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{
"id": "jvasp-9574",
"created_at": "2022-09-04T14:38:17.510191Z",
"updated_at": "2022-09-04T14:38:17.510220Z",
"structure_string": "Ga3 As3 O12\n1.0\n2.496352 -4.323808 -0.000000\n2.496352 4.323808 0.000000\n0.000000 -0.000000 11.569669\nGa As O\n3 3 12\ndirect\n0.446763 -0.000000 0.333333 Ga\n-0.000000 0.446763 0.666667 Ga\n0.553236 0.553236 0.000000 Ga\n0.444159 -0.000000 0.833333 As\n-0.000000 0.444159 0.166667 As\n0.555840 0.555840 0.500000 As\n0.068883 0.676143 0.285655 O\n0.931116 0.607259 0.047679 O\n0.676143 0.068883 0.714345 O\n0.392740 0.323856 0.381012 O\n0.390309 0.302499 0.870033 O\n0.087809 0.697500 0.796635 O\n0.912191 0.609691 0.536700 O\n0.607259 0.931116 0.952321 O\n0.609691 0.912191 0.463300 O\n0.302499 0.390309 0.129967 O\n0.697500 0.087809 0.203366 O\n0.323856 0.392740 0.618988 O\n",
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{
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"updated_at": "2022-09-04T14:36:05.219112Z",
"structure_string": "Ga1 Te4 Mo4 Se4\n1.0\n6.586432 -0.000000 3.802679\n2.195477 6.209748 3.802679\n-0.000000 0.000000 7.605357\nGa Te Mo Se\n1 4 4 4\ndirect\n0.000000 0.000000 0.000000 Ga\n0.137695 0.137696 0.137696 Te\n0.586914 0.137696 0.137696 Te\n0.137696 0.586915 0.137696 Te\n0.137695 0.137696 0.586915 Te\n0.404525 0.786425 0.404525 Mo\n0.404525 0.404525 0.404525 Mo\n0.404525 0.404525 0.786426 Mo\n0.786425 0.404525 0.404526 Mo\n0.631525 0.105422 0.631526 Se\n0.631526 0.631526 0.631526 Se\n0.631526 0.631526 0.105423 Se\n0.105423 0.631526 0.631526 Se\n",
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{
"id": "jvasp-95767",
"created_at": "2022-09-04T14:36:08.068693Z",
"updated_at": "2022-09-04T14:36:08.068723Z",
"structure_string": "Eu4 F12\n1.0\n4.395155 -0.000000 0.000000\n-0.000000 6.592861 0.000000\n0.000000 0.000000 7.002029\nEu F\n4 12\ndirect\n0.934575 0.631280 0.750000 Eu\n0.434575 0.868720 0.250000 Eu\n0.565424 0.131280 0.750000 Eu\n0.065424 0.368720 0.250000 Eu\n0.388918 0.165580 0.436122 F\n0.888918 0.334420 0.563878 F\n0.111081 0.665580 0.063878 F\n0.611080 0.834420 0.936122 F\n0.578820 0.519553 0.250000 F\n0.078820 0.980447 0.750000 F\n0.921178 0.019553 0.250000 F\n0.421179 0.480447 0.750000 F\n0.388918 0.165580 0.063878 F\n0.888918 0.334420 0.936122 F\n0.111081 0.665580 0.436122 F\n0.611080 0.834420 0.563878 F\n",
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"formula_full": "Eu4 F12",
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"spacegroup": 62
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{
"id": "jvasp-95769",
"created_at": "2022-09-04T14:36:10.588719Z",
"updated_at": "2022-09-04T14:36:10.588740Z",
"structure_string": "Mn4 Co4 P4\n1.0\n3.464691 -0.000000 0.000000\n-0.000000 5.890958 0.000000\n0.000000 0.000000 6.686485\nMn Co P\n4 4 4\ndirect\n0.750000 0.028239 0.332736 Mn\n0.250000 0.971762 0.667265 Mn\n0.750000 0.528239 0.167264 Mn\n0.250000 0.471762 0.832736 Mn\n0.250000 0.357880 0.434409 Co\n0.750000 0.642120 0.565591 Co\n0.250000 0.857881 0.065591 Co\n0.750000 0.142120 0.934410 Co\n0.250000 0.734695 0.374615 P\n0.750000 0.265305 0.625385 P\n0.250000 0.234695 0.125385 P\n0.750000 0.765306 0.874616 P\n",
