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{
"id": "jvasp-105254",
"created_at": "2022-09-04T14:36:57.061915Z",
"updated_at": "2022-09-04T14:36:57.061942Z",
"structure_string": "Sr2 Mg1 Tl1\n1.0\n4.999195 -0.000000 2.886287\n1.666398 4.713286 2.886287\n-0.000000 -0.000000 5.772573\nSr Mg Tl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.749999 0.750001 0.750001 Sr\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Tl\n",
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{
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"created_at": "2022-09-04T14:37:03.494484Z",
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"structure_string": "K2 Na1 Tl1 Cl6\n1.0\n6.431362 -0.000000 3.713149\n2.143787 6.063546 3.713149\n-0.000000 -0.000000 7.426296\nK Na Tl Cl\n2 1 1 6\ndirect\n0.750000 0.750001 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Tl\n0.753103 0.246897 0.246897 Cl\n0.246897 0.246897 0.753103 Cl\n0.246897 0.753103 0.753103 Cl\n0.246897 0.753103 0.246897 Cl\n0.753103 0.246897 0.753103 Cl\n0.753103 0.753103 0.246897 Cl\n",
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{
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"structure_string": "Ca2 In1 Hg1\n1.0\n4.652440 -0.000000 2.686087\n1.550813 4.386362 2.686087\n0.000000 -0.000000 5.372175\nCa In Hg\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ca\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Hg\n",
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{
"id": "jvasp-15808",
"created_at": "2022-09-04T14:36:57.140921Z",
"updated_at": "2022-09-04T14:36:57.140940Z",
"structure_string": "Sr1 Cd2 Sb2\n1.0\n2.388294 -4.136647 0.000000\n2.388294 4.136647 -0.000000\n-0.000000 -0.000000 7.830924\nSr Cd Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.333332 0.666666 0.366781 Cd\n0.666666 0.333332 0.633219 Cd\n0.333332 0.666666 0.752158 Sb\n0.666666 0.333332 0.247842 Sb\n",
"nsites": 5,
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"elements": [
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"chemical_system": "Cd-Sb-Sr",
"density": 5.966435521764381,
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"volume": 154.7316848019944,
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"formula_full": "Sr1 Cd2 Sb2",
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"spacegroup": 164
},
{
"id": "jvasp-107145",
"created_at": "2022-09-04T14:36:57.146242Z",
"updated_at": "2022-09-04T14:36:57.146263Z",
"structure_string": "Rb3 Ce1 Cl6\n1.0\n7.061277 -0.000000 4.076830\n2.353759 6.657436 4.076830\n-0.000000 -0.000000 8.153660\nRb Ce Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Ce\n0.763278 0.236723 0.236722 Cl\n0.236723 0.236723 0.763277 Cl\n0.236723 0.763278 0.763277 Cl\n0.236723 0.763278 0.236722 Cl\n0.763278 0.236723 0.763277 Cl\n0.763278 0.763278 0.236722 Cl\n",
"nsites": 10,
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"elements": [
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"density": 2.639324609558405,
"density_atomic": 0.026088983236396055,
"volume": 383.3035542009649,
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"formula_full": "Rb3 Ce1 Cl6",
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{
"id": "jvasp-29370",
"created_at": "2022-09-04T14:37:03.473999Z",
"updated_at": "2022-09-04T14:37:03.474018Z",
"structure_string": "Yb2 Cl2 O2\n1.0\n3.624060 -0.077334 8.381772\n1.672080 3.216200 8.381772\n-0.130484 -0.077334 9.130766\nYb Cl O\n2 2 2\ndirect\n0.388359 0.388360 0.388358 Yb\n0.611640 0.611642 0.611639 Yb\n0.117097 0.117097 0.117096 Cl\n0.882904 0.882907 0.882902 Cl\n0.302744 0.302745 0.302744 O\n0.697255 0.697257 0.697254 O\n",
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{
"id": "jvasp-104823",
"created_at": "2022-09-04T14:36:57.332226Z",
"updated_at": "2022-09-04T14:36:57.332253Z",
