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{
"id": "jvasp-19048",
"created_at": "2022-09-04T14:36:52.696158Z",
"updated_at": "2022-09-04T14:36:52.696190Z",
"structure_string": "Na4 Ti6 O14\n1.0\n0.000000 8.599545 0.007796\n3.811660 0.000000 0.000000\n0.000000 -1.874579 -8.998636\nNa Ti O\n4 6 14\ndirect\n0.498691 0.750000 0.158169 Na\n0.501308 0.250000 0.841831 Na\n0.683353 0.750000 0.587584 Na\n0.316646 0.250000 0.412416 Na\n0.030162 0.750000 0.279721 Ti\n0.969837 0.250000 0.720279 Ti\n0.250163 0.750000 0.676648 Ti\n0.749836 0.250000 0.323352 Ti\n0.147780 0.750000 0.985507 Ti\n0.852219 0.250000 0.014493 Ti\n0.219809 0.750000 0.188956 O\n0.780190 0.250000 0.811044 O\n0.553998 0.250000 0.347105 O\n0.446001 0.750000 0.652895 O\n0.672886 0.250000 0.090462 O\n0.327113 0.750000 0.909538 O\n0.085505 0.250000 0.956823 O\n0.015310 0.750000 0.753951 O\n0.197794 0.250000 0.683901 O\n0.802205 0.750000 0.316099 O\n0.851526 0.250000 0.536485 O\n0.914494 0.750000 0.043177 O\n0.984690 0.250000 0.246049 O\n0.148473 0.750000 0.463515 O\n",
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{
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{
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"updated_at": "2022-09-04T14:38:32.023132Z",
"structure_string": "Zn6 Sn4 O14\n1.0\n5.362926 -0.000000 -0.000000\n-0.000000 5.211227 -1.405645\n0.000000 -0.125672 9.896849\nZn Sn O\n6 4 14\ndirect\n0.728097 0.745070 0.000000 Zn\n0.228097 0.254931 0.000000 Zn\n0.790793 0.572726 0.590335 Zn\n0.290793 0.427275 0.409666 Zn\n0.790793 0.982391 0.409666 Zn\n0.290793 0.017610 0.590334 Zn\n0.755783 0.356529 0.207613 Sn\n0.255783 0.643472 0.792388 Sn\n0.255783 0.851085 0.207613 Sn\n0.755783 0.148916 0.792387 Sn\n0.353546 0.620574 0.000000 O\n0.853546 0.379426 0.000000 O\n0.426999 0.156742 0.148765 O\n0.926999 0.843259 0.851235 O\n0.082798 0.552820 0.272243 O\n0.582798 0.447181 0.727757 O\n0.162808 0.074299 0.411170 O\n0.082798 0.280577 0.727757 O\n0.662809 0.336872 0.411170 O\n0.162808 0.663129 0.588831 O\n0.926999 0.992024 0.148766 O\n0.662809 0.925702 0.588831 O\n0.582798 0.719424 0.272243 O\n0.426999 0.007977 0.851235 O\n",
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{
"id": "jvasp-41384",
"created_at": "2022-09-04T14:38:33.580116Z",
"updated_at": "2022-09-04T14:38:33.580148Z",
"structure_string": "Lu6 Ni14 B4\n1.0\n2.498845 -4.328127 -0.000000\n2.498845 4.328127 0.000000\n-0.000000 0.000000 14.223190\nLu Ni B\n6 14 4\ndirect\n0.333332 0.666666 0.216851 Lu\n0.666666 0.333332 0.716853 Lu\n0.666666 0.333332 0.283147 Lu\n0.333332 0.666666 0.783149 Lu\n0.333332 0.666666 0.000000 Lu\n0.666666 0.333332 0.500000 Lu\n0.166050 0.833948 0.397155 Ni\n0.166051 0.332102 0.397155 Ni\n0.667896 0.833947 0.397155 Ni\n0.332102 0.166051 0.897153 Ni\n0.833947 0.667896 0.897153 Ni\n0.833947 0.166051 0.897153 Ni\n0.332102 0.166051 0.102847 Ni\n0.166051 0.332102 0.602845 Ni\n0.667896 0.833947 0.602845 Ni\n0.833947 0.166051 0.102847 Ni\n0.166050 0.833948 0.602845 Ni\n0.000000 0.000000 0.249997 Ni\n0.000000 0.000000 0.750003 Ni\n0.833947 0.667896 0.102847 Ni\n0.000000 0.000000 0.500000 B\n0.333332 0.666666 0.500000 B\n0.666666 0.333332 0.000000 B\n0.000000 0.000000 0.000000 B\n",
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{
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"created_at": "2022-09-04T14:38:31.846562Z",
