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{
"id": "jvasp-120369",
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{
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"structure_string": "Rb2 Li1 Ga1 F6\n1.0\n5.015136 -0.000000 2.895490\n1.671712 4.728315 2.895490\n-0.000000 -0.000000 5.790980\nRb Li Ga F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750001 0.750000 Rb\n0.500000 0.500001 0.500000 Li\n0.000000 0.000000 0.000000 Ga\n0.236885 0.236885 0.763115 F\n0.236884 0.763116 0.763115 F\n0.763116 0.763116 0.236884 F\n0.236884 0.763116 0.236884 F\n0.763116 0.236885 0.763115 F\n0.763116 0.236885 0.236884 F\n",
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"formula_full": "Rb2 Li1 Ga1 F6",
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{
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"structure_string": "Ca2 Ge4 Pt4\n1.0\n4.343957 0.000000 0.000000\n0.000000 4.343989 0.003420\n0.000000 -0.007852 10.233111\nCa Ge Pt\n2 4 4\ndirect\n0.254406 0.249989 0.750539 Ca\n0.754406 0.750012 0.249461 Ca\n0.754326 0.750033 0.629426 Ge\n0.754464 0.249998 -0.000000 Ge\n0.254464 0.750003 0.000000 Ge\n0.254326 0.249967 0.370574 Ge\n0.254338 0.749958 0.500020 Pt\n0.754469 0.750007 0.870335 Pt\n0.254469 0.249993 0.129665 Pt\n0.754339 0.250043 0.499980 Pt\n",
"nsites": 10,
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"volume": 193.09995910981652,
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},
{
"id": "jvasp-117861",
"created_at": "2022-09-04T14:38:48.491777Z",
"updated_at": "2022-09-04T14:38:48.491800Z",
"structure_string": "Pb1 Br2\n1.0\n4.229494 0.000000 0.000000\n0.000000 4.311977 0.000000\n0.000000 0.000000 7.817159\nPb Br\n1 2\ndirect\n0.466445 0.000000 0.000000 Pb\n-0.033223 0.000000 0.737941 Br\n-0.033223 0.000000 0.262060 Br\n",
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{
"id": "jvasp-111010",
"created_at": "2022-09-04T14:38:48.488080Z",
"updated_at": "2022-09-04T14:38:48.488109Z",
"structure_string": "Sb1 Pb1 Br1 O2\n1.0\n3.771619 0.012342 -5.990649\n-0.303684 3.759394 -5.990649\n-0.011347 -0.012342 7.079044\nSb Pb Br O\n1 1 1 2\ndirect\n0.328855 0.328854 -0.000000 Sb\n0.639504 0.639502 -0.000000 Pb\n0.998571 0.998568 -0.000001 Br\n0.754437 0.254436 0.499999 O\n0.254437 0.754436 0.499999 O\n",
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{
"id": "jvasp-113645",
"created_at": "2022-09-04T14:38:48.487339Z",
"updated_at": "2022-09-04T14:38:48.487365Z",
"structure_string": "Na1 Al1 H4\n1.0\n3.372831 0.000000 0.000000\n0.000000 3.372831 0.000000\n0.000000 0.000000 5.785178\nNa Al H\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 H\n0.000000 0.500000 0.500000 H\n0.500000 0.500000 0.201910 H\n0.500000 0.500000 0.798091 H\n",
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"volume": 65.8121210281693,
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{
"id": "jvasp-117790",
"created_at": "2022-09-04T14:38:48.487051Z",
"updated_at": "2022-09-04T14:38:48.487077Z",
"structure_string": "I1 Br2\n1.0\n4.174890 0.180665 -0.588499\n1.402465 -6.527719 0.129747\n1.313114 0.397466 -3.987024\nI Br\n1 2\ndirect\n0.054249 0.045692 0.899089 I\n0.350793 0.348973 0.560941 Br\n0.757678 0.742389 0.237271 Br\n",
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},
{
"id": "jvasp-110854",
"created_at": "2022-09-04T14:38:48.485082Z",
"updated_at": "2022-09-04T14:38:48.485123Z",
"structure_string": "Rb1 Sn1 O3\n1.0\n4.181185 -0.000000 0.000000\n0.000000 4.181185 0.000000\n-0.000000 -0.000000 4.181185\nRb Sn O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500001 Sn\n0.500001 0.500001 -0.000000 O\n0.500001 0.000000 0.500001 O\n-0.000000 0.500001 0.500001 O\n",
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},
{
"id": "jvasp-118709",
"created_at": "2022-09-04T14:38:48.482987Z",
"updated_at": "2022-09-04T14:38:48.483004Z",
"structure_string": "Mg1 Si1 O3\n1.0\n3.518575 -0.000000 -0.000000\n0.000000 3.518575 0.000000\n-0.000000 0.000000 3.518575\nMg Si O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Si\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:38:48.482754Z",
"updated_at": "2022-09-04T14:38:48.482781Z",
"structure_string": "Ba2 Al1 Ga3\n1.0\n4.786867 -0.004033 3.921856\n2.243350 4.228652 3.921856\n-0.011442 -0.006876 7.917017\nBa Al Ga\n2 1 3\ndirect\n0.251605 0.251604 0.189088 Ba\n0.748244 0.748242 0.810566 Ba\n0.424065 0.424065 0.416550 Al\n0.573351 0.573350 0.584095 Ga\n0.925700 0.925700 0.236988 Ga\n0.077039 0.077037 0.762715 Ga\n",
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{
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"structure_string": "Na12 Sb4 Se12\n1.0\n8.977083 -0.000000 0.000000\n0.000000 8.977083 0.000000\n-0.000000 -0.000000 8.977083\nNa Sb Se\n12 4 12\ndirect\n0.918169 0.418169 0.081831 Na\n0.418169 0.081831 0.918169 Na\n0.081831 0.918169 0.418169 Na\n0.581831 0.581831 0.581831 Na\n0.176216 0.676216 0.823783 Na\n0.676216 0.823783 0.176216 Na\n0.823783 0.176216 0.676216 Na\n0.323784 0.323784 0.323784 Na\n0.685949 0.185950 0.314050 Na\n0.185950 0.314050 0.685949 Na\n0.314050 0.685949 0.185950 Na\n0.814050 0.814050 0.814050 Na\n0.039119 0.039119 0.039119 Sb\n0.539119 0.460881 0.960881 Sb\n0.960881 0.539119 0.460881 Sb\n0.460881 0.960881 0.539119 Sb\n0.997916 0.759471 0.115852 Se\n0.884148 0.497916 0.740528 Se\n0.259471 0.384148 0.002084 Se\n0.497916 0.740528 0.884148 Se\n0.384148 0.002084 0.259471 Se\n0.759471 0.115852 0.997916 Se\n0.002084 0.259471 0.384148 Se\n0.115852 0.997916 0.759471 Se\n0.740528 0.884148 0.497916 Se\n0.502084 0.240529 0.615852 Se\n0.615852 0.502084 0.240529 Se\n0.240529 0.615852 0.502084 Se\n",
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