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{
"id": "jvasp-109887",
"created_at": "2022-09-04T14:38:37.129330Z",
"updated_at": "2022-09-04T14:38:37.129353Z",
"structure_string": "Rb2 In1 Ag1 I6\n1.0\n7.239172 0.000000 4.179538\n2.413057 6.825156 4.179538\n-0.000000 0.000000 8.359075\nRb In Ag I\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 In\n0.500000 0.500000 0.500000 Ag\n0.749906 0.250094 0.250094 I\n0.250094 0.250094 0.749907 I\n0.250094 0.749907 0.749907 I\n0.250094 0.749907 0.250094 I\n0.749906 0.250094 0.749907 I\n0.749906 0.749907 0.250094 I\n",
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{
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"structure_string": "Rb2 In1 Ag1 F6\n1.0\n5.486894 -0.000000 3.167860\n1.828965 5.173093 3.167860\n-0.000000 -0.000000 6.335720\nRb In Ag F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.749999 0.750000 0.750001 Rb\n0.000000 0.000000 0.000000 In\n0.499999 0.500000 0.500001 Ag\n0.233863 0.233863 0.766137 F\n0.233862 0.766136 0.766138 F\n0.766136 0.766136 0.233864 F\n0.233862 0.766136 0.233864 F\n0.766136 0.233863 0.766137 F\n0.766136 0.233863 0.233864 F\n",
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{
"id": "jvasp-109481",
"created_at": "2022-09-04T14:38:19.412995Z",
"updated_at": "2022-09-04T14:38:19.413019Z",
"structure_string": "Rb2 In1 Ag1 Cl6\n1.0\n6.375164 -0.000000 3.680703\n2.125055 6.010562 3.680703\n-0.000000 -0.000000 7.361405\nRb In Ag Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 In\n0.499999 0.500000 0.500000 Ag\n0.755992 0.244007 0.244007 Cl\n0.244007 0.244007 0.755993 Cl\n0.244007 0.755993 0.755993 Cl\n0.244007 0.755993 0.244007 Cl\n0.755992 0.244007 0.755993 Cl\n0.755992 0.755993 0.244007 Cl\n",
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"density_atomic": 0.0354513555113374,
"volume": 282.07666126622394,
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"formula_full": "Rb2 In1 Ag1 Cl6",
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},
{
"id": "jvasp-101511",
"created_at": "2022-09-04T14:36:40.443213Z",
"updated_at": "2022-09-04T14:36:40.443234Z",
"structure_string": "Rb2 In1 Ag1 Br6\n1.0\n6.728498 0.000000 3.884700\n2.242833 6.343689 3.884700\n0.000000 0.000000 7.769400\nRb In Ag Br\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 In\n0.500000 0.500000 0.500000 Ag\n0.753433 0.246568 0.246567 Br\n0.246567 0.246568 0.753433 Br\n0.246567 0.753433 0.753433 Br\n0.246567 0.753433 0.246567 Br\n0.753433 0.246568 0.753432 Br\n0.753432 0.753433 0.246567 Br\n",
"nsites": 10,
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"elements": [
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],
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"density": 4.3715820339572256,
"density_atomic": 0.030154526098717056,
"volume": 331.62517518142846,
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"formula_full": "Rb2 In1 Ag1 Br6",
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{
"id": "jvasp-122103",
"created_at": "2022-09-04T14:38:55.468359Z",
"updated_at": "2022-09-04T14:38:55.468382Z",
"structure_string": "Rb3 Ho1 V2 O8\n1.0\n6.003630 0.000000 0.000000\n-3.001815 5.199296 0.000000\n-0.000000 -0.000000 7.818062\nRb Ho V O\n3 1 2 8\ndirect\n0.333333 0.666667 0.693014 Rb\n0.666667 0.333334 0.306986 Rb\n0.000000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Ho\n0.333333 0.666667 0.252978 V\n0.666667 0.333334 0.747022 V\n0.333333 0.666667 0.039100 O\n0.666667 0.333334 0.960900 O\n0.174706 0.825294 0.329927 O\n0.825293 0.174707 0.670072 O\n0.174707 0.349414 0.329927 O\n0.825293 0.650587 0.670072 O\n0.650586 0.825294 0.329927 O\n0.349414 0.174707 0.670072 O\n",
"nsites": 14,
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{
"id": "jvasp-91247",
"created_at": "2022-09-04T14:36:18.532990Z",
"updated_at": "2022-09-04T14:36:18.533021Z",
"structure_string": "Rb2 Ho4 Cu6 S10\n1.0\n3.940326 0.000000 0.000000\n-1.970163 6.948603 -0.000000\n0.000000 0.000000 16.445387\nRb Ho Cu S\n2 4 6 10\ndirect\n0.564718 0.129435 0.250000 Rb\n0.435284 0.870565 0.750000 Rb\n0.307663 0.615323 0.093528 Ho\n0.307663 0.615323 0.406472 Ho\n0.692339 0.384677 0.593529 Ho\n0.692339 0.384677 0.906472 Ho\n0.917198 0.834394 0.538457 Cu\n0.844978 0.689952 0.250000 Cu\n0.155024 0.310047 0.750000 Cu\n0.082803 0.165606 0.461543 Cu\n0.082803 0.165606 0.038457 Cu\n0.917198 0.834394 0.961543 Cu\n0.062000 0.124001 0.884578 S\n0.938001 0.875999 0.384578 S\n0.938001 0.875999 0.115422 S\n0.741872 0.483741 0.750000 S\n0.258130 0.516258 0.250000 S\n0.331738 0.663474 0.930649 S\n0.668264 0.336526 0.069351 S\n0.668264 0.336526 0.430649 S\n0.062000 0.124001 0.615422 S\n0.331738 0.663474 0.569351 S\n",
"nsites": 22,
