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{
"id": "jvasp-81066",
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"updated_at": "2022-09-04T14:37:11.269096Z",
"structure_string": "Ca2 Zn1 Ag1\n1.0\n-10.360667 -0.000000 -5.981735\n-6.927656 0.331335 0.035584\n-5.918967 3.184338 -1.711517\nCa Zn Ag\n2 1 1\ndirect\n0.744812 -0.000001 0.000000 Ca\n0.255189 -0.000000 0.000000 Ca\n0.000000 0.000000 0.000000 Zn\n0.500000 -0.000000 0.000000 Ag\n",
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{
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"structure_string": "Ca4 Zn1 Ag3\n1.0\n4.045967 -0.000000 0.000000\n0.000000 4.595346 0.000000\n-0.000000 -0.000000 11.290923\nCa Zn Ag\n4 1 3\ndirect\n0.500000 0.500000 0.142295 Ca\n-0.000000 0.500000 0.642485 Ca\n0.000000 0.000000 0.358000 Ca\n0.500000 0.000000 0.858110 Ca\n0.500000 0.500000 0.427189 Zn\n-0.000000 0.500000 0.922121 Ag\n0.000000 0.000000 0.078334 Ag\n0.500000 0.000000 0.571466 Ag\n",
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{
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"structure_string": "Ca2 Zn3 Ag1\n1.0\n4.481469 0.038442 3.624106\n2.094267 3.962208 3.624106\n0.005712 0.003475 7.318939\nCa Zn Ag\n2 3 1\ndirect\n0.547721 0.547720 0.699482 Ca\n0.452684 0.452683 0.297086 Ca\n0.828344 0.828342 0.732490 Zn\n0.842590 0.842590 0.099783 Zn\n0.166841 0.166839 0.886593 Zn\n0.161825 0.161824 0.284571 Ag\n",
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"formula_full": "Ca2 Zn3 Ag1",
"formula_reduced": "Ca2Zn3Ag",
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{
"id": "jvasp-101224",
"created_at": "2022-09-04T14:36:38.783673Z",
"updated_at": "2022-09-04T14:36:38.783683Z",
"structure_string": "Ca2 Zn2 Ag2\n1.0\n4.592053 0.044011 3.596681\n2.271060 3.991388 3.596681\n0.038196 0.022459 7.295877\nCa Zn Ag\n2 2 2\ndirect\n0.452243 0.452243 0.301174 Ca\n0.547757 0.547758 0.698826 Ca\n0.158218 0.158217 0.893209 Zn\n0.841782 0.841783 0.106791 Zn\n0.829127 0.829128 0.727846 Ag\n0.170873 0.170873 0.272154 Ag\n",
"nsites": 6,
"nelements": 3,
"elements": [
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],
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"density": 5.357207086481835,
"density_atomic": 0.04536358406040083,
"volume": 132.26468155626998,
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"formula_reduced": "CaZnAg",
"formula_anonymous": "ABC",
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"spacegroup": 12
},
{
"id": "jvasp-86791",
"created_at": "2022-09-04T14:35:49.426951Z",
"updated_at": "2022-09-04T14:35:49.426969Z",
"structure_string": "Rb1 Cd1 Ag3 C6 N6\n1.0\n6.873339 0.000000 0.000000\n-3.436670 5.952486 -0.000000\n-0.000000 0.000000 8.486904\nRb Cd Ag C N\n1 1 3 6 6\ndirect\n0.333333 0.666667 0.000000 Rb\n0.000000 0.000000 0.000000 Cd\n0.508212 0.016423 0.500000 Ag\n0.508212 0.491789 0.500000 Ag\n0.983577 0.491789 0.500000 Ag\n0.986589 0.344168 0.291909 C\n0.357579 0.344168 0.708090 C\n0.986589 0.642422 0.708090 C\n0.655832 0.642422 0.291909 C\n0.655832 0.013411 0.708090 C\n0.357579 0.013411 0.291909 C\n0.990499 0.262458 0.172095 N\n0.737542 0.728041 0.172095 N\n0.737542 0.009502 0.827904 N\n0.271960 0.262458 0.827904 N\n0.271960 0.009502 0.172095 N\n0.990499 0.728041 0.827904 N\n",
"nsites": 17,
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"elements": [
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],
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"density": 3.2404045908559693,
"density_atomic": 0.048959106661584685,
"volume": 347.2285578555888,
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"formula_full": "Rb1 Cd1 Ag3 C6 N6",
"formula_reduced": "RbCdAg3(CN)6",
"formula_anonymous": "ABC3D6E6",
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{
"id": "jvasp-86189",
"created_at": "2022-09-04T14:35:42.247945Z",
"updated_at": "2022-09-04T14:35:42.247977Z",
"structure_string": "Rb1 Cd1 Ag3 C6 N6\n1.0\n6.870921 0.000000 -0.000000\n-3.435461 5.950392 -0.000000\n-0.000000 0.000000 8.489219\nRb Cd Ag C N\n1 1 3 6 6\ndirect\n0.333333 0.666667 0.000000 Rb\n0.000000 0.000000 0.000000 Cd\n0.508280 0.016559 0.500000 Ag\n0.508280 0.491720 0.500000 Ag\n0.983441 0.491720 0.500000 Ag\n0.986540 0.344130 0.291944 C\n0.357589 0.344130 0.708056 C\n0.986540 0.642410 0.708056 C\n0.655870 0.642410 0.291944 C\n0.655870 0.013460 0.708056 C\n0.357589 0.013460 0.291944 C\n0.990531 0.262515 0.172125 N\n0.737485 0.728016 0.172125 N\n0.737485 0.009469 0.827875 N\n0.271984 0.262515 0.827875 N\n0.271984 0.009469 0.172125 N\n0.990531 0.728016 0.827875 N\n",
