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{
"id": "jvasp-39250",
"created_at": "2022-09-04T14:37:56.013059Z",
"updated_at": "2022-09-04T14:37:56.013086Z",
"structure_string": "Hg3 C1\n1.0\n-2.164298 2.164298 4.220648\n2.164298 -2.164298 4.220648\n2.164298 2.164298 -4.220648\nHg C\n3 1\ndirect\n0.750001 0.250000 0.500001 Hg\n0.250000 0.750001 0.500001 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 C\n",
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{
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"created_at": "2022-09-04T14:38:37.096497Z",
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"structure_string": "Hg3 Cl1\n1.0\n4.572475 -0.000000 2.639920\n1.524158 4.310971 2.639920\n-0.000000 -0.000000 5.279839\nHg Cl\n3 1\ndirect\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750001 Hg\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Cl\n",
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{
"id": "jvasp-37682",
"created_at": "2022-09-04T14:38:05.082502Z",
"updated_at": "2022-09-04T14:38:05.082527Z",
"structure_string": "Hg3 F1\n1.0\n-2.300291 2.300291 3.942644\n2.300291 -2.300291 3.942644\n2.300291 2.300291 -3.942644\nHg F\n3 1\ndirect\n0.750000 0.250000 0.500000 Hg\n0.250000 0.750000 0.500000 Hg\n0.499999 0.499999 0.000000 Hg\n0.000000 0.000000 0.000000 F\n",
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{
"id": "jvasp-39330",
"created_at": "2022-09-04T14:38:00.255993Z",
"updated_at": "2022-09-04T14:38:00.256018Z",
"structure_string": "Hg3 F1\n1.0\n0.000000 3.476484 3.476484\n3.476484 0.000000 3.476484\n3.476484 3.476484 -0.000000\nHg F\n3 1\ndirect\n0.000000 0.000000 0.000000 Hg\n0.499999 0.499999 0.499999 Hg\n0.250000 0.250000 0.250000 Hg\n0.749999 0.749999 0.749999 F\n",
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"spacegroup": 225
},
{
"id": "jvasp-39329",
"created_at": "2022-09-04T14:37:59.892881Z",
"updated_at": "2022-09-04T14:37:59.892901Z",
"structure_string": "Hg3 F1\n1.0\n4.372429 0.000000 0.000000\n0.000000 4.372429 0.000000\n-0.000000 -0.000000 4.372429\nHg F\n3 1\ndirect\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 F\n",
"nsites": 4,
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"elements": [
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"density": 12.331343701329702,
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"volume": 83.59268947416872,
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"spacegroup": 221
},
{
"id": "jvasp-37649",
"created_at": "2022-09-04T14:38:00.627661Z",
"updated_at": "2022-09-04T14:38:00.627670Z",
"structure_string": "Hg3 Ir1\n1.0\n-2.067994 2.067994 4.612254\n2.067994 -2.067994 4.612254\n2.067994 2.067994 -4.612254\nHg Ir\n3 1\ndirect\n0.749999 0.250000 0.499998 Hg\n0.250000 0.749999 0.499998 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 4,
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"elements": [
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"density": 16.710549567027847,
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"volume": 78.89904677186712,
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{
"id": "jvasp-8145",
"created_at": "2022-09-04T14:36:37.203745Z",
"updated_at": "2022-09-04T14:36:37.203769Z",
"structure_string": "Hg3 O3\n1.0\n1.831694 -3.172586 0.000000\n1.831694 3.172586 -0.000000\n0.000000 -0.000000 8.879471\nHg O\n3 3\ndirect\n0.238857 -0.000000 0.833333 Hg\n-0.000000 0.238857 0.166667 Hg\n0.761142 0.761142 0.500000 Hg\n0.545108 -0.000001 0.333333 O\n-0.000001 0.545108 0.666667 O\n0.454891 0.454891 0.000000 O\n",
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"elements": [
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"density": 10.455002362217119,
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"volume": 103.2008834578162,
"volume_molar": 10.358170778988747,
"formula_full": "Hg3 O3",
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"spacegroup": 152
},
{
"id": "jvasp-93803",
"created_at": "2022-09-04T14:36:16.534422Z",
"updated_at": "2022-09-04T14:36:16.534438Z",
"structure_string": "Hg3 O3\n1.0\n-1.831757 -3.172696 -0.000000\n-1.831757 3.172696 0.000000\n0.000000 0.000000 -8.879724\nHg O\n3 3\ndirect\n0.238845 0.000000 0.000033 Hg\n0.761156 0.761156 0.333367 Hg\n0.000000 0.238845 0.666700 Hg\n0.545199 0.000000 0.500033 O\n0.454802 0.454802 0.833367 O\n0.000000 0.545199 0.166700 O\n",
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"elements": [
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"density": 10.45398244794889,
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"formula_full": "Hg3 O3",
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"spacegroup": 154
},
{
"id": "jvasp-38162",
"created_at": "2022-09-04T14:38:15.317241Z",
"updated_at": "2022-09-04T14:38:15.317256Z",
"structure_string": "Hg3 Pd1\n1.0\n4.347217 0.000000 0.000000\n0.000000 4.347217 0.000000\n0.000000 -0.000000 4.347217\nHg Pd\n3 1\ndirect\n0.500000 0.000000 0.500000 Hg\n0.000000 0.500000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 Pd\n",
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"elements": [
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"chemical_system": "Hg-Pd",
"density": 14.314129081203577,
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"volume": 82.15499209935685,
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"formula_full": "Hg3 Pd1",
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"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-107933",
"created_at": "2022-09-04T14:35:46.812763Z",
"updated_at": "2022-09-04T14:35:46.812787Z",
"structure_string": "Hg3 Pt1\n1.0\n3.881993 -0.017486 -3.874202\n-0.680116 3.821991 -3.874202\n0.014716 0.017486 5.484441\nHg Pt\n3 1\ndirect\n0.750000 0.250000 0.500000 Hg\n0.250000 0.750000 0.500000 Hg\n0.499999 0.499999 -0.000001 Hg\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
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"elements": [
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"formula_full": "Hg3 Pt1",
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"spacegroup": 139
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{
"id": "jvasp-107930",
"created_at": "2022-09-04T14:38:17.549879Z",
"updated_at": "2022-09-04T14:38:17.549904Z",
"structure_string": "Hg3 Pt1\n1.0\n4.338732 0.000000 0.000000\n0.000000 4.338732 0.000000\n0.000000 0.000000 4.338732\nHg Pt\n3 1\ndirect\n-0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.500000 0.500000 -0.000000 Hg\n0.000000 0.000000 0.000000 Pt\n",
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"formula_full": "Hg3 Pt1",
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{
"id": "jvasp-79033",
"created_at": "2022-09-04T14:37:11.721114Z",
"updated_at": "2022-09-04T14:37:11.721123Z",
"structure_string": "Hg3 Rh1\n1.0\n-2.068015 2.068015 4.634913\n2.068015 -2.068015 4.634913\n2.068015 2.068015 -4.634913\nHg Rh\n3 1\ndirect\n0.750002 0.250000 0.500001 Hg\n0.250000 0.750002 0.500001 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 Rh\n",
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"elements": [
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