.784539 0.585960 0.815878 Si\n0.215460 0.414040 0.184123 Si\n0.695963 0.225555 0.373414 Si\n0.401406 0.355704 0.348542 O\n0.761480 0.319671 0.907958 O\n0.914105 0.420059 0.306862 O\n0.085894 0.579941 0.693138 O\n0.238520 0.680329 0.092042 O\n0.770930 -0.000316 0.249971 O\n0.269600 0.859616 0.418872 O\n0.737172 0.797301 0.949363 O\n0.730400 0.140384 0.581128 O\n0.229070 0.000316 0.750029 O\n0.598594 0.644296 0.651458 O\n0.262827 0.202699 0.050637 O\n",
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{
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"created_at": "2022-09-04T14:38:02.509845Z",
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"structure_string": "Mg2 V3 O8\n1.0\n4.566973 -0.046204 -1.512195\n-0.843268 5.011850 -2.699884\n-0.110809 -0.073183 6.032191\nMg V O\n2 3 8\ndirect\n0.665762 0.733389 0.466774 Mg\n0.334236 0.266614 0.533227 Mg\n0.499999 0.999999 0.000001 V\n0.999998 0.710499 0.000001 V\n0.999998 0.289503 0.000001 V\n0.083084 0.385160 0.770321 O\n0.916915 0.614841 0.229681 O\n0.090660 0.895940 0.791880 O\n0.909339 0.104060 0.208121 O\n0.399847 0.346512 0.230356 O\n0.399847 0.883844 0.230357 O\n0.600153 0.116156 0.769645 O\n0.600152 0.653489 0.769645 O\n",
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}
]
}