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{
"id": "jvasp-111659",
"created_at": "2022-09-04T14:38:50.682525Z",
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{
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"structure_string": "Mn6 Co4 O16\n1.0\n4.870125 -0.000000 0.000000\n0.000000 5.691503 0.000000\n-0.000000 -0.000000 9.153440\nMn Co O\n6 4 16\ndirect\n0.176433 0.761814 0.002214 Mn\n0.823566 0.738186 0.502214 Mn\n0.823566 0.261814 0.502214 Mn\n0.176433 0.238186 0.002214 Mn\n0.687609 0.500000 0.997805 Mn\n0.312390 0.000000 0.497805 Mn\n0.680973 0.000000 0.810815 Co\n0.319026 0.500000 0.310815 Co\n0.679871 0.000000 0.212016 Co\n0.320128 0.500000 0.712016 Co\n0.335289 0.000000 0.111453 O\n0.025738 0.500000 0.888272 O\n0.974261 0.000000 0.388272 O\n0.643558 0.000000 0.609558 O\n0.356441 0.500000 0.109558 O\n0.664710 0.500000 0.611453 O\n0.501407 0.772195 0.372849 O\n0.146526 0.758679 0.611477 O\n0.498592 0.272195 0.872849 O\n0.501407 0.227804 0.372849 O\n0.853473 0.741320 0.111477 O\n0.977280 0.500000 0.388906 O\n0.146526 0.241321 0.611477 O\n0.853473 0.258679 0.111477 O\n0.498592 0.727804 0.872849 O\n0.022719 0.000000 0.888906 O\n",
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{
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"created_at": "2022-09-04T14:36:16.934574Z",
"updated_at": "2022-09-04T14:36:16.934599Z",
"structure_string": "Li2 Fe3 F8\n1.0\n5.181737 -0.129968 0.195482\n-2.694363 5.216424 -0.072880\n0.156867 -1.925444 5.393432\nLi Fe F\n2 3 8\ndirect\n0.588160 0.095792 0.756338 Li\n0.411841 0.904207 0.243661 Li\n0.000000 0.000000 0.000000 Fe\n0.720259 0.522337 0.385526 Fe\n0.279742 0.477662 0.614473 Fe\n0.458502 0.221170 0.068588 F\n0.468690 0.224480 0.548993 F\n0.038822 0.724006 0.685511 F\n0.005606 0.765747 0.190839 F\n0.994396 0.234252 0.809161 F\n0.961179 0.275993 0.314488 F\n0.531311 0.775519 0.451006 F\n0.541499 0.778829 0.931411 F\n",
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{
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"created_at": "2022-09-04T14:36:38.753459Z",
"updated_at": "2022-09-04T14:36:38.753486Z",
"structure_string": "Ag3 As2 O8\n1.0\n5.873759 0.134291 0.134291\n0.134291 5.873759 0.134291\n0.134291 0.134291 5.873759\nAg As O\n3 2 8\ndirect\n0.488068 0.745402 0.003810 Ag\n0.745402 0.003810 0.488068 Ag\n0.003810 0.488068 0.745402 Ag\n0.997984 0.997984 0.997984 As\n0.501445 0.501445 0.501445 As\n0.159932 0.785037 0.851881 O\n0.154087 0.154087 0.154087 O\n0.345645 0.342249 0.698203 O\n0.342249 0.698203 0.345645 O\n0.698203 0.345645 0.342249 O\n0.676257 0.676257 0.676257 O\n0.851881 0.159932 0.785037 O\n0.785037 0.851881 0.159932 O\n",
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{
