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{
"id": "jvasp-86193",
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"updated_at": "2022-09-04T14:35:52.226650Z",
"structure_string": "Sr4 Li2 Co2 N4\n1.0\n5.367137 0.000000 0.000000\n0.000000 5.367137 0.000000\n0.000000 0.000000 7.345576\nSr Li Co N\n4 2 2 4\ndirect\n0.000000 0.500000 0.750000 Sr\n0.000000 0.500000 0.250000 Sr\n0.500000 0.000000 0.250000 Sr\n0.500000 0.000000 0.750000 Sr\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.737873 0.737873 0.500000 N\n0.762128 0.237872 0.000000 N\n0.262128 0.262128 0.500000 N\n0.237872 0.762128 0.000000 N\n",
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{
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{
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"created_at": "2022-09-04T14:35:46.264361Z",
"updated_at": "2022-09-04T14:35:46.264387Z",
"structure_string": "Ca4 Mn2 Al2 O10\n1.0\n5.042428 0.000000 -1.655469\n-0.597441 5.254425 -1.819758\n-0.083073 -0.127085 8.254118\nCa Mn Al O\n4 2 2 10\ndirect\n0.618398 0.079671 0.219831 Ca\n0.898567 0.359841 0.780172 Ca\n0.398567 0.920329 0.780169 Ca\n0.118394 0.640159 0.219828 Ca\n0.997975 -0.000000 -0.000000 Mn\n0.497973 0.500000 -0.000000 Mn\n0.788715 0.675946 0.499998 Al\n0.288717 0.324054 0.500002 Al\n0.735718 0.731709 0.971866 O\n0.623024 0.393424 0.500003 O\n0.235718 0.740154 0.971867 O\n0.820101 0.924759 0.706344 O\n0.113757 0.075241 0.293656 O\n0.320111 0.281600 0.706357 O\n0.613753 0.718400 0.293643 O\n0.123021 0.606576 0.499997 O\n0.263851 0.259846 0.028133 O\n0.763851 0.268291 0.028134 O\n",
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{
"id": "jvasp-85781",
"created_at": "2022-09-04T14:35:46.167937Z",
"updated_at": "2022-09-04T14:35:46.167967Z",
"structure_string": "Na2 H8 I2 O4\n1.0\n6.326085 0.110487 -3.308265\n-2.350656 5.311810 0.901494\n0.039234 0.024460 7.069620\nNa H I O\n2 8 2 4\ndirect\n0.861563 0.679373 0.517086 Na\n0.138437 0.320627 0.482914 Na\n0.106909 0.391215 0.861422 H\n0.893091 0.608786 0.138578 H\n0.862612 0.202606 0.719961 H\n0.137388 0.797394 0.280039 H\n0.264122 0.053968 0.861934 H\n0.735878 0.946033 0.138066 H\n0.347563 0.953548 0.733196 H\n0.652437 0.046453 0.266804 H\n0.621939 0.753501 0.776900 I\n0.378061 0.246500 0.223100 I\n0.982844 0.363418 0.715178 O\n0.017156 0.636583 0.284822 O\n0.222753 -0.000423 0.717568 O\n0.777248 0.000424 0.282433 O\n",
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{
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"created_at": "2022-09-04T14:36:03.152565Z",
"updated_at": "2022-09-04T14:36:03.152590Z",
"structure_string": "Cd1 Pb2 Cl2 O2\n1.0\n0.000000 -3.875730 0.000000\n5.215121 -1.937865 -3.318093\n5.221716 -1.937865 4.295976\nCd Pb Cl O\n1 2 2 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.186548 0.383257 0.243644 Pb\n0.813449 0.616743 0.756357 Pb\n0.436142 0.823141 0.304571 Cl\n0.563855 0.176858 0.695430 Cl\n0.193256 0.683471 0.930013 O\n0.806741 0.316528 0.069988 O\n",
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"elements": [
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"formula_full": "Cd1 Pb2 Cl2 O2",
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{
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"created_at": "2022-09-04T14:35:55.108448Z",
"updated_at": "2022-09-04T14:35:55.108477Z",
