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{
"id": "jvasp-108022",
"created_at": "2022-09-04T14:35:57.886867Z",
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"structure_string": "Rb2 Cu1 F6\n1.0\n5.131300 -0.000000 2.962557\n1.710433 4.837836 2.962557\n-0.000000 -0.000000 5.925115\nRb Cu F\n2 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.749999 0.750001 0.750000 Rb\n0.000000 0.000000 0.000000 Cu\n0.778309 0.221691 0.221691 F\n0.221690 0.778310 0.778309 F\n0.221690 0.778310 0.221691 F\n0.778309 0.221691 0.778309 F\n0.221690 0.221691 0.778309 F\n0.778309 0.778310 0.221691 F\n",
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{
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"structure_string": "Tm2 Cd6\n1.0\n4.820707 0.000000 -0.000000\n0.000000 5.931772 -2.488562\n0.000000 -0.036634 6.432535\nTm Cd\n2 6\ndirect\n0.750000 0.366635 0.633366 Tm\n0.250000 0.633365 0.366635 Tm\n0.750000 0.822610 0.177390 Cd\n0.250000 0.177390 0.822611 Cd\n0.750000 0.313454 0.122946 Cd\n0.250000 0.686546 0.877056 Cd\n0.250000 0.122946 0.313455 Cd\n0.750000 0.877055 0.686546 Cd\n",
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{
"id": "jvasp-68962",
"created_at": "2022-09-04T14:35:41.612855Z",
"updated_at": "2022-09-04T14:35:41.612887Z",
"structure_string": "Ba1 Sr1 Mg2\n1.0\n4.246360 -0.000000 0.000000\n-0.000000 4.246360 -0.000000\n0.000000 -0.000000 8.475200\nBa Sr Mg\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Sr\n-0.000000 0.000000 0.265445 Mg\n-0.000000 0.000000 0.734555 Mg\n",
"nsites": 4,
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"elements": [
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},
{
"id": "jvasp-14661",
"created_at": "2022-09-04T14:35:48.351503Z",
"updated_at": "2022-09-04T14:35:48.351523Z",
"structure_string": "Ba1 Ga4\n1.0\n4.322387 -0.000000 -1.686109\n-0.657730 4.272051 -1.686109\n-0.035882 -0.041829 6.291350\nBa Ga\n1 4\ndirect\n0.000000 0.000000 0.000000 Ba\n0.622201 0.622201 0.244402 Ga\n0.750001 0.250000 0.500000 Ga\n0.250000 0.750000 0.500000 Ga\n0.377799 0.377799 0.755598 Ga\n",
"nsites": 5,
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"elements": [
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"chemical_system": "Ba-Ga",
"density": 5.980704704760284,
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"formula_full": "Ba1 Ga4",
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"spacegroup": 139
},
{
"id": "jvasp-94231",
"created_at": "2022-09-04T14:35:53.359439Z",
"updated_at": "2022-09-04T14:35:53.359458Z",
"structure_string": "Mg6 Ga1 Fe1\n1.0\n6.095578 0.020930 0.000000\n-3.029664 5.289389 0.000000\n0.000000 0.000000 4.801046\nMg Ga Fe\n6 1 1\ndirect\n0.168098 0.841227 0.250000 Mg\n0.658774 0.331902 0.250000 Mg\n0.665572 0.834429 0.250000 Mg\n0.327997 0.646660 0.750001 Mg\n0.853341 0.172004 0.750001 Mg\n0.834213 0.665788 0.750001 Mg\n0.322691 0.177309 0.750001 Ga\n0.169315 0.330685 0.250000 Fe\n",
"nsites": 8,
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"volume": 155.09920296655505,
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"formula_full": "Mg6 Ga1 Fe1",
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"spacegroup": 38
},
{
"id": "jvasp-69242",
"created_at": "2022-09-04T14:35:44.235763Z",
"updated_at": "2022-09-04T14:35:44.235780Z",
"structure_string": "Ba2 Pb1 Cl1\n1.0\n-0.000000 4.189987 4.189987\n4.189987 0.000000 4.189987\n4.189987 4.189987 -0.000000\nBa Pb Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 4,