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"density": 7.0495970522044065,
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"formula_full": "Mn4 Co4 P4",
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{
"id": "jvasp-9577",
"created_at": "2022-09-04T14:38:13.166606Z",
"updated_at": "2022-09-04T14:38:13.166623Z",
"structure_string": "Er4 Ag4 Se8\n1.0\n4.201839 0.000000 0.000000\n0.000000 6.771065 0.000000\n0.000000 0.000000 13.691594\nEr Ag Se\n4 4 8\ndirect\n0.215651 0.292322 0.127739 Er\n0.715652 0.207679 0.872261 Er\n0.784349 0.792322 0.372261 Er\n0.284349 0.707679 0.627739 Er\n0.508484 0.708560 0.872734 Ag\n0.491516 0.208559 0.627265 Ag\n0.008484 0.791442 0.127265 Ag\n0.991516 0.291441 0.372735 Ag\n0.776640 0.510849 0.526851 Se\n0.276640 0.989152 0.473149 Se\n0.223360 0.010849 0.973149 Se\n0.723361 0.489151 0.026851 Se\n0.784150 0.913874 0.725793 Se\n0.715851 0.086126 0.225793 Se\n0.215851 0.413874 0.774207 Se\n0.284149 0.586127 0.274207 Se\n",
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"volume": 389.53851386747584,
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"formula_full": "Er4 Ag4 Se8",
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{
"id": "jvasp-95770",
"created_at": "2022-09-04T14:36:07.308722Z",
"updated_at": "2022-09-04T14:36:07.308750Z",
"structure_string": "Eu2 Ge2\n1.0\n4.024315 -0.000000 -0.000000\n0.000000 4.004022 -1.685904\n0.000000 0.108125 5.854524\nEu Ge\n2 2\ndirect\n0.250000 0.862224 0.724450 Eu\n0.750001 0.137775 0.275549 Eu\n0.250000 0.585531 0.171064 Ge\n0.750001 0.414467 0.828935 Ge\n",
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{
"id": "jvasp-95772",
"created_at": "2022-09-04T14:36:10.584384Z",
"updated_at": "2022-09-04T14:36:10.584408Z",
"structure_string": "Eu1 Hg2\n1.0\n4.974992 0.000000 -0.000000\n-2.487496 4.308469 -0.000000\n-0.000000 0.000000 3.429633\nEu Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Eu\n0.333332 0.666667 0.500000 Hg\n0.666667 0.333333 0.500000 Hg\n",
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{
"id": "jvasp-9578",
"created_at": "2022-09-04T14:37:36.276377Z",
"updated_at": "2022-09-04T14:37:36.276405Z",
"structure_string": "Rb4 Mn6 Se8\n1.0\n5.116105 0.000000 1.683109\n1.960726 8.655568 2.657234\n-0.210568 0.288037 9.257262\nRb Mn Se\n4 6 8\ndirect\n0.749910 0.875245 0.124755 Rb\n0.750091 0.375245 0.624755 Rb\n0.250091 0.124756 0.875244 Rb\n0.249910 0.624755 0.375244 Rb\n0.750000 -0.002478 0.502478 Mn\n0.250001 0.497522 0.002478 Mn\n0.750001 0.750000 0.749999 Mn\n0.750001 0.502479 -0.002479 Mn\n0.250000 0.002479 0.497521 Mn\n0.250000 0.250000 0.250000 Mn\n0.403954 0.219863 0.471155 Se\n0.594972 0.280137 0.028845 Se\n0.905029 0.471155 0.219862 Se\n0.596047 0.780138 0.528844 Se\n0.405029 0.719863 0.971154 Se\n0.903955 0.971156 0.719862 Se\n0.094972 0.528845 0.780137 Se\n0.096046 0.028845 0.280137 Se\n",
