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{
"id": "jvasp-105613",
"created_at": "2022-09-04T14:35:42.747380Z",
"updated_at": "2022-09-04T14:35:42.747405Z",
"structure_string": "K2 Na1 Au1 Cl6\n1.0\n6.290325 -0.000000 3.631720\n2.096775 5.930574 3.631720\n0.000000 0.000000 7.263441\nK Na Au Cl\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Au\n0.757401 0.242599 0.242599 Cl\n0.242599 0.242599 0.757401 Cl\n0.242599 0.757401 0.757401 Cl\n0.242599 0.757401 0.242599 Cl\n0.757401 0.242599 0.757401 Cl\n0.757401 0.757401 0.242599 Cl\n",
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{
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"structure_string": "Y1 Mg6 Cu1\n1.0\n6.679825 -0.284874 0.000000\n-3.586621 5.642461 0.000000\n0.000000 0.000000 4.874415\nY Mg Cu\n1 6 1\ndirect\n0.195920 0.304080 0.250000 Y\n0.176335 0.823520 0.250000 Mg\n0.676480 0.323666 0.250000 Mg\n0.655033 0.844967 0.250000 Mg\n0.314115 0.682615 0.749999 Mg\n0.817385 0.185886 0.749999 Mg\n0.810465 0.689536 0.749999 Mg\n0.354265 0.145735 0.749999 Cu\n",
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{
"id": "jvasp-88080",
"created_at": "2022-09-04T14:35:44.842419Z",
"updated_at": "2022-09-04T14:35:44.842451Z",
"structure_string": "Ba8 Br12 O2\n1.0\n10.412649 0.000000 0.000000\n-5.206325 9.017619 -0.000000\n0.000000 -0.000000 7.902812\nBa Br O\n8 12 2\ndirect\n0.198366 0.801634 -0.000917 Ba\n0.333333 0.666667 0.420931 Ba\n0.603268 0.801634 -0.000917 Ba\n0.801634 0.198366 0.499083 Ba\n0.396732 0.198366 0.499083 Ba\n0.801634 0.603268 0.499083 Ba\n0.666667 0.333333 0.920930 Ba\n0.198366 0.396732 -0.000917 Ba\n0.940378 0.470189 0.207818 Br\n0.470189 0.529811 0.707818 Br\n0.529811 0.059622 0.207818 Br\n0.141650 0.858349 0.394846 Br\n0.470189 0.940378 0.707818 Br\n0.059621 0.529811 0.707818 Br\n0.141650 0.283301 0.394846 Br\n0.858349 0.716699 0.894846 Br\n0.283301 0.141651 0.894846 Br\n0.529811 0.470189 0.207818 Br\n0.716699 0.858349 0.394846 Br\n0.858349 0.141651 0.894846 Br\n0.333333 0.666667 0.099395 O\n0.666667 0.333333 0.599395 O\n",
"nsites": 22,
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{
"id": "jvasp-94095",
"created_at": "2022-09-04T14:35:43.691817Z",
"updated_at": "2022-09-04T14:35:43.691834Z",
"structure_string": "Mg6 Ga1 Ni1\n1.0\n6.028132 0.049540 0.000000\n-2.971163 5.245285 0.000000\n0.000000 0.000000 4.808691\nMg Ga Ni\n6 1 1\ndirect\n0.164088 0.844999 0.250000 Mg\n0.655000 0.335912 0.250000 Mg\n0.662624 0.837375 0.250000 Mg\n0.329461 0.638685 0.750000 Mg\n0.861314 0.170539 0.750000 Mg\n0.836026 0.663973 0.750000 Mg\n0.335866 0.164134 0.750000 Ga\n0.155622 0.344378 0.250000 Ni\n",
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{
"id": "jvasp-3648",
"created_at": "2022-09-04T14:35:49.009044Z",
"updated_at": "2022-09-04T14:35:49.009071Z",
"structure_string": "Hg2 Br4\n1.0\n4.149853 -0.121358 0.000000\n-1.632661 3.817122 0.000000\n0.000000 0.000000 12.469954\nHg Br\n2 4\ndirect\n0.660966 0.339033 0.500213 Hg\n0.339034 0.660966 0.000213 Hg\n0.607454 0.392545 0.134364 Br\n0.392545 0.607454 0.634364 Br\n0.071343 0.928656 0.865422 Br\n0.928656 0.071343 0.365422 Br\n",
"nsites": 6,
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"elements": [
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{
"id": "jvasp-105799",
"created_at": "2022-09-04T14:35:55.026920Z",
"updated_at": "2022-09-04T14:35:55.026947Z",
"structure_string": "Li1 Ce1 Zn2\n1.0\n4.193476 0.000000 2.421104\n1.397825 3.953646 2.421104\n0.000000 0.000000 4.842209\nLi Ce Zn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500001 0.500000 0.499999 Ce\n0.250000 0.250000 0.249999 Zn\n0.750001 0.750001 0.749998 Zn\n",
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{
"id": "jvasp-69110",
"created_at": "2022-09-04T14:36:11.878640Z",
