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{
"id": "jvasp-20818",
"created_at": "2022-09-04T14:37:50.881282Z",
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{
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"structure_string": "Fe6 O8 F4\n1.0\n0.000000 4.505710 0.004758\n4.511689 0.000000 0.000000\n0.000000 -4.435895 -8.937650\nFe O F\n6 8 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.309522 0.026570 0.346572 Fe\n0.690477 0.973430 0.653428 Fe\n0.690477 0.526570 0.153428 Fe\n0.309521 0.473430 0.846572 Fe\n-0.000001 0.500000 0.500000 Fe\n0.294844 0.789604 0.501365 O\n0.978942 0.826312 0.166676 O\n0.021058 0.326312 0.333324 O\n0.705154 0.289604 0.998634 O\n0.294844 0.710396 0.001365 O\n0.021057 0.173688 0.833324 O\n0.705155 0.210396 0.498634 O\n0.978941 0.673688 0.666676 O\n0.380935 0.267462 0.673247 F\n0.380935 0.232538 0.173247 F\n0.619064 0.732539 0.326753 F\n0.619063 0.767462 0.826753 F\n",
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{
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"structure_string": "Ca6 Al4 N8\n1.0\n5.513739 -0.003589 0.154864\n0.141342 6.513723 1.639334\n-0.005555 -0.006147 6.718326\nCa Al N\n6 4 8\ndirect\n0.454930 0.252443 0.977541 Ca\n0.545071 0.747556 0.022458 Ca\n0.250000 0.601676 0.398323 Ca\n0.750000 0.398323 0.601677 Ca\n0.954929 0.977540 0.252443 Ca\n0.045072 0.022459 0.747557 Ca\n0.589371 0.823136 0.585649 Al\n0.410630 0.176863 0.414350 Al\n0.089371 0.585649 0.823137 Al\n0.910629 0.414350 0.176863 Al\n0.019542 0.697873 0.058381 N\n0.980459 0.302126 0.941618 N\n0.920362 0.736946 0.588108 N\n0.519543 0.058381 0.697873 N\n0.420362 0.588108 0.736946 N\n0.480458 0.941618 0.302126 N\n0.579638 0.411891 0.263053 N\n0.079639 0.263053 0.411892 N\n",
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{
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"updated_at": "2022-09-04T14:38:44.459587Z",
"structure_string": "Mg6 Cr4 N8\n1.0\n6.173331 0.007079 -0.066961\n-4.279837 5.868697 0.000000\n-0.017896 -0.013051 5.435834\nMg Cr N\n6 4 8\ndirect\n0.225375 0.990553 0.974523 Mg\n0.774624 0.765177 0.525476 Mg\n0.774624 0.009448 0.025477 Mg\n0.225375 0.234824 0.474523 Mg\n-0.000000 0.595509 0.749999 Mg\n-0.000000 0.404492 0.250000 Mg\n0.610302 0.433585 0.102515 Cr\n0.389698 0.823283 0.397484 Cr\n0.610301 0.176718 0.602515 Cr\n0.389698 0.566416 0.897484 Cr\n0.291324 0.735535 0.063883 N\n0.220037 0.945071 0.569953 N\n0.779962 0.725035 0.930045 N\n0.779963 0.054930 0.430046 N\n0.220037 0.274966 0.069954 N\n0.708675 0.264466 0.936116 N\n0.291324 0.555790 0.563883 N\n0.708676 0.444211 0.436116 N\n",
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{
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"created_at": "2022-09-04T14:38:39.254132Z",
"updated_at": "2022-09-04T14:38:39.254167Z",
"structure_string": "Te8 Mo6 S4\n1.0\n0.347635 5.918669 -0.000199\n-4.965761 3.261222 0.074938\n-1.765140 3.073510 14.138676\nTe Mo S\n8 6 4\ndirect\n0.898643 0.189290 0.388730 Te\n0.358521 0.032598 0.877057 Te\n0.643308 0.977392 0.111269 Te\n0.434845 0.134047 0.622945 Te\n0.023360 0.689259 0.888732 Te\n0.231830 0.532615 0.377052 Te\n0.308150 0.634067 0.122948 Te\n0.768022 0.477392 0.611269 Te\n0.270076 0.934380 0.249251 Mo\n0.747913 0.083330 0.750000 Mo\n0.918751 0.583342 0.250000 Mo\n0.396582 0.732293 0.750750 Mo\n0.620369 0.232303 0.250749 Mo\n0.046301 0.434357 0.749250 Mo\n0.700989 0.373182 0.853227 S\n0.094064 0.793469 0.646775 S\n0.572595 0.873204 0.353223 S\n0.965671 0.293487 0.146775 S\n",
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{
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"structure_string": "Sr3 Al2 Ge4\n1.0\n4.209211 -0.000000 -0.000000\n-2.104605 5.928467 -2.226437\n-0.000000 -0.002400 8.949652\nSr Al Ge\n3 2 4\ndirect\n0.393753 0.787509 0.312396 Sr\n0.000000 0.000000 0.000000 Sr\n0.606246 0.212492 0.687604 Sr\n0.295418 0.590837 0.649612 Al\n0.704581 0.409163 0.350388 Al\n0.290026 0.580055 0.944934 Ge\n0.709973 0.419946 0.055065 Ge\n0.104720 0.209441 0.390711 Ge\n0.895278 0.790560 0.609289 Ge\n",
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{
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"created_at": "2022-09-04T14:38:43.440018Z",
