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{
"id": "jvasp-85958",
"created_at": "2022-09-04T14:36:20.024914Z",
"updated_at": "2022-09-04T14:36:20.024943Z",
"structure_string": "Cu2 Bi4 O8\n1.0\n4.997565 0.000000 2.421270\n2.498783 6.249322 1.210633\n-0.225998 -0.000000 6.834654\nCu Bi O\n2 4 8\ndirect\n0.680076 -0.000000 0.000000 Cu\n0.180032 -0.000000 0.000000 Cu\n0.656222 0.500054 0.164250 Bi\n0.820472 0.835750 0.500054 Bi\n0.156277 0.164250 0.499946 Bi\n0.320526 0.499946 0.835750 Bi\n0.763786 0.091567 0.704285 O\n0.355323 0.908497 0.704273 O\n0.559639 0.908433 0.295715 O\n0.468071 0.295715 0.091567 O\n0.059597 0.295727 0.908496 O\n0.968093 0.091503 0.295727 O\n0.855354 0.704285 0.908433 O\n0.263820 0.704273 0.091503 O\n",
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{
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"structure_string": "Tb4 Mn4 Si4\n1.0\n4.157436 -0.000000 0.000000\n-0.000000 7.038494 0.000000\n0.000000 0.000000 7.411178\nTb Mn Si\n4 4 4\ndirect\n0.250000 0.501487 0.186388 Tb\n0.750001 0.498513 0.813613 Tb\n0.250000 0.001487 0.313612 Tb\n0.750001 0.998512 0.686388 Tb\n0.750001 0.860885 0.060272 Mn\n0.250000 0.139114 0.939728 Mn\n0.750001 0.360886 0.439728 Mn\n0.250000 0.639114 0.560272 Mn\n0.250000 0.792634 0.891915 Si\n0.750001 0.207365 0.108085 Si\n0.250000 0.292635 0.608086 Si\n0.750001 0.707365 0.391915 Si\n",
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{
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"created_at": "2022-09-04T14:36:13.941360Z",
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"structure_string": "Cu2 Bi4 O8\n1.0\n4.997491 0.000000 2.421234\n2.498746 6.249206 1.210616\n-0.225984 -0.000000 6.834533\nCu Bi O\n2 4 8\ndirect\n0.680039 -0.000000 -0.000000 Cu\n0.180039 -0.000000 -0.000000 Cu\n0.656289 0.500007 0.164237 Bi\n0.820527 0.835763 0.500006 Bi\n0.156296 0.164238 0.499993 Bi\n0.320533 0.499994 0.835762 Bi\n0.763771 0.091572 0.704284 O\n0.355342 0.908436 0.704273 O\n0.559628 0.908429 0.295715 O\n0.468055 0.295716 0.091572 O\n0.059616 0.295726 0.908435 O\n0.968050 0.091565 0.295726 O\n0.855344 0.704285 0.908427 O\n0.263777 0.704274 0.091565 O\n",
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{
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"created_at": "2022-09-04T14:37:00.352851Z",
"updated_at": "2022-09-04T14:37:00.352868Z",
"structure_string": "Te4 W3 S2\n1.0\n3.431793 0.000000 0.000000\n-1.715897 2.971959 0.000000\n0.000000 0.000000 21.261720\nTe W S\n4 3 2\ndirect\n0.667012 0.334024 0.945240 Te\n0.666993 0.333988 0.572373 Te\n0.666993 0.333988 0.121592 Te\n0.667012 0.334024 0.748724 Te\n0.333665 0.667333 0.033377 W\n0.333665 0.667333 0.660588 W\n0.665974 0.331949 0.346982 W\n0.332640 0.665283 0.417522 S\n0.332640 0.665283 0.276443 S\n",
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{
"id": "jvasp-101111",
"created_at": "2022-09-04T14:36:37.601899Z",
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"structure_string": "Sr1 Pb3 S4\n1.0\n4.209426 0.006130 13.442073\n2.060603 3.670589 13.442073\n0.010453 0.006130 14.085755\nSr Pb S\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.249706 0.249706 0.249706 Pb\n0.499999 0.500000 0.500000 Pb\n0.750293 0.750294 0.750294 Pb\n0.125165 0.125165 0.125165 S\n0.374486 0.374487 0.374487 S\n0.625513 0.625513 0.625513 S\n0.874834 0.874835 0.874835 S\n",
