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{
"id": "jvasp-31941",
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"structure_string": "Cu1 H12 I4 N4\n1.0\n5.468622 4.376664 -4.382862\n-5.468622 4.376664 4.382862\n0.083170 0.000000 6.597839\nCu H I N\n1 12 4 4\ndirect\n0.500000 0.500000 0.000000 Cu\n0.719317 0.791365 0.145011 H\n0.208634 0.280682 0.145011 H\n0.791365 0.719317 0.854989 H\n0.555671 0.876198 0.851152 H\n0.123801 0.444328 0.851152 H\n0.280682 0.208634 0.854989 H\n0.876198 0.555671 0.148848 H\n0.495156 0.763626 0.104973 H\n0.236373 0.504843 0.104973 H\n0.504843 0.236373 0.895027 H\n0.763626 0.495156 0.895027 H\n0.444328 0.123801 0.148848 H\n0.907381 0.092618 0.535296 I\n0.092618 0.907381 0.464704 I\n0.699288 0.300711 0.619870 I\n0.300711 0.699288 0.380130 I\n0.238427 0.425304 0.027291 N\n0.761572 0.574695 0.972709 N\n0.425304 0.238427 0.972709 N\n0.574695 0.761572 0.027291 N\n",
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{
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"structure_string": "Cu1 Ge2 P3\n1.0\n3.861855 0.000000 0.000000\n-1.930928 3.344464 0.000000\n-0.000000 0.000000 9.432423\nCu Ge P\n1 2 3\ndirect\n0.000000 0.000000 0.981880 Cu\n0.666665 0.333333 0.327690 Ge\n0.333332 0.666666 0.692815 Ge\n0.000000 0.000000 0.226327 P\n0.666665 0.333333 0.585633 P\n0.333332 0.666666 0.935653 P\n",
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},
{
"id": "jvasp-40621",
"created_at": "2022-09-04T14:37:48.921705Z",
"updated_at": "2022-09-04T14:37:48.921725Z",
"structure_string": "Cu1 Ge1 Rh2\n1.0\n0.000000 2.999564 2.999564\n2.999564 0.000000 2.999564\n2.999564 2.999564 0.000000\nCu Ge Rh\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Cu\n0.750000 0.750000 0.750000 Ge\n0.000000 0.000000 0.000000 Rh\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 4,
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},
{
"id": "jvasp-93259",
"created_at": "2022-09-04T14:36:34.952265Z",
"updated_at": "2022-09-04T14:36:34.952290Z",
"structure_string": "Cu1 Ge1 I3\n1.0\n4.989585 4.006170 4.224479\n-1.226748 2.874762 2.914770\n-2.598897 -6.397531 2.178072\nCu Ge I\n1 1 3\ndirect\n0.107794 0.196046 0.000000 Cu\n0.805894 -0.007300 0.000000 Ge\n0.344527 0.462679 0.000000 I\n0.031538 0.418288 0.345291 I\n0.686247 0.418288 0.654708 I\n",
"nsites": 5,
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"elements": [
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"density": 5.068162743327798,
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{
"id": "jvasp-118212",
"created_at": "2022-09-04T14:38:37.449855Z",
"updated_at": "2022-09-04T14:38:37.449882Z",
"structure_string": "Cu1 F3\n1.0\n5.956960 0.982130 0.534512\n-3.591227 -2.798331 -0.317753\n-0.578067 -1.229114 -3.522043\nCu F\n1 3\ndirect\n0.908274 0.930730 -0.018655 Cu\n0.539079 0.862705 0.837769 F\n0.908232 0.930616 0.481359 F\n0.277504 -0.001225 0.124851 F\n",
"nsites": 4,
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"elements": [
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},
{
"id": "jvasp-118213",
"created_at": "2022-09-04T14:38:37.485972Z",
"updated_at": "2022-09-04T14:38:37.485982Z",
"structure_string": "Cu1 F1\n1.0\n2.815246 -0.124782 0.310680\n1.293064 -2.507788 0.135298\n-0.046345 -1.808401 -3.546803\nCu F\n1 1\ndirect\n0.955563 0.000646 0.002303 Cu\n0.455787 0.500059 0.502264 F\n",
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"elements": [
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{
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"created_at": "2022-09-04T14:37:50.856819Z",
"updated_at": "2022-09-04T14:37:50.856846Z",
"structure_string": "Cu1 F1\n1.0\n2.958284 -0.000000 1.707967\n0.986095 2.789097 1.707967\n0.000000 -0.000000 3.415933\nCu F\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 F\n",
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},
{
"id": "jvasp-8760",
"created_at": "2022-09-04T14:37:04.304261Z",
"updated_at": "2022-09-04T14:37:04.304281Z",
"structure_string": "Cu1 Cl4\n1.0\n7.367728 0.000000 -0.000000\n7.367728 6.486871 1.414154\n3.683865 4.991647 3.529227\nCu Cl\n1 4\ndirect\n0.236696 0.500123 0.026362 Cu\n0.120241 0.026034 0.207451 Cl\n0.646464 -0.026576 0.260222 Cl\n0.367750 0.500210 0.252982 Cl\n0.878849 0.500210 0.252982 Cl\n",
"nsites": 5,
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"density": 2.9229256858232295,
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"formula_full": "Cu1 Cl4",
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"spacegroup": 42
},
{
"id": "jvasp-8734",
"created_at": "2022-09-04T14:37:05.925768Z",
"updated_at": "2022-09-04T14:37:05.925799Z",
"structure_string": "Cu1 Cl2\n1.0\n3.182811 -0.000000 0.914429\n1.593250 3.448542 0.450795\n0.045560 -0.035912 5.837769\nCu Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.262163 0.229963 0.245712 Cl\n0.737837 0.770037 0.754288 Cl\n",
"nsites": 3,
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"volume": 63.9312223352037,
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},
{
"id": "jvasp-105092",
"created_at": "2022-09-04T14:36:49.417100Z",
"updated_at": "2022-09-04T14:36:49.417129Z",
"structure_string": "Cu1 Cl2\n1.0\n4.517915 0.000000 0.000000\n0.000000 4.517915 0.000000\n0.000000 0.000000 3.680498\nCu Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500001 0.000000 -0.000000 Cl\n-0.000000 0.500001 -0.000000 Cl\n",
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},
{
"id": "jvasp-102815",
"created_at": "2022-09-04T14:36:45.714408Z",
"updated_at": "2022-09-04T14:36:45.714424Z",
"structure_string": "Cu1 Cl2\n1.0\n3.161749 -0.140407 5.067347\n1.345155 2.864774 5.067347\n-0.232275 -0.140407 5.968309\nCu Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.747009 0.747005 0.747009 Cl\n0.252993 0.252992 0.252993 Cl\n",
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{
"id": "jvasp-54956",
"created_at": "2022-09-04T14:38:27.635467Z",
"updated_at": "2022-09-04T14:38:27.635488Z",
"structure_string": "Cu1 Cl1\n1.0\n3.126379 0.000000 1.805015\n1.042126 2.947578 1.805015\n0.000000 0.000000 3.610031\nCu Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500001 0.500000 0.500001 Cl\n",
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