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{
"id": "jvasp-107850",
"created_at": "2022-09-04T14:36:35.215940Z",
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"structure_string": "Rb2 Sc1 Ag1 F6\n1.0\n5.419134 -0.000000 3.128739\n1.806378 5.109209 3.128739\n-0.000000 -0.000000 6.257477\nRb Sc Ag F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500001 Ag\n0.771645 0.228355 0.228355 F\n0.228354 0.228355 0.771646 F\n0.228355 0.771646 0.771646 F\n0.228355 0.771646 0.228355 F\n0.771645 0.228355 0.771646 F\n0.771645 0.771646 0.228355 F\n",
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{
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"structure_string": "Na2 Te1\n1.0\n4.454749 -0.000000 2.571951\n1.484916 4.199977 2.571951\n-0.000000 -0.000000 5.143901\nNa Te\n2 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.750001 0.750001 0.749999 Na\n0.000000 0.000000 0.000000 Te\n",
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{
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"structure_string": "Rb2 Tl1 Ga1 I6\n1.0\n7.383118 -0.000000 4.262645\n2.461040 6.960870 4.262645\n0.000000 0.000000 8.525290\nRb Tl Ga I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Ga\n0.766953 0.233047 0.233047 I\n0.233047 0.233047 0.766953 I\n0.233047 0.766953 0.766954 I\n0.233047 0.766953 0.233047 I\n0.766953 0.233047 0.766954 I\n0.766954 0.766953 0.233047 I\n",
"nsites": 10,
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"density_atomic": 0.022823776525193684,
"volume": 438.13958610055835,
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"formula_full": "Rb2 Tl1 Ga1 I6",
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{
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"created_at": "2022-09-04T14:36:35.200457Z",
"updated_at": "2022-09-04T14:36:35.200481Z",
"structure_string": "Sr1 Zn2 Ge2\n1.0\n4.142104 -0.000000 -1.577469\n-0.600759 4.098306 -1.577469\n-0.014415 -0.016682 6.189035\nSr Zn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.750000 0.250000 0.500000 Zn\n0.250000 0.750001 0.500000 Zn\n0.620233 0.620234 0.240466 Ge\n0.379767 0.379767 0.759533 Ge\n",
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},
{
"id": "jvasp-1942",
"created_at": "2022-09-04T14:36:35.190729Z",
"updated_at": "2022-09-04T14:36:35.190754Z",
"structure_string": "K1 I1\n1.0\n4.297564 0.000000 2.481199\n1.432521 4.051782 2.481199\n0.000000 0.000000 4.962399\nK I\n1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500001 I\n",
"nsites": 2,
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{
"id": "jvasp-78999",
"created_at": "2022-09-04T14:36:35.176994Z",
"updated_at": "2022-09-04T14:36:35.177008Z",
"structure_string": "Sr3 Li1\n1.0\n-2.774208 2.774208 5.956617\n2.774208 -2.774208 5.956617\n2.774208 2.774208 -5.956617\nSr Li\n3 1\ndirect\n0.750001 0.249999 0.500001 Sr\n0.249999 0.750001 0.500001 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Li\n",
"nsites": 4,
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{
"id": "jvasp-92847",
"created_at": "2022-09-04T14:36:15.823154Z",
"updated_at": "2022-09-04T14:36:15.823178Z",
"structure_string": "Ba1 Mg6 Cr1\n1.0\n7.648166 0.813731 0.000000\n-3.119370 5.402907 0.000000\n0.000000 0.000000 5.031491\nBa Mg Cr\n1 6 1\ndirect\n0.085588 0.292794 0.250000 Ba\n0.621783 0.322449 0.250000 Mg\n0.621783 0.799332 0.250000 Mg\n0.356354 0.174247 0.750000 Mg\n0.356354 0.682108 0.750000 Mg\n0.740576 0.120288 0.750000 Mg\n0.937765 0.718882 0.750000 Mg\n0.279801 0.889901 0.250000 Cr\n",
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"density": 2.521857242883576,
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"volume": 220.6845044114138,
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{
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"created_at": "2022-09-04T14:36:31.676034Z",
"updated_at": "2022-09-04T14:36:31.676061Z",