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"structure_string": "Zn6 P4 O16\n1.0\n0.000000 4.930331 0.039510\n9.314353 0.000000 0.000000\n0.000000 -4.899345 -6.524862\nZn P O\n6 4 16\ndirect\n0.832547 0.370621 0.840851 Zn\n0.167451 0.870621 0.659149 Zn\n0.167452 0.629379 0.159149 Zn\n0.832548 0.129379 0.340851 Zn\n0.000000 0.000000 0.000000 Zn\n-0.000001 0.500000 0.500000 Zn\n0.661641 0.816286 0.160649 P\n0.338358 0.316287 0.339351 P\n0.661641 0.683713 0.660649 P\n0.338357 0.183713 0.839351 P\n0.941221 0.678134 0.626899 O\n0.680680 0.120972 0.031668 O\n0.319319 0.620972 0.468331 O\n0.941222 0.821865 0.126899 O\n0.058777 0.321865 0.373101 O\n0.058776 0.178135 0.873101 O\n0.779769 0.912671 0.348248 O\n0.395209 0.159791 0.304556 O\n0.220230 0.087328 0.651752 O\n0.779768 0.587328 0.848248 O\n0.604790 0.659791 0.195444 O\n0.680679 0.379027 0.531668 O\n0.395209 0.340209 0.804556 O\n0.604789 0.840209 0.695444 O\n0.220230 0.412671 0.151752 O\n0.319319 0.879027 0.968331 O\n",
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{
"id": "jvasp-11279",
"created_at": "2022-09-04T14:37:34.093159Z",
"updated_at": "2022-09-04T14:37:34.093186Z",
"structure_string": "Zn2 Cr3 O8\n1.0\n4.553395 -0.318743 -2.013874\n-0.858418 5.101898 -2.748393\n-0.610477 -0.022720 6.392132\nZn Cr O\n2 3 8\ndirect\n0.725935 0.688157 0.376312 Zn\n0.274062 0.311845 0.623689 Zn\n0.499999 1.000000 0.000001 Cr\n0.999998 0.738007 0.000001 Cr\n0.999998 0.261995 0.000001 Cr\n-0.004166 0.389618 0.779235 O\n0.004165 0.610381 0.220765 O\n0.028841 0.891265 0.782530 O\n0.971157 0.108735 0.217470 O\n0.448376 0.334164 0.205816 O\n0.448376 0.871652 0.205816 O\n0.551624 0.128348 0.794185 O\n0.551624 0.665836 0.794185 O\n",
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"formula_full": "Zn2 Cr3 O8",
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{
"id": "jvasp-57164",
"created_at": "2022-09-04T14:37:34.287667Z",
"updated_at": "2022-09-04T14:37:34.287685Z",
"structure_string": "Ba3 P2 S8\n1.0\n6.660362 -0.013545 -0.000192\n-3.318462 5.774810 0.000192\n-0.000198 0.000116 8.730165\nBa P S\n3 2 8\ndirect\n0.333316 0.666684 0.369250 Ba\n0.666684 0.333316 0.630750 Ba\n0.000000 0.000000 0.000000 Ba\n0.666652 0.333347 0.216928 P\n0.333348 0.666653 0.783071 P\n0.831200 0.662443 0.308249 S\n0.168799 0.337556 0.691751 S\n0.662444 0.831201 0.691751 S\n0.333357 0.666642 0.014843 S\n0.666642 0.333358 0.985157 S\n0.337556 0.168799 0.308249 S\n0.831204 0.168795 0.308251 S\n0.168796 0.831205 0.691749 S\n",
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"volume": 335.39003553591755,
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{
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"created_at": "2022-09-04T14:37:57.419953Z",
"updated_at": "2022-09-04T14:37:57.419986Z",
"structure_string": "Ca3 P2 O8\n1.0\n4.869789 -0.006378 4.932160\n2.020479 4.430864 4.932160\n-0.009932 -0.006378 6.931158\nCa P O\n3 2 8\ndirect\n0.000000 0.000000 0.000000 Ca\n0.202655 0.202655 0.202655 Ca\n0.797346 0.797343 0.797345 Ca\n0.404979 0.404978 0.404979 P\n0.595022 0.595021 0.595022 P\n0.727440 0.727438 0.246175 O\n0.727440 0.246174 0.727439 O\n0.246175 0.727438 0.727439 O\n0.753826 0.272561 0.272561 O\n0.272562 0.272561 0.753826 O\n0.322900 0.322899 0.322899 O\n0.677102 0.677100 0.677101 O\n0.272562 0.753825 0.272561 O\n",
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{
"id": "jvasp-30638",
"created_at": "2022-09-04T14:37:28.855334Z",
"updated_at": "2022-09-04T14:37:28.855355Z",