"structure_string": "Rb2 Li1 As1 F6\n1.0\n5.133938 -0.000000 2.964081\n1.711313 4.840323 2.964081\n-0.000000 -0.000000 5.928161\nRb Li As F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.749999 0.750000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 As\n0.248529 0.248529 0.751470 F\n0.248529 0.751470 0.751471 F\n0.751471 0.751470 0.248529 F\n0.248529 0.751470 0.248530 F\n0.751471 0.248529 0.751470 F\n0.751471 0.248529 0.248529 F\n",
"nsites": 10,
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"elements": [
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"density_atomic": 0.06788206525866784,
"volume": 147.31431581956917,
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"formula_full": "Rb2 Li1 As1 F6",
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"formula_anonymous": "ABC2D6",
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"spacegroup": 225
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{
"id": "jvasp-106447",
"created_at": "2022-09-04T14:36:56.797640Z",
"updated_at": "2022-09-04T14:36:56.797666Z",
"structure_string": "Rb2 Bi1 Au1 Cl6\n1.0\n6.577662 -0.000000 3.797615\n2.192554 6.201479 3.797615\n-0.000000 -0.000000 7.595230\nRb Bi Au Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 Au\n0.747575 0.252424 0.252424 Cl\n0.252424 0.252424 0.747576 Cl\n0.252424 0.747576 0.747575 Cl\n0.252424 0.747576 0.252424 Cl\n0.747575 0.252424 0.747575 Cl\n0.747575 0.747576 0.252424 Cl\n",
"nsites": 10,
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"elements": [
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"density": 4.232030508772422,
"density_atomic": 0.03227693144335781,
"volume": 309.8187948116696,
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"formula_full": "Rb2 Bi1 Au1 Cl6",
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{
"id": "jvasp-106627",
"created_at": "2022-09-04T14:36:57.334163Z",
"updated_at": "2022-09-04T14:36:57.334189Z",
"structure_string": "Yb2 Tl1 Ga1\n1.0\n4.530181 -0.000000 2.615501\n1.510060 4.271096 2.615501\n-0.000000 -0.000000 5.231002\nYb Tl Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750001 0.749999 Yb\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500001 0.499999 Ga\n",
"nsites": 4,
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{
"id": "jvasp-102635",
"created_at": "2022-09-04T14:36:56.740408Z",
"updated_at": "2022-09-04T14:36:56.740435Z",
"structure_string": "Yb1 Zn2 Ge2\n1.0\n3.941406 -0.054050 -4.690245\n-0.564407 3.901160 -4.690245\n0.047445 0.054050 6.126241\nYb Zn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.750001 0.250000 0.500002 Zn\n0.250000 0.750000 0.500001 Zn\n0.383991 0.383991 0.000001 Ge\n0.616010 0.616009 0.000001 Ge\n",
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},
{
"id": "jvasp-4098",
"created_at": "2022-09-04T14:37:03.729089Z",
"updated_at": "2022-09-04T14:37:03.729115Z",
"structure_string": "K4 Cd1 As2\n1.0\n5.531076 0.024987 8.179496\n2.524405 4.921464 8.179496\n0.040693 0.024987 9.873971\nK Cd As\n4 1 2\ndirect\n0.207959 0.207959 0.207959 K\n0.792041 0.792041 0.792040 K\n0.390767 0.390767 0.390766 K\n0.609234 0.609234 0.609233 K\n0.000000 0.000000 0.000000 Cd\n0.909939 0.909939 0.909938 As\n0.090062 0.090062 0.090062 As\n",
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},
{
"id": "jvasp-107606",
"created_at": "2022-09-04T14:37:03.534203Z",
"updated_at": "2022-09-04T14:37:03.534228Z",
"structure_string": "K2 Sc1 Ag1 I6\n1.0\n7.164803 -0.000000 4.136601\n2.388268 6.755041 4.136601\n-0.000000 -0.000000 8.273202\nK Sc Ag I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Ag\n0.754304 0.245694 0.245694 I\n0.245694 0.245695 0.754304 I\n0.245695 0.754305 0.754304 I\n0.245695 0.754306 0.245695 I\n0.754304 0.245694 0.754304 I\n0.754305 0.754306 0.245694 I\n",
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