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{
"id": "jvasp-2505",
"created_at": "2022-09-04T14:36:58.732195Z",
"updated_at": "2022-09-04T14:36:58.732209Z",
"structure_string": "Rb1 Cd1 F3\n1.0\n4.449817 0.000000 0.000000\n0.000000 4.449817 0.000000\n0.000000 0.000000 4.449817\nRb Cd F\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Cd\n0.000000 0.500000 0.500000 F\n0.500000 0.000000 0.500000 F\n0.500000 0.500000 0.000000 F\n",
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{
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{
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"structure_string": "Ba4 Cu4\n1.0\n2.239961 -3.879726 -0.000000\n2.239961 3.879726 0.000000\n-0.000000 0.000000 16.229911\nBa Cu\n4 4\ndirect\n0.333333 0.666667 0.878342 Ba\n0.666667 0.333333 0.378342 Ba\n0.666667 0.333333 0.121658 Ba\n0.333333 0.666667 0.621658 Ba\n0.000000 0.000000 0.750000 Cu\n0.000000 0.000000 0.250000 Cu\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.750000 Cu\n",
"nsites": 8,
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{
"id": "jvasp-7786",
"created_at": "2022-09-04T14:36:41.080595Z",
"updated_at": "2022-09-04T14:36:41.080606Z",
"structure_string": "Zn1 Sn1 F6\n1.0\n4.585207 0.070264 3.141798\n1.692767 4.261878 3.141798\n0.101824 0.070264 5.557396\nZn Sn F\n1 1 6\ndirect\n0.500000 0.499999 0.500001 Zn\n0.000000 0.000000 0.000000 Sn\n0.247599 0.898246 0.607572 F\n0.898247 0.607571 0.247599 F\n0.392429 0.752402 0.101754 F\n0.101754 0.392428 0.752403 F\n0.752402 0.101753 0.392429 F\n0.607572 0.247597 0.898248 F\n",
"nsites": 8,
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},
{
"id": "jvasp-101513",
"created_at": "2022-09-04T14:36:41.065810Z",
"updated_at": "2022-09-04T14:36:41.065833Z",
"structure_string": "Rb2 Hg1 Au1 F6\n1.0\n5.543606 -0.000000 3.200602\n1.847869 5.226562 3.200602\n-0.000000 -0.000000 6.401205\nRb Hg Au F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.499999 Hg\n0.000000 0.000000 0.000000 Au\n0.752512 0.247489 0.247488 F\n0.247489 0.247489 0.752510 F\n0.247489 0.752511 0.752510 F\n0.247489 0.752511 0.247488 F\n0.752512 0.247489 0.752510 F\n0.752512 0.752511 0.247488 F\n",
"nsites": 10,
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"elements": [
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"density": 6.110411732224131,
"density_atomic": 0.05391750676420505,
"volume": 185.4685166310182,
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"formula_full": "Rb2 Hg1 Au1 F6",
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{
"id": "jvasp-82065",
"created_at": "2022-09-04T14:36:51.560967Z",
"updated_at": "2022-09-04T14:36:51.560998Z",
"structure_string": "Li1 Cd1 Hg2\n1.0\n-11.850093 2.648331 -2.516947\n-8.367555 1.565350 1.005845\n-7.420513 4.243989 -0.634479\nLi Cd Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 -0.000001 -0.000000 Cd\n0.691947 0.040572 0.040572 Hg\n0.308055 0.959424 0.959428 Hg\n",
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{
"id": "jvasp-107389",
"created_at": "2022-09-04T14:36:51.563224Z",
"updated_at": "2022-09-04T14:36:51.563242Z",
"structure_string": "K1 Rb2 Co1 F6\n1.0\n5.320036 -0.000000 3.071524\n1.773345 5.015778 3.071524\n-0.000000 -0.000000 6.143049\nK Rb Co F\n1 2 1 6\ndirect\n0.500001 0.500000 0.499999 K\n0.750001 0.750000 0.749998 Rb\n0.250000 0.250000 0.249999 Rb\n0.000000 0.000000 0.000000 Co\n0.785528 0.214473 0.214472 F\n0.785528 0.785527 0.214471 F\n0.214473 0.214473 0.785527 F\n0.214474 0.785527 0.785526 F\n0.785528 0.214473 0.785526 F\n0.214474 0.785527 0.214472 F\n",
