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{
"id": "jvasp-48822",
"created_at": "2022-09-04T14:35:51.180466Z",
"updated_at": "2022-09-04T14:35:51.180476Z",
"structure_string": "Li2 Mn4 O2 F6\n1.0\n-4.411349 4.411349 -0.000000\n4.417062 0.005713 4.417062\n4.417062 4.417062 0.005713\nLi Mn O F\n2 4 2 6\ndirect\n0.501607 0.003213 0.501607 Li\n0.858042 0.716084 0.858042 Li\n0.503107 0.006212 0.990341 Mn\n0.144923 0.289847 0.144923 Mn\n0.503107 0.493447 0.503107 Mn\n0.990341 0.493447 0.503107 Mn\n0.729255 0.458511 0.729255 O\n0.273618 0.547236 0.273618 O\n0.736856 0.473712 0.250985 F\n0.736856 0.987840 0.736856 F\n0.250984 0.987840 0.736856 F\n0.741756 0.006529 0.264774 F\n0.264774 0.006529 0.264774 F\n0.264773 0.529547 0.741756 F\n",
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{
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"created_at": "2022-09-04T14:38:11.533133Z",
"updated_at": "2022-09-04T14:38:11.533160Z",
"structure_string": "Y1 Sc3 N4\n1.0\n4.219148 0.002142 -3.744362\n-0.851251 4.132383 -3.744362\n-0.001745 -0.002142 5.641051\nY Sc N\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Y\n0.250001 0.750000 0.500001 Sc\n0.500000 0.499999 0.000000 Sc\n0.750001 0.250000 0.500001 Sc\n0.000001 0.500000 0.500000 N\n0.257725 0.257724 0.000000 N\n0.500001 -0.000000 0.500001 N\n0.742276 0.742275 0.000000 N\n",
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"volume": 98.29512077718965,
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"formula_full": "Y1 Sc3 N4",
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"formula_anonymous": "AB3C4",
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{
"id": "jvasp-51455",
"created_at": "2022-09-04T14:36:14.199234Z",
"updated_at": "2022-09-04T14:36:14.199245Z",
"structure_string": "Ti1 Ga1 Fe2\n1.0\n3.560657 0.000082 2.055872\n1.186930 3.357018 2.055928\n0.000067 0.000117 4.111626\nTi Ga Fe\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Ti\n1.000000 -0.000001 -0.000001 Ga\n0.250004 0.250004 0.250005 Fe\n0.749997 0.749996 0.749993 Fe\n",
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{
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"created_at": "2022-09-04T14:36:50.183805Z",
"updated_at": "2022-09-04T14:36:50.183831Z",
"structure_string": "Ti1 Ga1 Fe2\n1.0\n-2.907260 -2.907260 -0.000000\n-2.907260 0.000000 -2.907260\n-0.000000 -2.907260 -2.907260\nTi Ga Fe\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Ga\n0.250000 0.250000 0.250000 Fe\n0.750000 0.750000 0.750000 Fe\n",
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{
"id": "jvasp-35356",
"created_at": "2022-09-04T14:37:29.226051Z",
"updated_at": "2022-09-04T14:37:29.226084Z",
"structure_string": "U1 B2 Rh2 C1\n1.0\n3.784198 -0.000000 -0.000000\n-0.000000 3.784198 -0.000000\n-1.892098 -1.892098 5.147784\nU B Rh C\n1 2 2 1\ndirect\n0.500000 0.500000 0.000000 U\n0.145537 0.145537 0.291074 B\n0.854463 0.854463 0.708925 B\n0.250000 0.750000 0.500000 Rh\n0.750000 0.250000 0.500000 Rh\n0.000000 0.000000 0.000000 C\n",
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{
"id": "jvasp-9976",
"created_at": "2022-09-04T14:37:12.587830Z",
"updated_at": "2022-09-04T14:37:12.587848Z",
"structure_string": "Ba1 Mg1 C2 O6\n1.0\n4.595986 -0.040206 4.212544\n1.828354 4.216851 4.212544\n-0.061843 -0.040206 6.234163\nBa Mg C O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500001 0.499999 0.499999 Mg\n0.759592 0.759589 0.759590 C\n0.240410 0.240409 0.240409 C\n0.051336 0.610448 0.610448 O\n0.610450 0.051334 0.610448 O\n0.389552 0.389550 0.948663 O\n0.948666 0.389550 0.389550 O\n0.389551 0.948663 0.389551 O\n0.610449 0.610448 0.051335 O\n",