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"elements": [
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],
"chemical_system": "Cu-Ho-Rb-S",
"density": 5.651963070660449,
"density_atomic": 0.04885948995197133,
"volume": 450.27076667451723,
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"formula_full": "Rb2 Ho4 Cu6 S10",
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},
{
"id": "jvasp-110349",
"created_at": "2022-09-04T14:38:39.273347Z",
"updated_at": "2022-09-04T14:38:39.273380Z",
"structure_string": "Rb2 Hg1 Sb1 F6\n1.0\n5.825235 -0.000000 3.363201\n1.941745 5.492084 3.363201\n0.000000 0.000000 6.726401\nRb Hg Sb F\n2 1 1 6\ndirect\n0.749999 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n0.776049 0.223950 0.223950 F\n0.223950 0.223950 0.776050 F\n0.223949 0.776049 0.776050 F\n0.223949 0.776049 0.223951 F\n0.776049 0.223950 0.776050 F\n0.776049 0.776049 0.223951 F\n",
"nsites": 10,
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],
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"density": 4.685995348495624,
"density_atomic": 0.046469352826204985,
"volume": 215.19559433934708,
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"formula_full": "Rb2 Hg1 Sb1 F6",
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"formula_anonymous": "ABC2D6",
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{
"id": "jvasp-102074",
"created_at": "2022-09-04T14:36:43.144181Z",
"updated_at": "2022-09-04T14:36:43.144204Z",
"structure_string": "Rb2 Hg1 Sb1 Cl6\n1.0\n6.685230 -0.000000 3.859719\n2.228410 6.302894 3.859719\n0.000000 0.000000 7.719438\nRb Hg Sb Cl\n2 1 1 6\ndirect\n0.750000 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n0.758444 0.241556 0.241557 Cl\n0.241556 0.241556 0.758444 Cl\n0.241557 0.758443 0.758444 Cl\n0.241557 0.758443 0.241557 Cl\n0.758444 0.241556 0.758444 Cl\n0.758444 0.758443 0.241557 Cl\n",
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],
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{
"id": "jvasp-103197",
"created_at": "2022-09-04T14:36:32.779871Z",
"updated_at": "2022-09-04T14:36:32.779898Z",
"structure_string": "Rb2 Hg1 Ru1 F6\n1.0\n5.800848 -0.000000 3.349121\n1.933616 5.469092 3.349121\n0.000000 0.000000 6.698243\nRb Hg Ru F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.499999 Hg\n0.000000 0.000000 0.000000 Ru\n0.794577 0.205423 0.205423 F\n0.205424 0.205423 0.794576 F\n0.205424 0.794576 0.794576 F\n0.205424 0.794576 0.205423 F\n0.794577 0.205423 0.794576 F\n0.794578 0.794576 0.205423 F\n",
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{
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"created_at": "2022-09-04T14:37:08.926526Z",
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"structure_string": "Rb2 Hg1 Rh1 F6\n1.0\n5.471783 -0.000000 3.159135\n1.823928 5.158846 3.159135\n0.000000 0.000000 6.318271\nRb Hg Rh F\n2 1 1 6\ndirect\n0.750000 0.750001 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 Hg\n0.000000 0.000000 0.000000 Rh\n0.773702 0.226298 0.226297 F\n0.226298 0.226298 0.773702 F\n0.226298 0.773703 0.773701 F\n0.226298 0.773703 0.226297 F\n0.773702 0.226298 0.773701 F\n0.773702 0.773703 0.226297 F\n",
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{
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"created_at": "2022-09-04T14:35:53.815268Z",
"updated_at": "2022-09-04T14:35:53.815284Z",
"structure_string": "Rb2 Hg2 Pd1 Cl8\n1.0\n6.368219 0.039202 1.932702\n2.754581 5.741780 1.932702\n-0.036506 -0.023132 9.833210\nRb Hg Pd Cl\n2 2 1 8\ndirect\n0.397298 0.397299 0.829108 Rb\n0.602701 0.602701 0.170891 Rb\n0.866065 0.866065 0.400907 Hg\n0.133934 0.133935 0.599093 Hg\n0.000000 0.000000 0.000000 Pd\n0.085096 0.085097 0.305975 Cl\n0.106689 0.623952 0.134375 Cl\n0.647877 0.647877 0.503505 Cl\n0.376047 0.893311 0.865624 Cl\n0.352122 0.352123 0.496495 Cl\n0.623952 0.106689 0.134375 Cl\n0.893310 0.376048 0.865624 Cl\n0.914903 0.914904 0.694024 Cl\n",
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{
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"created_at": "2022-09-04T14:35:41.048650Z",
"updated_at": "2022-09-04T14:35:41.048673Z",
"structure_string": "Rb2 Hg2 Pd1 Cl8\n1.0\n6.368097 0.039047 1.932409\n2.754388 5.741736 1.932409\n-0.037039 -0.023470 9.834079\nRb Hg Pd Cl\n2 2 1 8\ndirect\n0.397295 0.397295 0.829109 Rb\n0.602705 0.602706 0.170891 Rb\n0.866074 0.866075 0.400908 Hg\n0.133926 0.133926 0.599092 Hg\n0.000000 0.000000 0.000000 Pd\n0.085111 0.085111 0.305976 Cl\n0.106719 0.623961 0.134386 Cl\n0.647880 0.647881 0.503489 Cl\n0.376039 0.893282 0.865614 Cl\n0.352119 0.352120 0.496511 Cl\n0.623961 0.106720 0.134386 Cl\n0.893281 0.376040 0.865614 Cl\n0.914889 0.914890 0.694024 Cl\n",
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]
}