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{
"id": "jvasp-94745",
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"structure_string": "Ca1 Mg6 Mn1\n1.0\n6.567028 -0.065638 0.000000\n-3.340357 5.654393 0.000000\n0.000000 0.000000 5.060394\nCa Mg Mn\n1 6 1\ndirect\n0.176786 0.323214 0.250000 Ca\n0.177903 0.840501 0.250000 Mg\n0.659498 0.322096 0.250000 Mg\n0.662868 0.837130 0.250000 Mg\n0.330612 0.682386 0.749999 Mg\n0.817613 0.169388 0.749999 Mg\n0.828384 0.671615 0.749999 Mg\n0.346333 0.153667 0.749999 Mn\n",
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{
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"structure_string": "Mg6 Ti1 Ni1\n1.0\n6.248836 -0.142753 0.000000\n-3.248046 5.340274 0.000000\n0.000000 0.000000 4.737939\nMg Ti Ni\n6 1 1\ndirect\n0.175454 0.844163 0.250000 Mg\n0.655836 0.324545 0.250000 Mg\n0.672451 0.827549 0.250000 Mg\n0.319758 0.663778 0.750000 Mg\n0.836223 0.180241 0.750000 Mg\n0.832990 0.667010 0.750000 Mg\n0.308668 0.191332 0.750000 Ti\n0.198620 0.301380 0.250000 Ni\n",
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{
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"structure_string": "V6 O9 F3\n1.0\n4.654419 -0.135322 -0.000000\n-0.135322 4.654419 0.000000\n-0.000000 0.000000 8.742761\nV O F\n6 9 3\ndirect\n-0.000738 0.000738 0.998539 V\n-0.000738 0.000738 0.334794 V\n0.021838 0.978162 0.666667 V\n0.538032 0.461969 0.166667 V\n0.472417 0.527584 0.832152 V\n0.472417 0.527584 0.501182 V\n0.807174 0.192827 0.166667 O\n0.697831 0.706306 0.666667 O\n0.700439 0.697038 0.332700 O\n0.700439 0.697038 0.000634 O\n0.302963 0.299561 0.000634 O\n0.302963 0.299561 0.332700 O\n0.198176 0.801824 0.832094 O\n0.198176 0.801824 0.501239 O\n0.293694 0.302170 0.666667 O\n0.795384 0.204617 0.832228 F\n0.204154 0.795847 0.166667 F\n0.795384 0.204617 0.501105 F\n",
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"formula_full": "V6 O9 F3",
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{
"id": "jvasp-93201",
"created_at": "2022-09-04T14:36:06.528283Z",
"updated_at": "2022-09-04T14:36:06.528310Z",
"structure_string": "Mg6 Ti1 Ga1\n1.0\n6.283662 -0.015895 0.000000\n-3.155597 5.433862 0.000000\n0.000000 0.000000 4.825517\nMg Ti Ga\n6 1 1\ndirect\n0.171864 0.832688 0.250000 Mg\n0.667312 0.328136 0.250000 Mg\n0.667474 0.832526 0.250000 Mg\n0.328886 0.658682 0.750000 Mg\n0.841318 0.171114 0.750000 Mg\n0.830836 0.669165 0.750000 Mg\n0.177586 0.322414 0.250000 Ti\n0.314723 0.185277 0.750000 Ga\n",
"nsites": 8,
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"formula_full": "Mg6 Ti1 Ga1",
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{
"id": "jvasp-92908",
"created_at": "2022-09-04T14:36:06.574604Z",
"updated_at": "2022-09-04T14:36:06.574619Z",
"structure_string": "Mg6 Ga1 Mo1\n1.0\n6.127082 0.145930 0.000000\n-2.937162 5.087313 0.000000\n0.000000 0.000000 4.915442\nMg Ga Mo\n6 1 1\ndirect\n0.656673 0.327307 0.250000 Mg\n0.656673 0.829365 0.250000 Mg\n0.333293 0.177321 0.750000 Mg\n0.333293 0.655973 0.750000 Mg\n0.854880 0.177441 0.750000 Mg\n0.850918 0.675460 0.750000 Mg\n0.161284 0.830641 0.250000 Ga\n0.152984 0.326491 0.250000 Mo\n",
"nsites": 8,
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{
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"created_at": "2022-09-04T14:36:06.629075Z",
"updated_at": "2022-09-04T14:36:06.629112Z",
"structure_string": "Ce1 Mg6 Cr1\n1.0\n6.641941 -0.101735 0.000000\n-3.409075 5.701221 0.000000\n0.000000 0.000000 5.037332\nCe Mg Cr\n1 6 1\ndirect\n0.182968 0.317032 0.250000 Ce\n0.179451 0.831377 0.250000 Mg\n0.668623 0.320549 0.250000 Mg\n0.663301 0.836699 0.250000 Mg\n0.326530 0.679982 0.750000 Mg\n0.820019 0.173471 0.750000 Mg\n0.826951 0.673049 0.750000 Mg\n0.332155 0.167845 0.750000 Cr\n",
