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{
"id": "jvasp-105613",
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"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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{
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"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",
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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-105630",
"created_at": "2022-09-04T14:35:54.729275Z",
"updated_at": "2022-09-04T14:35:54.729299Z",
"structure_string": "K2 Hg1 Pd1 F6\n1.0\n5.422412 -0.000000 3.130631\n1.807471 5.112299 3.130631\n-0.000000 -0.000000 6.261262\nK Hg Pd F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Pd\n0.762738 0.237261 0.237261 F\n0.237261 0.237261 0.762738 F\n0.237261 0.762739 0.762738 F\n0.237261 0.762739 0.237261 F\n0.762738 0.237261 0.762738 F\n0.762738 0.762739 0.237261 F\n",
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{
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"created_at": "2022-09-04T14:35:49.726652Z",
"updated_at": "2022-09-04T14:35:49.726676Z",
"structure_string": "Ca1 Pb1 F6\n1.0\n5.326751 0.000000 3.075401\n1.775584 5.022109 3.075401\n0.000000 0.000000 6.150802\nCa Pb F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Pb\n0.240833 0.759167 0.759167 F\n0.240833 0.759167 0.240833 F\n0.759167 0.240833 0.240833 F\n0.759166 0.759167 0.240833 F\n0.240833 0.240833 0.759167 F\n0.759167 0.240833 0.759167 F\n",
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{
"id": "jvasp-91879",
"created_at": "2022-09-04T14:36:06.436307Z",
"updated_at": "2022-09-04T14:36:06.436326Z",
"structure_string": "Mg7 Zn1\n1.0\n6.266486 -0.000000 0.000000\n-3.133243 5.426936 -0.000000\n-0.000000 -0.000000 5.071122\nMg Zn\n7 1\ndirect\n0.165826 0.832913 0.250000 Mg\n0.667089 0.334175 0.250000 Mg\n0.667089 0.832913 0.250000 Mg\n0.330350 0.169651 0.750000 Mg\n0.330350 0.660700 0.750000 Mg\n0.839301 0.169651 0.750000 Mg\n0.833334 0.666667 0.750000 Mg\n0.166667 0.333333 0.250000 Zn\n",
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{
"id": "jvasp-89067",
"created_at": "2022-09-04T14:36:01.311188Z",
"updated_at": "2022-09-04T14:36:01.311200Z",
"structure_string": "La4 Zn4 Sn4\n1.0\n4.619877 -0.000000 0.000000\n-2.309938 4.000930 0.000000\n0.000000 0.000000 17.079392\nLa Zn Sn\n4 4 4\ndirect\n0.000000 0.000000 0.750000 La\n0.000000 0.000000 0.250000 La\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 La\n0.666667 0.333333 0.843547 Zn\n0.666667 0.333333 0.656452 Zn\n0.333333 0.666667 0.156453 Zn\n0.333333 0.666667 0.343547 Zn\n0.666667 0.333333 0.115599 Sn\n0.666667 0.333333 0.384401 Sn\n0.333333 0.666667 0.884401 Sn\n0.333333 0.666667 0.615599 Sn\n",
"nsites": 12,
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{
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"created_at": "2022-09-04T14:35:56.571262Z",
"updated_at": "2022-09-04T14:35:56.571287Z",
"structure_string": "K2 Ca2 Be1\n1.0\n-2.376390 2.376390 10.792089\n2.376390 -2.376390 10.792089\n2.376390 2.376390 -10.792089\nK Ca Be\n2 2 1\ndirect\n0.584700 0.584700 0.000000 K\n0.415300 0.415300 0.000000 K\n0.750000 0.250000 0.500000 Ca\n0.250000 0.750000 0.500000 Ca\n0.000000 0.000000 0.000000 Be\n",
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{
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"created_at": "2022-09-04T14:36:11.402084Z",
"updated_at": "2022-09-04T14:36:11.402108Z",
"structure_string": "Na8 Mg4 In4 F28\n1.0\n7.337701 0.000000 0.000000\n-0.000000 7.505257 0.000000\n0.000000 0.000000 10.276654\nNa Mg In F\n8 4 4 28\ndirect\n0.250000 0.255774 0.277889 Na\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.000000 Na\n0.750000 0.744226 0.722110 Na\n0.750000 0.755775 0.222111 Na\n0.250000 0.244226 0.777889 Na\n0.000000 0.500000 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.250000 0.716965 0.760405 In\n0.250000 0.783035 0.260405 In\n0.750000 0.216965 0.739595 In\n0.750000 0.283035 0.239595 In\n0.250000 0.470436 0.940921 F\n0.750000 0.529564 0.059079 F\n0.750000 0.970437 0.559079 F\n0.250000 0.029564 0.440921 F\n0.250000 0.483521 0.650827 F\n0.750000 0.516479 0.349172 F\n0.445865 0.706858 0.115358 F\n0.250000 0.962189 0.859692 F\n0.945865 0.293142 0.884642 F\n0.554135 0.206858 0.384642 F\n0.054135 0.793143 0.615358 F\n0.554135 0.293142 0.884642 F\n0.054135 0.706858 0.115358 F\n0.445865 0.793143 0.615358 F\n0.945865 0.206858 0.384642 F\n0.492522 0.324447 0.144644 F\n0.250000 0.016479 0.150827 F\n-0.007478 0.675553 0.855356 F\n0.007478 0.175553 0.644644 F\n0.507478 0.675553 0.855356 F\n0.007478 0.324447 0.144644 F\n0.492522 0.175553 0.644644 F\n-0.007478 0.824447 0.355356 F\n0.250000 0.537811 0.359693 F\n0.750000 0.462189 0.640307 F\n0.750000 0.037811 0.140307 F\n0.507478 0.824447 0.355356 F\n0.750000 -0.016479 0.849172 F\n",
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"structure_string": "Ba1 In1 Br1\n1.0\n0.000000 4.018357 4.018357\n4.018357 0.000000 4.018357\n4.018357 4.018357 0.000000\nBa In Br\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Br\n",
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{
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