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},
{
"id": "jvasp-76262",
"created_at": "2022-09-04T14:35:53.165295Z",
"updated_at": "2022-09-04T14:35:53.165305Z",
"structure_string": "Ba9 Ag6\n1.0\n8.372439 0.032191 2.714288\n1.983048 8.134268 2.714286\n0.040820 0.032194 8.801331\nBa Ag\n9 6\ndirect\n0.500000 0.500000 0.500000 Ba\n0.296421 0.296421 0.296421 Ba\n0.703579 0.703579 0.703579 Ba\n0.336921 0.838434 0.103721 Ba\n0.103720 0.336921 0.838434 Ba\n0.838434 0.103720 0.336921 Ba\n0.663079 0.161565 0.896280 Ba\n0.896280 0.663079 0.161566 Ba\n0.161566 0.896280 0.663079 Ba\n0.646681 0.459566 0.090042 Ag\n0.090042 0.646681 0.459566 Ag\n0.459566 0.090042 0.646681 Ag\n0.353319 0.540434 0.909958 Ag\n0.909958 0.353319 0.540435 Ag\n0.540435 0.909958 0.353320 Ag\n",
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"volume": 597.3850164238454,
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"formula_full": "Ba9 Ag6",
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{
"id": "jvasp-66390",
"created_at": "2022-09-04T14:36:10.576195Z",
"updated_at": "2022-09-04T14:36:10.576221Z",
"structure_string": "Ba1 Hg1 Cl1\n1.0\n-0.000000 3.842682 3.842682\n3.842682 -0.000000 3.842682\n3.842682 3.842682 0.000000\nBa Hg Cl\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Cl\n",
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"formula_full": "Ba1 Hg1 Cl1",
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"formula_anonymous": "ABC",
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},
{
"id": "jvasp-105871",
"created_at": "2022-09-04T14:36:06.098434Z",
"updated_at": "2022-09-04T14:36:06.098456Z",
"structure_string": "Yb1 Lu1 Hg2\n1.0\n4.466994 0.000000 2.579020\n1.488998 4.211522 2.579020\n0.000000 0.000000 5.158041\nYb Lu Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Lu\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
"nsites": 4,
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"volume": 97.03741812469283,
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},
{
"id": "jvasp-108002",
"created_at": "2022-09-04T14:35:46.096797Z",
"updated_at": "2022-09-04T14:35:46.096826Z",
"structure_string": "Yb6 Sn2\n1.0\n6.933880 -0.000000 0.000000\n-3.466940 6.004917 0.000000\n-0.000000 -0.000000 5.496477\nYb Sn\n6 2\ndirect\n0.172867 0.345733 0.250000 Yb\n0.654267 0.827134 0.250000 Yb\n0.172867 0.827134 0.250000 Yb\n0.827134 0.654267 0.750000 Yb\n0.345733 0.172867 0.750000 Yb\n0.827133 0.172867 0.750000 Yb\n0.333333 0.666667 0.750000 Sn\n0.666667 0.333334 0.250000 Sn\n",
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{
"id": "jvasp-94794",
"created_at": "2022-09-04T14:35:41.626238Z",
"updated_at": "2022-09-04T14:35:41.626265Z",
"structure_string": "Mg7 V1\n1.0\n-4.358589 -4.358589 0.000000\n-4.358589 0.000000 -4.358589\n0.000000 -4.358589 -4.358589\nMg V\n7 1\ndirect\n0.500000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 V\n",
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{
"id": "jvasp-105077",
"created_at": "2022-09-04T14:36:46.379768Z",
"updated_at": "2022-09-04T14:36:46.379790Z",
"structure_string": "Rb2 Na1 Nd1 Br6\n1.0\n6.960519 -0.000000 4.018658\n2.320173 6.562440 4.018658\n-0.000000 -0.000000 8.037315\nRb Na Nd Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Nd\n0.748467 0.251533 0.251533 Br\n0.251533 0.251533 0.748468 Br\n0.251532 0.748467 0.748468 Br\n0.251532 0.748467 0.251533 Br\n0.748467 0.251533 0.748468 Br\n0.748467 0.748467 0.251533 Br\n",
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