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"elements": [
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"C",
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],
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"density": 3.2418014013845067,
"density_atomic": 0.04898021100017427,
"volume": 347.07894582037454,
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"formula_full": "Rb1 Cd1 Ag3 C6 N6",
"formula_reduced": "RbCdAg3(CN)6",
"formula_anonymous": "ABC3D6E6",
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"spacegroup": 149
},
{
"id": "jvasp-9984",
"created_at": "2022-09-04T14:37:19.664695Z",
"updated_at": "2022-09-04T14:37:19.664720Z",
"structure_string": "Co1 Ag3 C6 N6\n1.0\n3.236579 -5.605919 -0.000000\n3.236579 5.605919 -0.000000\n0.000000 -0.000000 7.551127\nCo Ag C N\n1 3 6 6\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Ag\n0.500000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.770630 0.000000 0.151304 C\n0.000000 0.770630 0.151304 C\n0.229370 0.229370 0.151304 C\n0.000000 0.229370 0.848696 C\n0.229370 0.000000 0.848696 C\n0.770630 0.770630 0.848696 C\n0.000000 0.356235 0.739069 N\n0.356235 0.356235 0.260932 N\n0.000000 0.643765 0.260932 N\n0.643765 0.000000 0.260932 N\n0.356235 0.000000 0.739069 N\n0.643765 0.643765 0.739069 N\n",
"nsites": 16,
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"elements": [
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],
"chemical_system": "Ag-C-Co-N",
"density": 3.2641842741444114,
"density_atomic": 0.058390901729543844,
"volume": 274.0152922129739,
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"formula_full": "Co1 Ag3 C6 N6",
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"formula_anonymous": "AB3C6D6",
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},
{
"id": "jvasp-14994",
"created_at": "2022-09-04T14:36:47.944262Z",
"updated_at": "2022-09-04T14:36:47.944288Z",
"structure_string": "Cd1 Ag1\n1.0\n3.372443 -0.000000 -0.000000\n0.000000 3.372443 0.000000\n0.000000 0.000000 3.372443\nCd Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
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"elements": [
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"density": 9.536493865498514,
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"formula_full": "Cd1 Ag1",
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"spacegroup": 221
},
{
"id": "jvasp-109776",
"created_at": "2022-09-04T14:38:20.439565Z",
"updated_at": "2022-09-04T14:38:20.439592Z",
"structure_string": "Cd1 Ag1\n1.0\n3.043812 0.507794 0.000000\n-0.544641 3.037435 0.000000\n0.000000 0.000000 4.031926\nCd Ag\n1 1\ndirect\n0.500000 0.499999 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
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"elements": [
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"density": 9.527617134131681,
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"volume": 38.39178380174604,
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},
{
"id": "jvasp-106108",
"created_at": "2022-09-04T14:36:19.928267Z",
"updated_at": "2022-09-04T14:36:19.928299Z",
"structure_string": "Cd1 Ag1\n1.0\n3.058762 0.077976 0.000000\n-1.595730 2.610699 0.000000\n0.000000 0.000000 4.761701\nCd Ag\n1 1\ndirect\n0.333251 0.666750 0.500000 Cd\n0.666750 0.333252 0.000000 Ag\n",
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"elements": [
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},
{
"id": "jvasp-106372",
"created_at": "2022-09-04T14:38:40.227804Z",
"updated_at": "2022-09-04T14:38:40.227834Z",
"structure_string": "Cd1 Ag1\n1.0\n2.894306 -0.009336 4.218387\n1.301145 2.585365 4.218387\n-0.015205 -0.009336 5.115815\nCd Ag\n1 1\ndirect\n0.500001 0.499999 0.500001 Cd\n0.000000 0.000000 0.000000 Ag\n",
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},
{
"id": "jvasp-106234",
"created_at": "2022-09-04T14:36:41.659494Z",
"updated_at": "2022-09-04T14:36:41.659513Z",
"structure_string": "Cd1 Ag3\n1.0\n3.796999 -0.037386 -3.428673\n-0.774393 3.717380 -3.428673\n0.030708 0.037386 5.115863\nCd Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750001 0.250000 0.500001 Ag\n0.250001 0.750000 0.500001 Ag\n0.500000 0.499999 0.000001 Ag\n",
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