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{
"id": "jvasp-269",
"created_at": "2022-09-04T14:38:08.219276Z",
"updated_at": "2022-09-04T14:38:08.219304Z",
"structure_string": "Sr2 Ti2 O6\n1.0\n4.803531 0.000000 -2.772782\n-1.600556 4.529032 -2.772782\n0.008685 0.012282 5.562225\nSr Ti O\n2 2 6\ndirect\n0.750000 0.250000 0.500001 Sr\n0.250000 0.749999 0.500000 Sr\n0.499999 0.500000 -0.000000 Ti\n0.000000 0.000000 0.000000 Ti\n0.772962 0.272962 0.000000 O\n0.727036 0.772962 -0.000000 O\n0.272962 0.227037 -0.000000 O\n0.227037 0.727037 -0.000000 O\n0.250000 0.250000 0.500001 O\n0.749999 0.749999 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:38:07.825674Z",
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"structure_string": "Rb1 Sr1 Cl3\n1.0\n5.659151 -0.039776 0.000064\n-0.053572 5.649762 0.003776\n0.000504 -0.003198 5.622008\nRb Sr Cl\n1 1 3\ndirect\n-0.067963 0.037686 -0.000572 Rb\n0.512652 0.500556 0.500002 Sr\n0.556992 0.513810 0.000040 Cl\n0.016721 0.458718 0.500514 Cl\n0.541596 -0.000771 0.500016 Cl\n",
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{
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"created_at": "2022-09-04T14:38:18.594077Z",
"updated_at": "2022-09-04T14:38:18.594100Z",
"structure_string": "Ba1 Dy1 O3\n1.0\n4.411688 -0.000000 0.000000\n0.000000 4.411688 0.000000\n0.000000 0.000000 4.411688\nBa Dy O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Dy\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
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},
{
"id": "jvasp-36990",
"created_at": "2022-09-04T14:38:07.831665Z",
"updated_at": "2022-09-04T14:38:07.831692Z",
"structure_string": "Tl2 Ag2 Cl6\n1.0\n6.202048 -0.004880 3.495406\n2.040078 5.856919 3.495406\n-0.006873 -0.004880 7.119215\nTl Ag Cl\n2 2 6\ndirect\n0.255759 0.255759 0.255759 Tl\n0.755760 0.755759 0.755760 Tl\n0.005684 0.005684 0.005684 Ag\n0.505685 0.505684 0.505685 Ag\n0.255679 0.792833 0.718545 Cl\n0.792833 0.718545 0.255679 Cl\n0.718545 0.255678 0.792833 Cl\n0.218545 0.292833 0.755679 Cl\n0.755679 0.218545 0.292833 Cl\n0.292833 0.755679 0.218545 Cl\n",
"nsites": 10,
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"elements": [
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"volume": 258.8874139650674,
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"formula_full": "Tl2 Ag2 Cl6",
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"spacegroup": 167
},
{
"id": "jvasp-36882",
"created_at": "2022-09-04T14:38:07.832061Z",
"updated_at": "2022-09-04T14:38:07.832077Z",
"structure_string": "Rb1 Sn1 Cl3\n1.0\n5.541023 0.001732 0.024952\n-0.002056 5.541047 0.025634\n-0.030519 -0.034437 5.563445\nRb Sn Cl\n1 1 3\ndirect\n0.005537 0.005929 0.041332 Rb\n0.506060 0.510266 0.483580 Sn\n0.505623 0.513596 0.987157 Cl\n0.506640 0.010414 0.459217 Cl\n0.006139 0.509793 0.458715 Cl\n",
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"volume": 170.82396616442378,
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{
"id": "jvasp-37981",
"created_at": "2022-09-04T14:38:17.885253Z",
"updated_at": "2022-09-04T14:38:17.885270Z",
"structure_string": "Co1 Te1 O3\n1.0\n3.790715 -0.000000 -0.000000\n-0.000000 3.790715 -0.000000\n-0.000000 0.000000 3.790715\nCo Te O\n1 1 3\ndirect\n0.499999 0.499999 0.499999 Co\n0.000000 0.000000 0.000000 Te\n0.499999 0.499999 0.000000 O\n0.000000 0.499999 0.499999 O\n0.499999 0.000000 0.499999 O\n",
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},
{
"id": "jvasp-18241",
"created_at": "2022-09-04T14:38:08.658413Z",
"updated_at": "2022-09-04T14:38:08.658433Z",