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"formula_full": "Rb4 Mn6 Se8",
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{
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"structure_string": "Pa1\n1.0\n2.879576 -0.000000 1.662524\n0.959858 2.714890 1.662524\n-0.000000 -0.000000 3.325048\nPa\n1\ndirect\n0.000000 -0.000000 -0.000000 Pa\n",
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{
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"created_at": "2022-09-04T14:38:16.632891Z",
"updated_at": "2022-09-04T14:38:16.632901Z",
"structure_string": "Ga3 P3 O12\n1.0\n2.454006 -4.250462 -0.000000\n2.454006 4.250462 0.000000\n0.000000 0.000000 11.155161\nGa P O\n3 3 12\ndirect\n0.546761 0.546761 0.000000 Ga\n0.000001 0.453240 0.666667 Ga\n0.453240 0.000001 0.333333 Ga\n0.547647 0.547647 0.500000 P\n0.000001 0.452354 0.166667 P\n0.452354 0.000001 0.833333 P\n0.082147 0.675187 0.275425 O\n0.917855 0.593042 0.057908 O\n0.675187 0.082147 0.724575 O\n0.406960 0.324814 0.391242 O\n0.405116 0.277167 0.869844 O\n0.127950 0.722835 0.796822 O\n0.872052 0.594886 0.536511 O\n0.593042 0.917855 0.942092 O\n0.594886 0.872052 0.463489 O\n0.277167 0.405116 0.130156 O\n0.722835 0.127950 0.203178 O\n0.324814 0.406960 0.608758 O\n",
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{
"id": "jvasp-9581",
"created_at": "2022-09-04T14:37:34.765951Z",
"updated_at": "2022-09-04T14:37:34.765969Z",
"structure_string": "Li4 Zr2 O6\n1.0\n5.172611 -0.035967 -1.027734\n-2.761050 4.374220 -1.027734\n0.035058 0.063068 5.409547\nLi Zr O\n4 2 6\ndirect\n0.741243 0.258756 0.250001 Li\n0.258757 0.741243 0.750001 Li\n0.425166 0.574833 0.250001 Li\n0.574834 0.425166 0.750001 Li\n0.091463 0.908537 0.250001 Zr\n0.908536 0.091463 0.750001 Zr\n0.000000 0.500000 0.000000 O\n0.691411 0.843526 0.988632 O\n0.843526 0.691411 0.488632 O\n0.308589 0.156474 0.011370 O\n0.156474 0.308589 0.511370 O\n0.500000 -0.000000 0.500001 O\n",
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"spacegroup": 15
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{
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"created_at": "2022-09-04T14:38:11.943675Z",
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"structure_string": "Ta4 N4 O4\n1.0\n0.000000 5.001667 -0.007149\n5.067416 0.000000 0.000000\n0.000000 -0.872501 -5.151402\nTa N O\n4 4 4\ndirect\n0.706703 0.544908 0.283715 Ta\n0.293298 0.044908 0.216285 Ta\n0.293298 0.455093 0.716284 Ta\n0.706703 0.955093 0.783715 Ta\n0.557149 0.256093 0.020419 N\n0.442852 0.756094 0.479581 N\n0.442852 0.743908 0.979581 N\n0.557149 0.243907 0.520418 N\n0.937202 0.673574 0.653825 O\n0.062799 0.173573 0.846174 O\n0.062799 0.326427 0.346175 O\n0.937202 0.826427 0.153825 O\n",
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"spacegroup": 14
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}