"structure_string": "Rb4 S4 F20\n1.0\n6.018661 -0.000000 0.000000\n-0.000000 7.693199 0.000000\n0.000000 0.000000 9.758248\nRb S F\n4 4 20\ndirect\n0.250000 0.852568 0.156608 Rb\n0.750000 0.352568 0.343392 Rb\n0.250000 0.647433 0.656608 Rb\n0.750000 0.147433 0.843392 Rb\n0.250000 0.354171 0.097026 S\n0.750000 0.645829 0.902974 S\n0.750000 0.854172 0.402974 S\n0.250000 0.145829 0.597026 S\n0.037685 0.309704 0.579248 F\n0.537685 0.690296 0.420752 F\n0.962315 0.809704 0.920752 F\n0.462315 0.190296 0.079248 F\n0.955702 0.006695 0.355101 F\n0.455702 -0.006695 0.644899 F\n0.250000 0.201525 0.757548 F\n0.044298 -0.006695 0.644899 F\n0.544297 0.006695 0.355101 F\n0.955702 0.493305 0.855101 F\n0.455702 0.506695 0.144899 F\n0.537685 0.809704 0.920752 F\n0.037685 0.190296 0.079248 F\n0.462315 0.309704 0.579248 F\n0.962315 0.690296 0.420752 F\n0.250000 0.298475 0.257548 F\n0.750000 0.701525 0.742453 F\n0.750000 0.798475 0.242453 F\n0.544297 0.493305 0.855101 F\n0.044298 0.506695 0.144899 F\n",
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},
{
"id": "jvasp-107997",
"created_at": "2022-09-04T14:36:20.256469Z",
"updated_at": "2022-09-04T14:36:20.256485Z",
"structure_string": "Yb1 Nd1 Mg2\n1.0\n4.742913 -0.000000 2.738322\n1.580971 4.471662 2.738322\n-0.000000 -0.000000 5.476645\nYb Nd Mg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.499999 Nd\n0.250000 0.250000 0.250000 Mg\n0.749999 0.750000 0.749999 Mg\n",
"nsites": 4,
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},
{
"id": "jvasp-99417",
"created_at": "2022-09-04T14:36:39.265731Z",
"updated_at": "2022-09-04T14:36:39.265748Z",
"structure_string": "Rb2 La1 Ag1 Cl6\n1.0\n6.656393 -0.000000 3.843070\n2.218798 6.275707 3.843070\n-0.000000 -0.000000 7.686140\nRb La Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Ag\n0.747099 0.252900 0.252900 Cl\n0.252900 0.252900 0.747100 Cl\n0.252900 0.747100 0.747099 Cl\n0.252900 0.747100 0.252900 Cl\n0.747099 0.252900 0.747100 Cl\n0.747100 0.747100 0.252900 Cl\n",
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{
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"created_at": "2022-09-04T14:36:32.921252Z",
"updated_at": "2022-09-04T14:36:32.921271Z",
"structure_string": "Zn4 Pb8 F24\n1.0\n5.708149 -0.000000 -0.000000\n-0.000000 5.708149 -0.000000\n-0.000000 0.000000 16.022523\nZn Pb F\n4 8 24\ndirect\n0.500000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.000000 0.500000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.008814 0.008814 0.844136 Pb\n0.991186 0.991186 0.155864 Pb\n0.508814 0.508814 0.155864 Pb\n0.008814 0.491186 0.344136 Pb\n0.491186 0.008814 0.344136 Pb\n0.991186 0.508814 0.655864 Pb\n0.491186 0.491186 0.844136 Pb\n0.508814 0.991186 0.655864 Pb\n0.556847 0.556847 0.622008 F\n0.750000 0.250000 0.500000 F\n0.250000 0.750000 0.000000 F\n0.250000 0.750000 0.500000 F\n0.750000 0.250000 0.000000 F\n0.943153 0.943153 0.622008 F\n0.750000 0.750000 0.759707 F\n0.556847 0.943153 0.122008 F\n0.750000 0.750000 0.259707 F\n0.250000 0.250000 0.740293 F\n0.250000 0.250000 0.240293 F\n0.750000 0.250000 0.250000 F\n0.250000 0.750000 0.750000 F\n0.250000 0.750000 0.250000 F\n0.943153 0.556847 0.122008 F\n0.750000 0.250000 0.750000 F\n0.750000 0.750000 0.462138 F\n0.250000 0.250000 0.537862 F\n0.250000 0.250000 0.037862 F\n0.056847 0.056847 0.377992 F\n0.443153 0.056847 0.877992 F\n0.056847 0.443153 0.877992 F\n0.750000 0.750000 0.962138 F\n0.443153 0.443153 0.377992 F\n",
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{
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"created_at": "2022-09-04T14:36:19.644874Z",
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"structure_string": "Sr1 Cd2 Ge2\n1.0\n4.243787 -0.000000 -1.549123\n-0.565481 4.205943 -1.549123\n0.075175 0.085959 6.793382\nSr Cd Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.750001 0.250000 0.500001 Cd\n0.250001 0.750000 0.500000 Cd\n0.606727 0.606726 0.213454 Ge\n0.393275 0.393274 0.786547 Ge\n",
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}