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{
"id": "jvasp-12750",
"created_at": "2022-09-04T14:38:14.160115Z",
"updated_at": "2022-09-04T14:38:14.160137Z",
"structure_string": "Na6 Bi2 O8\n1.0\n0.000000 5.733645 -0.018537\n6.747016 0.000000 0.000000\n0.000000 -2.010637 -5.531313\nNa Bi O\n6 2 8\ndirect\n0.250000 0.619076 0.000000 Na\n0.750000 0.602835 0.500000 Na\n0.250000 0.869738 0.500000 Na\n0.750000 0.130262 0.500000 Na\n0.750001 0.380924 0.000000 Na\n0.250000 0.397166 0.500000 Na\n0.250000 0.138319 0.000000 Bi\n0.750001 0.861682 0.000000 Bi\n0.027983 0.350114 0.762105 O\n0.472017 0.350114 0.237894 O\n0.972017 0.649887 0.237895 O\n0.527984 0.649887 0.762106 O\n0.501091 0.102895 0.786867 O\n-0.001091 0.102895 0.213132 O\n0.001090 0.897106 0.786867 O\n0.498909 0.897106 0.213133 O\n",
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"structure_string": "Nd2 Mn2 Sb2 O2\n1.0\n4.150088 -0.000000 0.000000\n-0.000000 4.150088 0.000000\n-0.000000 0.000000 9.296109\nNd Mn Sb O\n2 2 2 2\ndirect\n0.500000 0.000000 0.877553 Nd\n0.000000 0.500000 0.122447 Nd\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.323767 Sb\n0.000000 0.500000 0.676233 Sb\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
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{
"id": "jvasp-18143",
"created_at": "2022-09-04T14:38:14.156725Z",
"updated_at": "2022-09-04T14:38:14.156755Z",
"structure_string": "Tb3 In3 Ir3\n1.0\n3.759713 -6.512014 -0.000000\n3.759713 6.512014 -0.000000\n-0.000000 -0.000000 3.956847\nTb In Ir\n3 3 3\ndirect\n0.405670 0.405670 0.000000 Tb\n0.594330 -0.000000 0.000000 Tb\n-0.000000 0.594330 0.000000 Tb\n-0.000000 0.257598 0.500000 In\n0.742402 0.742402 0.500000 In\n0.257598 -0.000000 0.500000 In\n0.000000 0.000000 0.000000 Ir\n0.333333 0.666667 0.500000 Ir\n0.666667 0.333333 0.500000 Ir\n",
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"volume": 193.7533735274158,
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"formula_full": "Tb3 In3 Ir3",
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"spacegroup": 189
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{
"id": "jvasp-17434",
"created_at": "2022-09-04T14:38:14.155821Z",
"updated_at": "2022-09-04T14:38:14.155849Z",
"structure_string": "Pr3 Mg3 Pt3\n1.0\n3.797928 -6.578204 0.000000\n3.797928 6.578204 0.000000\n0.000000 0.000000 4.151803\nPr Mg Pt\n3 3 3\ndirect\n0.000000 0.587549 0.000000 Pr\n0.587549 0.000000 0.000000 Pr\n0.412451 0.412451 0.000000 Pr\n0.760298 0.760298 0.500000 Mg\n0.000000 0.239703 0.500000 Mg\n0.239703 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Pt\n0.333333 0.666667 0.500000 Pt\n0.666667 0.333333 0.500000 Pt\n",
"nsites": 9,
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},
{
"id": "jvasp-9378",
"created_at": "2022-09-04T14:38:14.155507Z",
"updated_at": "2022-09-04T14:38:14.155536Z",
"structure_string": "Er4 Cd2 S8\n1.0\n6.841453 -0.000000 3.949914\n2.280485 6.450184 3.949914\n0.000000 0.000000 7.899830\nEr Cd S\n4 2 8\ndirect\n0.500000 0.500000 -0.000000 Er\n0.500000 0.500000 0.500000 Er\n-0.000000 0.500000 0.500000 Er\n0.500000 -0.000000 0.500000 Er\n0.125000 0.125000 0.125000 Cd\n0.874999 0.875000 0.875000 Cd\n0.742236 0.742236 0.742236 S\n0.257763 0.257764 0.726709 S\n0.257763 0.726708 0.257764 S\n0.726708 0.257764 0.257764 S\n0.742236 0.273291 0.742236 S\n0.273291 0.742236 0.742236 S\n0.257763 0.257764 0.257764 S\n0.742236 0.742236 0.273291 S\n",
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{
"id": "jvasp-12904",
"created_at": "2022-09-04T14:38:14.147487Z",
"updated_at": "2022-09-04T14:38:14.147496Z",