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"formula_full": "Ba1 Mg1 C2 O6",
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"spacegroup": 166
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{
"id": "jvasp-59141",
"created_at": "2022-09-04T14:38:17.131052Z",
"updated_at": "2022-09-04T14:38:17.131076Z",
"structure_string": "Ho4 Sc4 O12\n1.0\n5.416119 0.000000 0.000000\n0.000000 5.728096 0.000000\n0.000000 0.000000 7.919764\nHo Sc O\n4 4 12\ndirect\n0.020424 0.935412 0.250000 Ho\n0.520424 0.564589 0.750000 Ho\n0.479576 0.435412 0.250000 Ho\n0.979576 0.064588 0.750000 Ho\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.500000 0.000000 0.500000 Sc\n0.000000 0.500000 0.500000 Sc\n0.810792 0.807326 0.931275 O\n0.310792 0.692675 0.068725 O\n0.310792 0.692675 0.431275 O\n0.810792 0.807326 0.568724 O\n0.189208 0.192675 0.068725 O\n0.367711 0.942277 0.750000 O\n0.132290 0.442277 0.750000 O\n0.632290 0.057723 0.250000 O\n0.189208 0.192675 0.431275 O\n0.867711 0.557724 0.250000 O\n0.689208 0.307325 0.931275 O\n0.689208 0.307325 0.568724 O\n",
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{
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"created_at": "2022-09-04T14:37:38.724488Z",
"updated_at": "2022-09-04T14:37:38.724528Z",
"structure_string": "Co4 Mo4 P4\n1.0\n3.751514 -0.000000 0.000000\n-0.000000 5.824751 0.000000\n0.000000 0.000000 6.746488\nCo Mo P\n4 4 4\ndirect\n0.749999 0.640771 0.432575 Co\n0.250000 0.859228 0.932575 Co\n0.749999 0.140772 0.067425 Co\n0.250000 0.359227 0.567425 Co\n0.250000 0.468159 0.169926 Mo\n0.250000 0.968159 0.330074 Mo\n0.749999 0.031841 0.669926 Mo\n0.749999 0.531841 0.830075 Mo\n0.250000 0.733619 0.619049 P\n0.250000 0.233619 0.880952 P\n0.749999 0.266381 0.380951 P\n0.749999 0.766381 0.119049 P\n",
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{
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"created_at": "2022-09-04T14:37:07.519875Z",
"updated_at": "2022-09-04T14:37:07.519902Z",
"structure_string": "Na2 Sm2 Ti3 O10\n1.0\n3.791221 -0.000000 -0.506109\n-0.067563 3.790618 -0.506109\n0.010201 0.010384 14.529317\nNa Sm Ti O\n2 2 3 10\ndirect\n0.288169 0.288168 0.576338 Na\n0.711831 0.711831 0.423662 Na\n0.424886 0.424885 0.849772 Sm\n0.575115 0.575114 0.150228 Sm\n0.000000 0.000000 0.000000 Ti\n0.146236 0.146236 0.292473 Ti\n0.853765 0.853764 0.707527 Ti\n0.500000 0.000000 -0.000000 O\n0.869244 0.369244 0.738489 O\n0.000000 0.500000 -0.000000 O\n0.208104 0.208104 0.416208 O\n0.791896 0.791896 0.583792 O\n0.630756 0.130756 0.261511 O\n0.130756 0.630756 0.261511 O\n0.369245 0.869243 0.738489 O\n0.067490 0.067490 0.134980 O\n0.932510 0.932509 0.865020 O\n",
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{
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"created_at": "2022-09-04T14:36:31.420395Z",
"updated_at": "2022-09-04T14:36:31.420426Z",
"structure_string": "Sr2 Ta1 Al1 O6\n1.0\n3.954014 0.000000 0.000000\n0.000000 3.954014 -0.000000\n0.000000 -0.000000 7.856860\nSr Ta Al O\n2 1 1 6\ndirect\n0.000000 0.000000 0.716736 Sr\n0.000000 0.000000 0.283264 Sr\n0.499999 0.499999 0.000000 Ta\n0.499999 0.499999 0.500000 Al\n0.499999 0.000000 0.000000 O\n0.499999 0.000000 0.500000 O\n0.000000 0.499999 0.000000 O\n0.000000 0.499999 0.500000 O\n0.499999 0.499999 0.748857 O\n0.499999 0.499999 0.251143 O\n",
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{
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"structure_string": "Cd1 Ir1 O3\n1.0\n3.945439 -0.000000 -0.000000\n-0.000000 3.945439 -0.000000\n0.000000 -0.000000 3.945439\nCd Ir O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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]
}