"structure_string": "Li1 V3 Zn2 O8\n1.0\n-4.199974 4.199974 0.054335\n4.145640 0.000000 4.145640\n4.145640 4.145640 0.000000\nLi V Zn O\n1 3 2 8\ndirect\n0.125000 0.750000 0.625000 Li\n0.625000 0.250001 0.125000 V\n0.625000 0.250001 0.625000 V\n0.625000 0.750001 0.625000 V\n0.991040 0.994029 0.002986 Zn\n0.258959 0.505973 0.247013 Zn\n0.852414 0.234944 0.382528 O\n0.405938 0.245291 0.377354 O\n0.844061 0.254711 0.872645 O\n0.844061 0.716708 0.410647 O\n0.844061 0.716708 0.872645 O\n0.397585 0.265058 0.867472 O\n0.405938 0.783293 0.377354 O\n0.405938 0.783293 0.839352 O\n",
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"formula_full": "Li1 V3 Zn2 O8",
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"formula_anonymous": "AB2C3D8",
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{
"id": "jvasp-89042",
"created_at": "2022-09-04T14:35:59.082658Z",
"updated_at": "2022-09-04T14:35:59.082676Z",
"structure_string": "Na3 Co2 Sb1 O6\n1.0\n5.283366 0.039020 -0.856228\n-2.808327 4.475353 -0.856228\n-0.003492 -0.006369 5.643681\nNa Co Sb O\n3 2 1 6\ndirect\n0.500000 0.499999 0.499998 Na\n0.176321 0.823678 0.499999 Na\n0.823678 0.176323 0.500000 Na\n0.338194 0.661805 0.999998 Co\n0.661806 0.338194 0.999998 Co\n0.000000 0.000000 0.000000 Sb\n0.067162 0.386483 0.206674 O\n0.246190 0.246189 0.790494 O\n0.753810 0.753809 0.209505 O\n0.386482 0.067162 0.206674 O\n0.613518 0.932836 0.793324 O\n0.932837 0.613517 0.793324 O\n",
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"structure_string": "Sm2 As2 Ru2 O2\n1.0\n4.085939 0.000000 0.000000\n-0.000000 4.085939 0.000000\n-0.000000 -0.000000 8.208843\nSm As Ru O\n2 2 2 2\ndirect\n0.750000 0.750000 0.635486 Sm\n0.250000 0.250000 0.364514 Sm\n0.750000 0.750000 0.163699 As\n0.250000 0.250000 0.836301 As\n0.750000 0.250000 0.000000 Ru\n0.250000 0.750000 0.000000 Ru\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:35:56.019558Z",
"updated_at": "2022-09-04T14:35:56.019576Z",
"structure_string": "Ba2 Ca2 C4 O12\n1.0\n5.290947 0.000000 0.000000\n0.000000 6.301595 -1.853417\n0.000000 -0.059314 8.060310\nBa Ca C O\n2 2 4 12\ndirect\n0.224699 0.290841 0.150749 Ba\n0.724699 0.709159 0.849250 Ba\n0.724693 0.804544 0.376824 Ca\n0.224693 0.195456 0.623175 Ca\n0.224678 0.746289 0.612878 C\n0.224722 0.752395 0.100400 C\n0.724722 0.247605 0.899600 C\n0.724678 0.253711 0.387121 C\n0.435436 0.848584 0.606344 O\n0.513917 0.151414 0.393638 O\n0.013917 0.848586 0.606361 O\n0.224716 0.859391 0.989075 O\n0.436825 0.692287 0.153716 O\n0.936825 0.307713 0.846283 O\n0.012633 0.692317 0.153752 O\n0.512633 0.307683 0.846247 O\n0.724683 0.440178 0.368349 O\n0.224683 0.559822 0.631651 O\n0.935436 0.151416 0.393655 O\n0.724716 0.140609 0.010925 O\n",
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{
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"updated_at": "2022-09-04T14:35:55.058055Z",
"structure_string": "Mo3 W1 Se4 S4\n1.0\n3.257831 -0.000008 -0.000026\n-1.628922 2.821363 -0.000010\n-0.000282 -0.000430 34.265747\nMo W Se S\n3 1 4 4\ndirect\n0.333318 0.666631 0.094746 Mo\n0.333326 0.666650 0.469453 Mo\n0.666682 0.333367 0.656619 Mo\n0.666672 0.333348 0.282093 W\n0.333352 0.666690 0.331954 Se\n0.333353 0.666688 0.706127 Se\n0.333328 0.666671 0.232234 Se\n0.333346 0.666712 0.607059 Se\n0.666623 0.333260 0.049674 S\n0.666648 0.333310 0.424332 S\n0.666679 0.333337 0.139876 S\n0.666670 0.333324 0.514578 S\n",
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}