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"structure_string": "Ca6 Sn4 S14\n1.0\n0.000000 0.000000 6.957980\n1.852955 -6.681481 0.000000\n11.067631 6.667029 0.000000\nCa Sn S\n6 4 14\ndirect\n0.500000 -0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.500000 0.834854 0.129136 Ca\n0.500000 0.165145 0.870864 Ca\n0.000000 0.294282 0.129136 Ca\n0.000000 0.705718 0.870864 Ca\n0.500000 0.615553 0.714406 Sn\n0.500000 0.384446 0.285594 Sn\n0.000000 0.098852 0.714406 Sn\n0.000000 0.901147 0.285594 Sn\n0.250000 0.380409 0.760819 S\n0.250000 0.619590 0.239181 S\n0.000000 0.881249 0.090634 S\n0.000000 0.118750 0.909366 S\n0.500000 0.209384 0.090634 S\n0.500000 0.790615 0.909365 S\n0.000000 -0.000000 0.500000 S\n0.750000 0.176020 0.352041 S\n0.250000 0.176020 0.352041 S\n0.250000 0.823979 0.647959 S\n0.750000 0.380409 0.760819 S\n0.500000 0.500000 0.500000 S\n0.750000 0.823979 0.647959 S\n0.750000 0.619590 0.239181 S\n",
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{
"id": "jvasp-57865",
"created_at": "2022-09-04T14:38:35.974455Z",
"updated_at": "2022-09-04T14:38:35.974482Z",
"structure_string": "Sr3 Ru2 O7\n1.0\n3.828211 -0.000000 -0.706436\n-0.130362 3.825991 -0.706436\n0.013798 0.014276 10.800619\nSr Ru O\n3 2 7\ndirect\n0.500000 0.500000 -0.000000 Sr\n0.686061 0.686061 0.372121 Sr\n0.313940 0.313940 0.627879 Sr\n0.098618 0.098618 0.197234 Ru\n0.901383 0.901383 0.802765 Ru\n0.402383 0.902383 0.804764 O\n0.902383 0.402383 0.804764 O\n0.597617 0.097618 0.195235 O\n0.097618 0.597617 0.195235 O\n0.803212 0.803212 0.606423 O\n0.000000 0.000000 0.000000 O\n0.196789 0.196789 0.393577 O\n",
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"volume": 158.27065130092868,
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{
"id": "jvasp-19306",
"created_at": "2022-09-04T14:38:35.916526Z",
"updated_at": "2022-09-04T14:38:35.916555Z",
"structure_string": "Zn6 Cr4 O14\n1.0\n5.098859 0.000000 0.000000\n-0.000000 4.923794 -1.328114\n0.000000 -0.077150 9.505162\nZn Cr O\n6 4 14\ndirect\n0.718596 0.744945 0.000000 Zn\n0.218596 0.255054 0.000000 Zn\n0.793545 0.571215 0.600896 Zn\n0.293545 0.428785 0.399104 Zn\n0.793545 0.970317 0.399104 Zn\n0.293545 0.029683 0.600896 Zn\n0.754105 0.352768 0.202961 Cr\n0.254105 0.647231 0.797039 Cr\n0.254105 0.850193 0.202962 Cr\n0.754105 0.149806 0.797039 Cr\n0.319426 0.637092 0.000000 O\n0.819426 0.362907 0.000000 O\n0.437090 0.148143 0.154170 O\n0.937090 0.851857 0.845830 O\n0.071806 0.552092 0.254243 O\n0.571806 0.447908 0.745757 O\n0.184445 0.054462 0.404093 O\n0.071806 0.297849 0.745757 O\n0.684445 0.349632 0.404094 O\n0.184445 0.650367 0.595907 O\n0.937090 0.006027 0.154170 O\n0.684445 0.945537 0.595907 O\n0.571806 0.702150 0.254243 O\n0.437090 -0.006026 0.845830 O\n",
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{
"id": "jvasp-40197",
"created_at": "2022-09-04T14:38:36.035154Z",
"updated_at": "2022-09-04T14:38:36.035175Z",
"structure_string": "Ca6 Sn4 S14\n1.0\n-0.000000 0.000000 -6.915922\n0.000000 -7.083848 0.000000\n-11.790347 3.541923 -0.000000\nCa Sn S\n6 4 14\ndirect\n0.250000 0.201461 0.000000 Ca\n0.750000 0.798539 0.000000 Ca\n0.250000 0.403308 0.370236 Ca\n0.750000 0.966928 0.370236 Ca\n0.750000 0.596693 0.629764 Ca\n0.250000 0.033073 0.629764 Ca\n0.250000 0.841328 0.207950 Sn\n0.750000 0.366623 0.207950 Sn\n0.750000 0.158673 0.792050 Sn\n0.250000 0.633378 0.792050 Sn\n0.500000 0.075531 0.151061 S\n0.000000 0.075531 0.151061 S\n0.000000 0.639062 0.278123 S\n0.500000 0.639062 0.278123 S\n0.000000 0.360939 0.721877 S\n0.500000 0.360939 0.721877 S\n0.750000 0.388214 0.000000 S\n0.750000 0.950335 0.588413 S\n0.750000 0.361921 0.411587 S\n0.250000 0.049666 0.411587 S\n0.000000 0.924470 0.848940 S\n0.250000 0.611786 0.000000 S\n0.250000 0.638080 0.588413 S\n0.500000 0.924470 0.848940 S\n",
