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{
"id": "jvasp-22550",
"created_at": "2022-09-04T14:37:31.256786Z",
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{
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{
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"structure_string": "Ca1 Ag2 Sn1\n1.0\n0.000000 3.522334 3.522334\n3.522334 0.000000 3.522334\n3.522334 3.522334 0.000000\nCa Ag Sn\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Ca\n0.000000 0.000000 0.000000 Ag\n0.499999 0.499999 0.499999 Ag\n0.750000 0.750000 0.750000 Sn\n",
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{
"id": "jvasp-81241",
"created_at": "2022-09-04T14:37:18.624617Z",
"updated_at": "2022-09-04T14:37:18.624641Z",
"structure_string": "Li1 Zn1 Hg2\n1.0\n-9.453001 -0.000000 -5.457693\n-6.279573 0.117928 -0.038845\n-5.299783 2.889193 -1.735891\nLi Zn Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.000000 Zn\n0.756049 0.000000 0.000000 Hg\n0.243951 0.000000 0.000000 Hg\n",
"nsites": 4,
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},
{
"id": "jvasp-80146",
"created_at": "2022-09-04T14:37:12.729267Z",
"updated_at": "2022-09-04T14:37:12.729293Z",
"structure_string": "Mg1 Zn1 Ni2\n1.0\n-8.465443 0.000001 -4.887525\n-5.529080 0.200238 -0.198404\n-4.759234 2.377691 -1.531817\nMg Zn Ni\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500001 -0.000001 -0.000000 Zn\n0.738110 -0.000002 -0.000000 Ni\n0.261891 -0.000001 -0.000000 Ni\n",
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{
"id": "jvasp-81285",
"created_at": "2022-09-04T14:37:18.749564Z",
"updated_at": "2022-09-04T14:37:18.749589Z",
"structure_string": "Li1 Zn2 Cu1\n1.0\n-8.755180 -0.000000 -5.054805\n-8.388286 -0.035588 4.419327\n-5.697712 7.574504 -0.240884\nLi Zn Cu\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.741250 -0.000000 -0.000000 Zn\n0.258750 -0.000000 -0.000000 Zn\n0.500000 -0.000000 -0.000000 Cu\n",
"nsites": 4,
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{
"id": "jvasp-81190",
"created_at": "2022-09-04T14:37:19.296638Z",
"updated_at": "2022-09-04T14:37:19.296666Z",
"structure_string": "Na1 Hg2 Bi1\n1.0\n-8.689135 -0.204514 -10.019899\n-4.905778 -1.677586 -1.969845\n-4.300237 3.383186 -5.227316\nNa Hg Bi\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.747161 -0.000324 0.022487 Hg\n0.252839 0.000324 -0.022486 Hg\n0.499999 0.000002 0.000002 Bi\n",
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{
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"created_at": "2022-09-04T14:37:09.112301Z",
"updated_at": "2022-09-04T14:37:09.112328Z",
"structure_string": "K2 Sc1 Ag1 F6\n1.0\n5.374814 -0.000000 3.103150\n1.791605 5.067423 3.103150\n-0.000000 -0.000000 6.206301\nK Sc Ag F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.749999 0.750000 0.750001 K\n0.000000 0.000000 0.000000 Sc\n0.499999 0.500000 0.500000 Ag\n0.229388 0.229389 0.770611 F\n0.229388 0.770611 0.770612 F\n0.770610 0.770611 0.229389 F\n0.229388 0.770611 0.229389 F\n0.770610 0.229389 0.770612 F\n0.770610 0.229389 0.229389 F\n",
"nsites": 10,
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"formula_anonymous": "ABC2D6",
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"spacegroup": 225
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{
"id": "jvasp-8338",
"created_at": "2022-09-04T14:37:08.426645Z",
"updated_at": "2022-09-04T14:37:08.426669Z",
"structure_string": "Ca1 Sb1 F6\n1.0\n4.950518 0.181156 3.438164\n1.893957 4.577485 3.438164\n0.260562 0.181156 6.021685\nCa Sb F\n1 1 6\ndirect\n0.500000 0.500001 0.499999 Ca\n0.000000 0.000000 0.000000 Sb\n0.384392 0.086825 0.764159 F\n0.086824 0.764160 0.384391 F\n0.235841 0.615609 0.913175 F\n0.913176 0.235843 0.615607 F\n0.615608 0.913178 0.235839 F\n0.764159 0.384393 0.086823 F\n",
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"volume": 128.54864958993903,
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"formula_full": "Ca1 Sb1 F6",
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},
{
"id": "jvasp-80430",
"created_at": "2022-09-04T14:37:19.123477Z",
"updated_at": "2022-09-04T14:37:19.123495Z",
"structure_string": "Ba2 Tl1 Ag1\n1.0\n-11.350382 -0.000000 -6.553147\n-11.888457 -0.001721 7.485120\n-7.745469 11.716420 0.309253\nBa Tl Ag\n2 1 1\ndirect\n0.752664 -0.000000 -0.000000 Ba\n0.247336 -0.000000 -0.000000 Ba\n0.500000 -0.000000 -0.000000 Tl\n0.000000 0.000000 0.000000 Ag\n",
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},
{
"id": "jvasp-36003",
"created_at": "2022-09-04T14:37:08.345138Z",
"updated_at": "2022-09-04T14:37:08.345156Z",
"structure_string": "K1 Na1 I1 Cl1\n1.0\n4.444488 0.000000 -0.000000\n0.000000 4.444488 0.000000\n0.000000 0.000000 6.674309\nK Na I Cl\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 I\n0.000000 0.000000 0.500000 Cl\n",
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{
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"created_at": "2022-09-04T14:37:20.227500Z",
"updated_at": "2022-09-04T14:37:20.227519Z",
"structure_string": "Mg2 Se2\n1.0\n2.112101 -3.658266 0.000000\n2.112101 3.658266 -0.000000\n-0.000000 -0.000000 6.829477\nMg Se\n2 2\ndirect\n0.666667 0.333333 0.501635 Mg\n0.333333 0.666667 0.001634 Mg\n0.666667 0.333333 0.123366 Se\n0.333333 0.666667 0.623366 Se\n",
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