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{
"id": "jvasp-93063",
"created_at": "2022-09-04T14:36:06.668359Z",
"updated_at": "2022-09-04T14:36:06.668375Z",
"structure_string": "Hf1 Mg6 Si1\n1.0\n6.168377 0.910097 0.000000\n-2.296021 5.797018 0.000000\n0.000000 0.000000 4.435431\nHf Mg Si\n1 6 1\ndirect\n0.380970 0.119031 0.750000 Hf\n0.108318 0.829539 0.250000 Mg\n0.670462 0.391683 0.250000 Mg\n0.605716 0.894286 0.250000 Mg\n0.315096 0.600385 0.750000 Mg\n0.899616 0.184905 0.750000 Mg\n0.813057 0.686944 0.750000 Mg\n0.206771 0.293229 0.250000 Si\n",
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"spacegroup": 38
},
{
"id": "jvasp-93100",
"created_at": "2022-09-04T14:36:06.724991Z",
"updated_at": "2022-09-04T14:36:06.725023Z",
"structure_string": "Mg6 Nb1 Si1\n1.0\n6.149716 0.220070 0.000000\n-2.884272 4.995705 0.000000\n0.000000 0.000000 5.049085\nMg Nb Si\n6 1 1\ndirect\n0.652856 0.327058 0.250000 Mg\n0.652856 0.825796 0.250000 Mg\n0.339991 0.163111 0.749999 Mg\n0.339991 0.676880 0.749999 Mg\n0.857811 0.178906 0.749999 Mg\n0.848196 0.674097 0.749999 Mg\n0.148303 0.824150 0.250000 Nb\n0.159996 0.329997 0.250000 Si\n",
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{
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"created_at": "2022-09-04T14:36:06.738470Z",
"updated_at": "2022-09-04T14:36:06.738496Z",
"structure_string": "Mg6 Mo1 C1\n1.0\n6.889822 0.677690 0.000000\n-2.858014 4.950225 0.000000\n0.000000 0.000000 4.101205\nMg Mo C\n6 1 1\ndirect\n0.603823 0.301277 0.250000 Mg\n0.603823 0.802544 0.250000 Mg\n0.301410 0.138281 0.750001 Mg\n0.301410 0.663129 0.750001 Mg\n0.852342 0.176172 0.750001 Mg\n0.894074 0.697038 0.750001 Mg\n0.131010 0.315504 0.250000 Mo\n0.312105 0.906051 0.250000 C\n",
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{
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"structure_string": "Mg6 Sn1 B1\n1.0\n6.901114 -0.548733 0.000000\n-3.925774 5.702175 0.000000\n0.000000 0.000000 4.601954\nMg Sn B\n6 1 1\ndirect\n0.170711 0.874088 0.250000 Mg\n0.625911 0.329289 0.250000 Mg\n0.678503 0.821496 0.250000 Mg\n0.319733 0.685645 0.749999 Mg\n0.814355 0.180267 0.749999 Mg\n0.825196 0.674803 0.749999 Mg\n0.147174 0.352826 0.250000 Sn\n0.418418 0.081582 0.749999 B\n",
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{
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"structure_string": "Mg6 Nb1 Ga1\n1.0\n6.229824 0.015191 0.000000\n-3.101755 5.402780 0.000000\n0.000000 0.000000 4.833770\nMg Nb Ga\n6 1 1\ndirect\n0.171551 0.833007 0.250000 Mg\n0.666993 0.328448 0.250000 Mg\n0.667807 0.832192 0.250000 Mg\n0.330463 0.657172 0.750000 Mg\n0.842827 0.169536 0.750000 Mg\n0.833338 0.666661 0.750000 Mg\n0.173508 0.326491 0.250000 Nb\n0.313506 0.186493 0.750000 Ga\n",
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{
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"created_at": "2022-09-04T14:36:07.036737Z",
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"structure_string": "Mg6 Nb1 Cu1\n1.0\n6.254646 0.164619 0.000000\n-2.984760 5.169754 0.000000\n0.000000 0.000000 4.789793\nMg Nb Cu\n6 1 1\ndirect\n0.646485 0.323630 0.250000 Mg\n0.646485 0.822852 0.250000 Mg\n0.332291 0.160550 0.749999 Mg\n0.332291 0.671740 0.749999 Mg\n0.876720 0.188360 0.749999 Mg\n0.843362 0.671681 0.749999 Mg\n0.143465 0.821732 0.250000 Nb\n0.178903 0.339451 0.250000 Cu\n",
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