"structure_string": "Tm3 Pb1 C1\n1.0\n4.810142 -0.000000 0.000000\n0.000000 4.810142 0.000000\n0.000000 0.000000 4.810142\nTm Pb C\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Tm\n0.000000 0.500000 0.500000 Tm\n0.500000 0.500000 0.000000 Tm\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 C\n",
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},
{
"id": "jvasp-17684",
"created_at": "2022-09-04T14:38:07.312091Z",
"updated_at": "2022-09-04T14:38:07.312116Z",
"structure_string": "Mn3 Ni1 N1\n1.0\n3.806313 0.000000 -0.000000\n0.000000 3.806313 0.000000\n0.000000 0.000000 3.806313\nMn Ni N\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 N\n",
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"density": 7.151962788438226,
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"volume": 55.1459337468447,
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"formula_full": "Mn3 Ni1 N1",
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"spacegroup": 221
},
{
"id": "jvasp-36888",
"created_at": "2022-09-04T14:38:07.945165Z",
"updated_at": "2022-09-04T14:38:07.945192Z",
"structure_string": "Rb1 Pb1 Br3\n1.0\n5.925411 0.002075 0.087697\n0.003986 5.892528 -0.001785\n0.100657 0.004813 5.942322\nRb Pb Br\n1 1 3\ndirect\n-0.071873 -0.000538 0.952137 Rb\n0.515058 0.500095 0.500526 Pb\n0.563979 0.000128 0.479155 Br\n0.021184 0.499652 0.554846 Br\n0.531651 0.500661 0.003335 Br\n",
"nsites": 5,
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},
{
"id": "jvasp-55943",
"created_at": "2022-09-04T14:38:08.082366Z",
"updated_at": "2022-09-04T14:38:08.082379Z",
"structure_string": "Rb4 Cd4 Br12\n1.0\n4.243091 0.000000 0.000000\n0.000000 9.431519 0.000000\n0.000000 0.000000 15.661753\nRb Cd Br\n4 4 12\ndirect\n0.750000 0.572585 0.826779 Rb\n0.250000 0.427415 0.173220 Rb\n0.750000 0.072585 0.673220 Rb\n0.250000 0.927415 0.326779 Rb\n0.750000 0.834753 0.057617 Cd\n0.250000 0.165247 0.942382 Cd\n0.750000 0.334753 0.442382 Cd\n0.250000 0.665247 0.557617 Cd\n0.250000 0.028450 0.103381 Br\n0.750000 0.971550 0.896619 Br\n0.250000 0.666127 0.995351 Br\n0.750000 0.333873 0.004649 Br\n0.250000 0.166127 0.504649 Br\n0.250000 0.288372 0.788028 Br\n0.250000 0.788372 0.711972 Br\n0.750000 0.211628 0.288028 Br\n0.750000 0.471550 0.603381 Br\n0.750000 0.711628 0.211972 Br\n0.750000 0.833873 0.495351 Br\n0.250000 0.528450 0.396619 Br\n",
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{
"id": "jvasp-35190",
"created_at": "2022-09-04T14:38:08.125677Z",
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"structure_string": "Sr2 Zr2 O6\n1.0\n5.797563 -0.000000 0.000000\n0.000000 5.797563 0.000000\n0.000000 -0.000000 4.208054\nSr Zr O\n2 2 6\ndirect\n0.000000 0.500000 0.000000 Sr\n0.500000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.500000 Zr\n0.500000 0.500000 0.000000 O\n0.000000 0.000000 0.000000 O\n0.807064 0.692935 0.500000 O\n0.192935 0.307064 0.500000 O\n0.307064 0.807064 0.500000 O\n0.692935 0.192935 0.500000 O\n",
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},
{
"id": "jvasp-108608",
"created_at": "2022-09-04T14:38:18.514908Z",
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"structure_string": "Ho2 Bi2 O6\n1.0\n5.203253 -0.014299 3.157805\n1.770426 4.892815 3.157805\n-0.020440 -0.014299 6.086473\nHo Bi O\n2 2 6\ndirect\n0.776398 0.776396 0.776398 Ho\n0.276397 0.276397 0.276397 Ho\n0.993629 0.993627 0.993630 Bi\n0.493629 0.493628 0.493629 Bi\n0.145079 0.587831 0.918655 O\n0.087833 0.645078 0.418655 O\n0.418655 0.087832 0.645079 O\n0.918655 0.145078 0.587833 O\n0.587833 0.918654 0.145080 O\n0.645079 0.418654 0.087833 O\n",
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