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{
"id": "jvasp-19309",
"created_at": "2022-09-04T14:38:35.847697Z",
"updated_at": "2022-09-04T14:38:35.847746Z",
"structure_string": "Ca6 Co4 O14\n1.0\n5.233514 0.000000 -0.000000\n-0.000000 5.008305 -1.350909\n-0.000000 0.031499 10.076020\nCa Co O\n6 4 14\ndirect\n0.705283 0.757239 0.000000 Ca\n0.205284 0.242762 0.000000 Ca\n0.785988 0.565990 0.625916 Ca\n0.285989 0.434011 0.374084 Ca\n0.785988 0.940073 0.374084 Ca\n0.285989 0.059928 0.625916 Ca\n0.748631 0.346697 0.193358 Co\n0.248631 0.653305 0.806642 Co\n0.248631 0.846662 0.193358 Co\n0.748631 0.153339 0.806642 Co\n0.258027 0.681812 0.000000 O\n0.758026 0.318189 0.000000 O\n0.452029 0.131740 0.168738 O\n0.952029 0.868261 0.831263 O\n0.043965 0.562209 0.217485 O\n0.543965 0.437792 0.782515 O\n0.247730 0.983845 0.390434 O\n0.043965 0.344723 0.782515 O\n0.747730 0.406590 0.390434 O\n0.247730 0.593411 0.609566 O\n0.952029 0.036998 0.168738 O\n0.747730 0.016156 0.609566 O\n0.543965 0.655278 0.217485 O\n0.452029 0.963003 0.831263 O\n",
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{
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"updated_at": "2022-09-04T14:38:35.902245Z",
"structure_string": "Na4 Si6 O14\n1.0\n4.874103 -0.000000 -0.000000\n-2.437051 4.401693 -0.965070\n-0.000000 0.033048 11.580026\nNa Si O\n4 6 14\ndirect\n0.852011 0.297334 0.184230 Na\n0.554677 0.702665 0.315770 Na\n0.147989 0.702665 0.815770 Na\n0.445322 0.297335 0.684230 Na\n0.171293 0.914314 0.114705 Si\n0.828707 0.085686 0.885295 Si\n0.743020 0.914314 0.614705 Si\n-0.000000 0.500000 0.500000 Si\n0.500000 0.500000 -0.000000 Si\n0.256979 0.085686 0.385295 Si\n0.925074 0.719234 0.629151 O\n0.205839 0.280766 0.870850 O\n0.643676 0.000000 0.750000 O\n0.316165 0.729860 0.033444 O\n0.586304 0.270139 0.466556 O\n0.683834 0.270139 0.966556 O\n0.413695 0.729861 0.533444 O\n0.003148 0.752834 0.410466 O\n0.250314 0.247166 0.089534 O\n0.996852 0.247166 0.589535 O\n0.749686 0.752834 0.910466 O\n0.356323 0.000000 0.250000 O\n0.794160 0.719234 0.129151 O\n0.074925 0.280766 0.370849 O\n",
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{
"id": "jvasp-59696",
"created_at": "2022-09-04T14:38:31.151229Z",
"updated_at": "2022-09-04T14:38:31.151255Z",
"structure_string": "K3 Cu2 F7\n1.0\n3.962310 0.000000 -0.786533\n-0.156130 3.959232 -0.786533\n0.110792 0.115246 10.931840\nK Cu F\n3 2 7\ndirect\n0.315801 0.315801 0.631603 K\n0.684199 0.684199 0.368398 K\n0.500000 0.500000 0.000000 K\n0.095640 0.095640 0.191279 Cu\n0.904360 0.904361 0.808721 Cu\n0.406050 0.906050 0.812101 F\n0.906050 0.406051 0.812101 F\n0.593950 0.093950 0.187900 F\n0.093950 0.593950 0.187900 F\n0.000000 0.000000 0.000000 F\n0.191969 0.191969 0.383939 F\n0.808031 0.808031 0.616062 F\n",
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{
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"updated_at": "2022-09-04T14:38:36.063926Z",
"structure_string": "Ca3 Sn2 S7\n1.0\n3.528182 -3.528182 0.000000\n3.528182 3.528182 -0.000000\n-3.528182 -0.000000 11.688805\nCa Sn S\n3 2 7\ndirect\n0.500000 0.500000 0.000000 Ca\n0.329717 0.329717 0.659434 Ca\n0.670283 0.670283 0.340566 Ca\n0.112298 0.112298 0.224596 Sn\n0.887702 0.887702 0.775404 Sn\n0.000000 0.000000 0.000000 S\n0.590505 0.090505 0.181012 S\n0.090505 0.590505 0.181012 S\n0.409495 0.909495 0.818989 S\n0.909495 0.409495 0.818989 S\n0.214722 0.214722 0.429443 S\n0.785278 0.785278 0.570557 S\n",
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}
]
}