"updated_at": "2022-09-04T14:38:43.440047Z",
"structure_string": "V6 O8 F4\n1.0\n4.615767 0.007535 0.102044\n0.120000 5.477932 0.443668\n0.000033 0.136787 7.554596\nV O F\n6 8 4\ndirect\n0.509171 0.833333 0.658211 V\n0.476089 0.510883 0.991702 V\n0.509998 0.178189 0.361579 V\n0.001456 0.344748 0.672502 V\n0.968639 0.643905 0.311208 V\n0.025596 0.992949 0.999842 V\n0.192427 0.296593 0.904175 O\n0.297664 0.799697 0.892999 O\n0.303104 0.455843 0.234915 O\n0.299266 0.139343 0.573895 O\n0.698773 0.537239 0.765307 O\n0.794809 0.697218 0.095589 O\n0.801609 0.370044 0.436027 O\n0.709317 0.866876 0.429662 O\n0.212369 0.961619 0.236469 F\n0.797121 0.037045 0.771187 F\n0.699036 0.194703 0.106446 F\n0.203554 0.639771 0.558288 F\n",
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{
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"created_at": "2022-09-04T14:38:36.794301Z",
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"structure_string": "Sr6 Y4 N8\n1.0\n7.643741 0.032064 -0.172939\n-7.274635 7.602826 -0.000001\n-0.039065 -0.037379 6.457171\nSr Y N\n6 4 8\ndirect\n0.222161 0.919956 0.077929 Sr\n0.777838 0.697794 0.422071 Sr\n0.777837 0.080044 0.922071 Sr\n0.222161 0.302206 0.577929 Sr\n-0.000001 0.588148 0.750000 Sr\n-0.000000 0.411852 0.250000 Sr\n0.525373 0.369082 0.091526 Y\n0.474626 0.843709 0.408474 Y\n0.525372 0.156290 0.591526 Y\n0.474626 0.630918 0.908473 Y\n0.379317 0.769943 0.063484 N\n0.213750 0.867665 0.498750 N\n0.786249 0.653913 0.001250 N\n0.786249 0.132335 0.501250 N\n0.213750 0.346087 0.998750 N\n0.620681 0.230057 0.936516 N\n0.379317 0.609375 0.563484 N\n0.620682 0.390625 0.436516 N\n",
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{
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"structure_string": "Te8 Mo6 S4\n1.0\n-0.347862 -5.917145 0.000387\n-0.000449 -0.000162 14.113043\n-4.966667 3.260798 -0.000142\nTe Mo S\n8 6 4\ndirect\n0.642688 0.111519 0.669425 Te\n0.026719 0.888481 0.669382 Te\n0.977974 0.377276 0.336311 Te\n0.975055 0.122726 0.330359 Te\n0.355287 0.877281 0.330324 Te\n0.306533 0.388483 0.997241 Te\n0.358356 0.622717 0.336348 Te\n0.690723 0.611517 0.997278 Te\n0.326953 0.250000 0.333334 Mo\n0.707227 0.750948 0.683596 Mo\n0.626101 0.250949 0.983065 Mo\n0.006389 0.749999 0.333333 Mo\n0.976369 0.249053 0.683602 Mo\n0.356963 0.749052 0.983071 Mo\n0.689756 0.853178 0.000666 S\n0.310925 0.146823 0.000692 S\n0.022468 0.646820 0.666002 S\n0.643518 0.353179 0.665973 S\n",
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{
"id": "jvasp-34071",
"created_at": "2022-09-04T14:38:36.311685Z",
"updated_at": "2022-09-04T14:38:36.311695Z",
"structure_string": "Te8 Mo6 S4\n1.0\n-1.543696 3.080000 0.000000\n0.000001 -0.000000 -13.956969\n-7.176090 -5.523719 0.000001\nTe Mo S\n8 6 4\ndirect\n0.900309 0.617249 0.800595 Te\n0.099691 0.117249 0.199406 Te\n0.099692 0.382751 0.199406 Te\n0.775071 0.119163 0.550154 Te\n0.224930 0.619163 0.449848 Te\n0.224930 0.880837 0.449848 Te\n0.775071 0.380837 0.550154 Te\n0.900309 0.882752 0.800595 Te\n0.785143 0.750000 0.570255 Mo\n0.888807 0.250000 0.777608 Mo\n0.458695 0.750000 0.917369 Mo\n0.541304 0.250000 0.082631 Mo\n0.111193 0.750000 0.222393 Mo\n0.214858 0.250000 0.429747 Mo\n0.436648 0.140436 0.873288 S\n0.563352 0.859564 0.126712 S\n0.563351 0.640436 0.126712 S\n0.436648 0.359564 0.873288 S\n",
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"created_at": "2022-09-04T14:38:36.384724Z",
"updated_at": "2022-09-04T14:38:36.384748Z",
"structure_string": "Te8 Mo6 S4\n1.0\n-1.542893 3.078430 0.000048\n7.149645 5.509461 0.022489\n1.834247 2.845555 -14.052476\nTe Mo S\n8 6 4\ndirect\n0.299759 0.009378 0.391165 Te\n0.353661 0.673579 0.619035 Te\n0.265644 0.589517 0.879115 Te\n0.980415 0.657481 0.381757 Te\n0.738352 0.412307 0.111090 Te\n0.029618 0.323831 0.616861 Te\n0.940685 0.237393 0.881152 Te\n0.058321 0.762878 0.120579 Te\n0.543288 0.164352 0.748994 Mo\n0.796279 0.155255 0.252252 Mo\n0.195927 0.858935 0.749126 Mo\n0.458147 0.828754 0.255023 Mo\n0.869869 0.511018 0.749193 Mo\n0.136315 0.482151 0.245305 Mo\n0.385682 0.077924 0.150789 S\n0.651927 0.346096 0.350145 S\n0.611303 0.919311 0.857979 S\n0.684815 0.989845 0.640441 S\n",
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}
]
}