"structure_string": "Ge2 H6 Cl2\n1.0\n4.463010 0.004778 0.000000\n-1.093428 4.326997 -0.000000\n0.000000 0.000000 8.274099\nGe H Cl\n2 6 2\ndirect\n0.558701 0.558701 0.952912 Ge\n0.441299 0.441300 0.452912 Ge\n0.198207 0.564018 0.544612 H\n0.801793 0.435983 0.044612 H\n0.435982 0.801794 0.044612 H\n0.564018 0.198207 0.544612 H\n0.686270 0.686271 0.364581 H\n0.313730 0.313730 0.864581 H\n0.830981 0.830983 0.750451 Cl\n0.169018 0.169019 0.250451 Cl\n",
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"spacegroup": 36
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{
"id": "jvasp-17986",
"created_at": "2022-09-04T14:38:14.142161Z",
"updated_at": "2022-09-04T14:38:14.142183Z",
"structure_string": "Sr1 Pb3\n1.0\n5.011463 0.000000 0.000000\n0.000000 5.011463 0.000000\n0.000000 0.000000 5.012549\nSr Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 Pb\n0.500000 0.000000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n",
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"spacegroup": 221
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{
"id": "jvasp-109806",
"created_at": "2022-09-04T14:38:14.139940Z",
"updated_at": "2022-09-04T14:38:14.139973Z",
"structure_string": "Ba2 Na2 N2\n1.0\n4.086741 0.000000 0.000000\n-2.043370 3.539224 0.000000\n0.000000 0.000000 9.692415\nBa Na N\n2 2 2\ndirect\n-0.000000 0.000001 0.497362 Ba\n-0.000001 0.999998 -0.002637 Ba\n0.666666 0.333333 0.722858 Na\n0.333333 0.666666 0.222859 Na\n0.333333 0.666666 0.624418 N\n0.666666 0.333333 0.124419 N\n",
"nsites": 6,
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{
"id": "jvasp-20583",
"created_at": "2022-09-04T14:38:14.132335Z",
"updated_at": "2022-09-04T14:38:14.132353Z",
"structure_string": "U1 As1\n1.0\n3.540352 0.000000 2.044023\n1.180117 3.337876 2.044023\n0.000000 0.000000 4.088046\nU As\n1 1\ndirect\n0.500000 0.500001 0.500000 U\n0.000000 0.000000 0.000000 As\n",
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{
"id": "jvasp-109104",
"created_at": "2022-09-04T14:38:14.127966Z",
"updated_at": "2022-09-04T14:38:14.127993Z",
"structure_string": "Rb2 Li1 V1 Cl6\n1.0\n6.932586 -0.000000 0.000000\n-3.466293 6.003796 0.000000\n-0.000000 -0.000000 5.932204\nRb Li V Cl\n2 1 1 6\ndirect\n0.333334 0.666667 0.251603 Rb\n0.666667 0.333334 0.748397 Rb\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 V\n0.838278 0.161723 0.264347 Cl\n0.161724 0.838278 0.735653 Cl\n0.838278 0.676554 0.264347 Cl\n0.161723 0.323446 0.735653 Cl\n0.323446 0.161723 0.264347 Cl\n0.676555 0.838278 0.735653 Cl\n",
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"spacegroup": 164
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{
"id": "jvasp-43720",
"created_at": "2022-09-04T14:38:14.124558Z",
"updated_at": "2022-09-04T14:38:14.124581Z",
"structure_string": "Li4 Fe2 O4 F2\n1.0\n5.032151 -0.041969 -0.001430\n1.541425 4.819793 0.000858\n0.772138 2.408463 4.493815\nLi Fe O F\n4 2 4 2\ndirect\n0.500572 0.998599 0.498744 Li\n0.000574 0.498595 0.498704 Li\n0.500597 0.669110 0.157680 Li\n0.500611 0.328030 0.839807 Li\n0.000605 0.808217 0.879414 Fe\n0.000595 0.188919 0.118017 Fe\n0.765496 0.589338 0.834716 O\n0.235701 0.071813 0.834704 O\n0.235688 0.407819 0.162708 O\n0.765500 0.925342 0.162710 O\n0.742576 0.252054 0.498722 F\n0.258607 0.745102 0.498709 F\n",
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{
"id": "jvasp-11122",
"created_at": "2022-09-04T14:38:14.122766Z",
"updated_at": "2022-09-04T14:38:14.122792Z",
"structure_string": "Rb2 U2 Ag2 Se6\n1.0\n4.224023 0.000000 0.000000\n-2.112011 7.477188 -0.000000\n0.000000 0.000000 10.849419\nRb U Ag Se\n2 2 2 6\ndirect\n0.253611 0.507222 0.250000 Rb\n0.746389 0.492779 0.750000 Rb\n0.000000 0.000000 0.500000 U\n0.000000 0.000000 0.000000 U\n0.456088 0.912177 0.750000 Ag\n0.543912 0.087824 0.250000 Ag\n0.372587 0.745174 0.539287 Se\n0.627413 0.254826 0.460713 Se\n0.627413 0.254826 0.039287 Se\n0.065306 0.130611 0.750000 Se\n0.934694 0.869389 0.250000 Se\n0.372587 0.745174 0.960713 Se\n",
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}