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{
"id": "jvasp-92505",
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"structure_string": "Rb1 Tl1 F3\n1.0\n-0.012580 -4.698367 -0.062333\n-4.698945 0.011822 -0.032655\n0.034087 0.062923 -4.698901\nRb Tl F\n1 1 3\ndirect\n0.989919 0.997616 0.991079 Rb\n0.488281 0.499652 0.496920 Tl\n0.486470 0.999818 0.502175 F\n0.988149 0.501133 0.502427 F\n0.487187 0.501777 0.997398 F\n",
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{
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{
"id": "jvasp-102420",
"created_at": "2022-09-04T14:36:42.415627Z",
"updated_at": "2022-09-04T14:36:42.415650Z",
"structure_string": "Rb2 Tl2 Cl6\n1.0\n6.781208 -0.000000 3.915132\n2.260403 6.393384 3.915132\n-0.000000 -0.000000 7.830264\nRb Tl Cl\n2 2 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n0.762982 0.237018 0.237018 Cl\n0.237018 0.237018 0.762981 Cl\n0.237018 0.762982 0.762982 Cl\n0.237018 0.762982 0.237018 Cl\n0.762982 0.237018 0.762981 Cl\n0.762982 0.762982 0.237018 Cl\n",
"nsites": 10,
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"elements": [
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"density": 3.876058963921399,
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"formula_full": "Rb2 Tl2 Cl6",
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{
"id": "jvasp-36924",
"created_at": "2022-09-04T14:38:07.611852Z",
"updated_at": "2022-09-04T14:38:07.611875Z",
"structure_string": "Rb1 Tl1 Br3\n1.0\n5.769630 -0.005088 -0.008659\n-0.011231 5.766023 0.003272\n-0.009355 0.002510 5.766015\nRb Tl Br\n1 1 3\ndirect\n-0.015469 0.010341 0.009176 Rb\n0.514115 0.501351 0.499307 Tl\n0.522611 0.499477 -0.001438 Br\n0.016365 0.498145 0.495910 Br\n0.522378 0.000683 0.497044 Br\n",
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"volume": 191.8219014441795,
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"spacegroup": 8
},
{
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"created_at": "2022-09-04T14:38:33.086821Z",
"updated_at": "2022-09-04T14:38:33.086841Z",
"structure_string": "Rb2 Tl2 Br6\n1.0\n6.956728 -0.105269 3.842520\n2.219055 6.594160 3.842520\n-0.148859 -0.105269 7.945997\nRb Tl Br\n2 2 6\ndirect\n0.261691 0.261691 0.261691 Rb\n0.761692 0.761691 0.761691 Rb\n0.005523 0.005523 0.005523 Tl\n0.505523 0.505523 0.505523 Tl\n0.251586 0.832263 0.677439 Br\n0.832264 0.677439 0.251585 Br\n0.677439 0.251585 0.832263 Br\n0.177439 0.332263 0.751585 Br\n0.751586 0.177439 0.332263 Br\n0.332264 0.751585 0.177438 Br\n",
"nsites": 10,
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"elements": [
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"density": 4.726250559005458,
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"volume": 372.1174765498872,
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"formula_full": "Rb2 Tl2 Br6",
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{
"id": "jvasp-114664",
"created_at": "2022-09-04T14:38:43.134614Z",
"updated_at": "2022-09-04T14:38:43.134643Z",
"structure_string": "Rb1 Tl1 Br3\n1.0\n5.769986 0.000000 0.000000\n-0.000000 5.769986 -0.000000\n0.000000 0.000000 5.769986\nRb Tl Br\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500001 Tl\n0.000000 0.500001 0.500001 Br\n0.500001 0.000000 0.500001 Br\n0.500001 0.500001 0.000000 Br\n",
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},
{
"id": "jvasp-109002",
"created_at": "2022-09-04T14:38:15.494202Z",
"updated_at": "2022-09-04T14:38:15.494229Z",
"structure_string": "Rb2 Tl2 Br6\n1.0\n7.096402 -0.000000 4.097110\n2.365467 6.690552 4.097110\n-0.000000 -0.000000 8.194219\nRb Tl Br\n2 2 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n0.757632 0.242368 0.242368 Br\n0.242368 0.242368 0.757632 Br\n0.242369 0.757632 0.757632 Br\n0.242369 0.757632 0.242368 Br\n0.757632 0.242368 0.757632 Br\n0.757632 0.757632 0.242368 Br\n",
"nsites": 10,
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"elements": [
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"density": 4.520527151452409,
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"volume": 389.0520668578535,
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},
{
"id": "jvasp-114661",
"created_at": "2022-09-04T14:38:42.185685Z",
"updated_at": "2022-09-04T14:38:42.185714Z",
"structure_string": "Rb1 Tl1 Br1\n1.0\n3.973050 -0.000000 0.000000\n-0.000000 3.973050 -0.000000\n-0.000000 -0.000000 9.459103\nRb Tl Br\n1 1 1\ndirect\n0.000000 0.000000 0.588609 Rb\n0.000000 0.000000 -0.028516 Tl\n0.000000 0.000000 0.264686 Br\n",
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},
{
"id": "jvasp-114660",
"created_at": "2022-09-04T14:38:42.177963Z",
"updated_at": "2022-09-04T14:38:42.177983Z",
"structure_string": "Rb1 Tl1 Br1\n1.0\n6.006091 0.000000 -0.000000\n-3.003045 5.201427 0.000000\n-0.000000 -0.000000 3.796966\nRb Tl Br\n1 1 1\ndirect\n0.333332 0.666667 0.000000 Rb\n0.666666 0.333334 0.000000 Tl\n0.000000 0.000000 0.000000 Br\n",
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},
{
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"created_at": "2022-09-04T14:37:51.207941Z",
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"structure_string": "Rb2 Tl6\n1.0\n4.013112 -6.950914 -0.000000\n4.013112 6.950914 0.000000\n0.000000 0.000000 5.354540\nRb Tl\n2 6\ndirect\n0.333333 0.666667 0.750000 Rb\n0.666667 0.333333 0.250000 Rb\n0.717432 0.858715 0.250000 Tl\n0.141284 0.858715 0.250000 Tl\n0.141284 0.282568 0.250000 Tl\n0.282568 0.141284 0.750000 Tl\n0.858715 0.141284 0.750000 Tl\n0.858715 0.717432 0.750000 Tl\n",
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},
{
"id": "jvasp-38287",
"created_at": "2022-09-04T14:37:55.415164Z",
"updated_at": "2022-09-04T14:37:55.415192Z",
"structure_string": "Rb1 Tl3\n1.0\n-0.000000 4.059566 4.059566\n4.059566 -0.000000 4.059566\n4.059566 4.059566 -0.000000\nRb Tl\n1 3\ndirect\n0.750001 0.750001 0.750001 Rb\n0.000000 0.000000 0.000000 Tl\n0.500001 0.500001 0.500001 Tl\n0.250000 0.250000 0.250000 Tl\n",
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},
{
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"structure_string": "Rb1 Tl2 Bi1\n1.0\n0.000000 4.107141 4.107141\n4.107141 -0.000000 4.107141\n4.107141 4.107141 0.000000\nRb Tl Bi\n1 2 1\ndirect\n0.749999 0.749999 0.749999 Rb\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n0.250000 0.250000 0.250000 Bi\n",
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}
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