"updated_at": "2022-09-04T14:36:11.878668Z",
"structure_string": "Ba1 Sr1 Ca2\n1.0\n4.595800 0.000000 0.000000\n0.000000 4.627287 0.000000\n0.000000 0.000000 9.015077\nBa Sr Ca\n1 1 2\ndirect\n0.500000 0.500000 0.764988 Ba\n0.000000 0.000000 0.477644 Sr\n0.000000 0.000000 0.022254 Ca\n0.500000 0.500000 0.235114 Ca\n",
"nsites": 4,
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"spacegroup": 99
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{
"id": "jvasp-98275",
"created_at": "2022-09-04T14:36:06.829625Z",
"updated_at": "2022-09-04T14:36:06.829642Z",
"structure_string": "In12 Sn4 I20\n1.0\n8.793286 0.000000 -1.443823\n0.000000 9.010718 0.000000\n0.000097 0.000000 17.597936\nIn Sn I\n12 4 20\ndirect\n0.383036 0.180117 0.249335 In\n0.383037 0.319883 0.749335 In\n0.889993 0.397638 0.247516 In\n0.110007 0.897638 0.252484 In\n0.616964 0.680117 0.250665 In\n0.782362 0.454125 0.971394 In\n0.217639 0.545875 0.028607 In\n0.889993 0.102362 0.747516 In\n0.217639 0.954125 0.528607 In\n0.110008 0.602362 0.752485 In\n0.616964 0.819883 0.750666 In\n0.782362 0.045875 0.471394 In\n0.705530 0.035915 0.083763 Sn\n0.294470 0.535915 0.416238 Sn\n0.705531 0.464085 0.583763 Sn\n0.294471 0.964085 0.916238 Sn\n0.619989 0.119196 0.895662 I\n0.868732 0.778808 0.611864 I\n0.619989 0.380804 0.395662 I\n0.250387 0.960632 0.737697 I\n0.250387 0.539368 0.237697 I\n0.016395 0.293873 0.604798 I\n0.131269 0.278808 0.888137 I\n0.457103 0.647014 0.898643 I\n0.131269 0.221192 0.388137 I\n0.380012 0.880804 0.104338 I\n0.983606 0.706127 0.395203 I\n0.016394 0.206127 0.104797 I\n0.868732 0.721192 0.111863 I\n0.983606 0.793874 0.895203 I\n0.542898 0.352986 0.101357 I\n0.749614 0.460632 0.762304 I\n0.457103 0.852986 0.398643 I\n0.380012 0.619196 0.604338 I\n0.749614 0.039368 0.262304 I\n0.542898 0.147014 0.601357 I\n",
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{
"id": "jvasp-66040",
"created_at": "2022-09-04T14:35:54.230788Z",
"updated_at": "2022-09-04T14:35:54.230812Z",
"structure_string": "Ba1 Li1 Br1\n1.0\n0.000000 4.009272 4.009272\n4.009272 0.000000 4.009272\n4.009272 4.009272 -0.000000\nBa Li Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Br\n",
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{
"id": "jvasp-107784",
"created_at": "2022-09-04T14:35:52.785105Z",
"updated_at": "2022-09-04T14:35:52.785126Z",
"structure_string": "Na1 Ca1 La1 F6\n1.0\n3.760563 -0.000000 0.000000\n0.000000 5.262989 -3.038588\n-0.000000 0.000000 6.077176\nNa Ca La F\n1 1 1 6\ndirect\n0.979805 0.000000 -0.000000 Na\n0.743462 0.333333 0.666667 Ca\n0.260130 0.666667 0.333333 La\n0.248700 0.086721 0.384054 F\n0.248700 0.615946 0.702667 F\n0.248700 0.297333 0.913280 F\n0.756834 0.919996 0.611997 F\n0.756834 0.388003 0.307999 F\n0.756834 0.692001 0.080004 F\n",
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{
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"structure_string": "Ba2 Mg1 Ga1\n1.0\n0.000000 4.187741 4.187741\n4.187741 0.000000 4.187741\n4.187741 4.187741 -0.000000\nBa Mg Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Ga\n",
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{
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"created_at": "2022-09-04T14:36:50.192330Z",
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"structure_string": "Ca2 Tl2 Br6\n1.0\n7.314471 0.040535 0.000000\n-6.101615 4.034034 0.000000\n-0.000000 -0.000000 10.886444\nCa Tl Br\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.256103 0.743895 0.250000 Tl\n0.743895 0.256103 0.750000 Tl\n0.636574 0.363424 0.049260 Br\n0.363424 0.636574 0.950739 Br\n0.363424 0.636574 0.549260 Br\n0.636574 0.363424 0.450740 Br\n0.935046 0.064951 0.250000 Br\n0.064952 0.935046 0.750000 Br\n",
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}