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{
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"created_at": "2022-09-04T14:35:48.362462Z",
"updated_at": "2022-09-04T14:35:48.362491Z",
"structure_string": "K4 Be1 Pd1\n1.0\n0.000000 4.767762 4.767762\n4.767762 0.000000 4.767762\n4.767762 4.767762 -0.000000\nK Be Pd\n4 1 1\ndirect\n0.128357 0.623880 0.623880 K\n0.623880 0.623880 0.623880 K\n0.623880 0.128357 0.623880 K\n0.623880 0.623880 0.128357 K\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Pd\n",
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{
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"created_at": "2022-09-04T14:37:14.669272Z",
"updated_at": "2022-09-04T14:37:14.669294Z",
"structure_string": "H4 C8 S2 O4\n1.0\n4.640253 -0.010365 -0.137817\n-0.744197 6.650092 -0.563860\n-0.077517 0.053642 7.023423\nH C S O\n4 8 2 4\ndirect\n0.590916 0.682598 0.028836 H\n0.723466 0.942690 0.075526 H\n0.590903 0.182623 0.528832 H\n0.723450 0.442713 0.575539 H\n0.814211 0.762800 0.302466 C\n0.814194 0.262811 0.802467 C\n0.328361 0.359658 0.711067 C\n0.616016 0.310158 0.638496 C\n0.328379 0.859645 0.211063 C\n0.616033 0.810141 0.138493 C\n0.100635 0.693599 0.247810 C\n0.100618 0.193610 0.747809 C\n0.156198 0.460779 0.259319 S\n0.156184 0.960791 0.759316 S\n0.283484 0.033039 0.260988 O\n0.748983 0.276427 0.970048 O\n0.748998 0.776421 0.470046 O\n0.283466 0.533050 0.761000 O\n",
"nsites": 18,
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"elements": [
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"formula_full": "H4 C8 S2 O4",
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"spacegroup": 1
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{
"id": "jvasp-23873",
"created_at": "2022-09-04T14:37:43.187500Z",
"updated_at": "2022-09-04T14:37:43.187524Z",
"structure_string": "Ba2 Cu3 Cl2 O4\n1.0\n5.214774 0.000000 -1.934844\n-0.717887 5.165124 -1.934844\n0.014685 0.016867 8.034408\nBa Cu Cl O\n2 3 2 4\ndirect\n0.640449 0.640449 0.280900 Ba\n0.359550 0.359550 0.719101 Ba\n0.000000 0.000000 0.000000 Cu\n-0.000000 0.500000 0.000000 Cu\n0.500000 -0.000000 0.000000 Cu\n0.750000 0.250000 0.500001 Cl\n0.250000 0.750000 0.500000 Cl\n0.756153 0.243846 0.000000 O\n0.756152 0.756153 0.000000 O\n0.243846 0.756153 0.000000 O\n0.243846 0.243846 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:36:02.360564Z",
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"structure_string": "Ba4 Cd1 Os1\n1.0\n-0.000000 4.767644 4.767644\n4.767644 -0.000000 4.767644\n4.767644 4.767644 0.000000\nBa Cd Os\n4 1 1\ndirect\n0.122019 0.625993 0.625993 Ba\n0.625993 0.625993 0.625993 Ba\n0.625993 0.122019 0.625993 Ba\n0.625993 0.625993 0.122019 Ba\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Os\n",
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{
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{
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{
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"structure_string": "K3 Sm1\n1.0\n-2.886170 2.886170 6.503844\n2.886170 -2.886170 6.503844\n2.886170 2.886170 -6.503844\nK Sm\n3 1\ndirect\n0.750001 0.250000 0.500001 K\n0.250000 0.750001 0.500001 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Sm\n",
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