"structure_string": "Mg2 Sn3 O8\n1.0\n5.294272 0.296739 -1.102744\n-0.906675 5.388699 -2.902893\n0.327890 -0.323726 5.891264\nMg Sn O\n2 3 8\ndirect\n0.576609 0.704629 0.409258 Mg\n0.423392 0.295372 0.590744 Mg\n0.500000 0.999999 0.000001 Sn\n0.000001 0.742200 0.999998 Sn\n0.000000 0.257798 0.999998 Sn\n0.134968 0.394014 0.788030 O\n0.865031 0.605985 0.211971 O\n0.136004 0.893812 0.787623 O\n0.863996 0.106188 0.212376 O\n0.362566 0.352706 0.250430 O\n0.362567 0.897724 0.250430 O\n0.637433 0.102275 0.749570 O\n0.637433 0.647294 0.749571 O\n",
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{
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"structure_string": "Mg2 Mo3 O8\n1.0\n4.644040 0.005002 -1.441210\n-0.833481 4.953680 -2.668548\n0.036186 0.088808 6.215798\nMg Mo O\n2 3 8\ndirect\n0.665531 0.734407 0.468812 Mg\n0.334469 0.265594 0.531188 Mg\n0.500000 0.999999 -0.000000 Mo\n0.999999 0.723778 -0.000000 Mo\n0.999999 0.276221 -0.000000 Mo\n0.097411 0.383354 0.766710 O\n0.902590 0.616645 0.233290 O\n0.060865 0.883844 0.767689 O\n0.939136 0.116155 0.232310 O\n0.417504 0.362173 0.239330 O\n0.417504 0.877156 0.239329 O\n0.582498 0.122843 0.760671 O\n0.582498 0.637827 0.760671 O\n",
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{
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"updated_at": "2022-09-04T14:37:07.011623Z",
"structure_string": "Ca2 Ni3 O8\n1.0\n4.725916 0.010668 -1.456266\n-0.852841 5.068741 -2.730532\n0.002476 -0.016602 6.171466\nCa Ni O\n2 3 8\ndirect\n0.664709 0.722138 0.444276 Ca\n0.335292 0.277863 0.555725 Ca\n0.500001 0.999999 0.000000 Ni\n1.000000 0.747530 -0.000000 Ni\n1.000000 0.252471 -0.000000 Ni\n0.035764 0.397270 0.794542 O\n0.964238 0.602729 0.205459 O\n0.099337 0.905102 0.810206 O\n0.900664 0.094897 0.189794 O\n0.389253 0.322335 0.199571 O\n0.389253 0.877236 0.199571 O\n0.610750 0.122763 0.800430 O\n0.610750 0.677666 0.800430 O\n",
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{
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"created_at": "2022-09-04T14:37:28.443842Z",
"updated_at": "2022-09-04T14:37:28.443863Z",
"structure_string": "Mg6 P4 O16\n1.0\n0.000000 5.918580 0.031073\n4.765563 0.000000 0.000000\n0.000000 -0.112217 -10.248971\nMg P O\n6 4 16\ndirect\n0.761567 0.513361 0.223156 Mg\n0.238433 0.013361 0.276844 Mg\n0.761567 0.986638 0.723156 Mg\n0.500000 0.000000 0.000000 Mg\n0.238432 0.486638 0.776844 Mg\n0.500000 0.500000 0.500000 Mg\n0.254703 0.575579 0.096414 P\n0.745297 0.075580 0.403587 P\n0.254703 0.924420 0.596414 P\n0.745297 0.424420 0.903587 P\n0.744292 0.188302 0.545222 O\n0.467482 0.769189 0.661455 O\n0.467482 0.730810 0.161455 O\n0.274092 0.245375 0.603587 O\n0.532517 0.269190 0.838546 O\n0.942593 0.192153 0.323664 O\n0.744292 0.311698 0.045222 O\n0.274092 0.254624 0.103587 O\n0.057407 0.692153 0.176336 O\n0.057406 0.807846 0.676336 O\n0.532518 0.230810 0.338546 O\n0.725907 0.754624 0.396413 O\n0.255708 0.688302 0.954778 O\n0.725907 0.745375 0.896413 O\n0.942593 0.307846 0.823664 O\n0.255708 0.811698 0.454778 O\n",
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}
]
}