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"density_atomic": 0.061004678566373496,
"volume": 163.92185378241004,
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"formula_full": "K1 Rb2 Co1 F6",
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"formula_anonymous": "ABC2D6",
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{
"id": "jvasp-100761",
"created_at": "2022-09-04T14:37:02.537392Z",
"updated_at": "2022-09-04T14:37:02.537414Z",
"structure_string": "Tl6 Sn2\n1.0\n7.062892 0.000000 0.000000\n-3.531445 6.116644 0.000000\n-0.000000 -0.000000 5.585300\nTl Sn\n6 2\ndirect\n0.169860 0.339720 0.250000 Tl\n0.660279 0.830139 0.250000 Tl\n0.169859 0.830139 0.250000 Tl\n0.830139 0.660280 0.750000 Tl\n0.339720 0.169860 0.750000 Tl\n0.830140 0.169860 0.750000 Tl\n0.333333 0.666666 0.750000 Sn\n0.666666 0.333333 0.250000 Sn\n",
"nsites": 8,
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},
{
"id": "jvasp-2703",
"created_at": "2022-09-04T14:36:51.776810Z",
"updated_at": "2022-09-04T14:36:51.776826Z",
"structure_string": "Na6 Sb2\n1.0\n2.668617 -4.622181 0.000000\n2.668617 4.622181 0.000000\n0.000000 0.000000 9.491715\nNa Sb\n6 2\ndirect\n0.333334 0.666668 0.082540 Na\n0.666668 0.333334 0.582539 Na\n0.000000 0.000000 0.750000 Na\n0.000000 0.000000 0.250000 Na\n0.333334 0.666668 0.417460 Na\n0.666668 0.333334 0.917460 Na\n0.666668 0.333334 0.250000 Sb\n0.333334 0.666668 0.750000 Sb\n",
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},
{
"id": "jvasp-58881",
"created_at": "2022-09-04T14:36:57.649284Z",
"updated_at": "2022-09-04T14:36:57.649304Z",
"structure_string": "K4 In4 Br12\n1.0\n4.254016 -7.368170 0.000000\n4.254015 7.368170 -0.000000\n0.000000 -0.000000 10.796943\nK In Br\n4 4 12\ndirect\n0.333334 0.666668 0.130010 K\n0.666668 0.333334 0.869989 K\n0.000000 0.000000 0.739240 K\n0.000000 0.000000 0.260760 K\n0.333334 0.666668 0.759086 In\n0.666668 0.333334 0.240913 In\n0.333334 0.666668 0.503991 In\n0.666668 0.333334 0.496008 In\n0.914502 0.612146 0.624477 Br\n0.612146 0.697645 0.375523 Br\n0.302357 0.914502 0.375523 Br\n0.085499 0.387855 0.375523 Br\n0.906110 0.620648 0.117049 Br\n0.620648 0.714539 0.882951 Br\n0.714539 0.093891 0.117049 Br\n0.093891 0.379353 0.882951 Br\n0.697644 0.085499 0.624477 Br\n0.285462 0.906110 0.882951 Br\n0.379353 0.285462 0.117049 Br\n0.387855 0.302356 0.624477 Br\n",
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},
{
"id": "jvasp-107705",
"created_at": "2022-09-04T14:36:57.602812Z",
"updated_at": "2022-09-04T14:36:57.602837Z",
"structure_string": "Yb2 Tl1 Zn1\n1.0\n4.523137 -0.000000 2.611434\n1.507712 4.264455 2.611434\n-0.000000 -0.000000 5.222869\nYb Tl Zn\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.749999 0.749999 Yb\n0.500000 0.499999 0.499999 Tl\n0.000000 0.000000 0.000000 Zn\n",
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{
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"created_at": "2022-09-04T14:36:51.659511Z",
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"structure_string": "K2 Na1 Cd1\n1.0\n-17.905839 -0.000000 -10.337941\n-10.499903 -0.537389 -2.489516\n-9.215253 3.096150 -4.714596\nK Na Cd\n2 1 1\ndirect\n0.664954 0.000000 0.000000 K\n0.335046 0.000000 0.000000 K\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.000000 Cd\n",
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