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{
"id": "jvasp-12805",
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"structure_string": "Li12 B4 O12\n1.0\n3.236434 -0.005135 0.000000\n-1.592621 8.183737 0.000000\n0.000000 0.000000 9.171824\nLi B O\n12 4 12\ndirect\n0.506536 0.982890 0.768524 Li\n0.493464 0.517112 0.268525 Li\n0.493464 0.017111 0.231475 Li\n0.506536 0.482889 0.731475 Li\n0.723698 0.888174 0.523639 Li\n0.276301 0.611827 0.023639 Li\n0.276301 0.111827 0.476360 Li\n0.723698 0.388174 0.976360 Li\n0.091578 0.631987 0.572425 Li\n0.908422 0.868014 0.072425 Li\n0.908422 0.368015 0.427574 Li\n0.091578 0.131987 0.927574 Li\n0.801116 0.245101 0.686800 B\n0.198884 0.254900 0.186800 B\n0.198884 0.754900 0.313200 B\n0.801116 0.745101 0.813200 B\n0.969827 0.900776 0.862392 O\n0.030173 0.599225 0.362393 O\n0.030172 0.099225 0.137607 O\n0.969827 0.400776 0.637607 O\n0.772464 0.611062 0.905556 O\n0.227536 0.888939 0.405556 O\n0.227536 0.388939 0.094444 O\n0.772464 0.111062 0.594443 O\n0.636198 0.720606 0.672170 O\n0.363802 0.779395 0.172170 O\n0.363802 0.279395 0.327830 O\n0.636198 0.220606 0.827829 O\n",
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{
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{
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"created_at": "2022-09-04T14:35:59.930265Z",
"updated_at": "2022-09-04T14:35:59.930296Z",
"structure_string": "Ba4 V1 Pb1\n1.0\n-0.000000 4.951965 4.951965\n4.951965 0.000000 4.951965\n4.951965 4.951965 -0.000000\nBa V Pb\n4 1 1\ndirect\n0.125840 0.624720 0.624720 Ba\n0.624720 0.624720 0.624720 Ba\n0.624720 0.125840 0.624720 Ba\n0.624720 0.624720 0.125840 Ba\n0.000000 0.000000 0.000000 V\n0.250000 0.250000 0.250000 Pb\n",
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{
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"created_at": "2022-09-04T14:38:29.566388Z",
"updated_at": "2022-09-04T14:38:29.566416Z",
"structure_string": "Ca2 Sn2 S6\n1.0\n0.000000 0.000000 -6.315966\n-3.331712 -5.770714 0.000000\n-3.331712 5.770714 -0.000000\nCa Sn S\n2 2 6\ndirect\n0.250000 0.666729 0.333271 Ca\n0.750000 0.333271 0.666729 Ca\n0.000000 0.000000 0.000000 Sn\n0.500000 0.000000 0.000000 Sn\n0.250000 0.174295 0.825705 S\n0.250000 0.651414 0.825730 S\n0.250000 0.174269 0.348586 S\n0.750000 0.825705 0.174295 S\n0.750000 0.348586 0.174269 S\n0.750000 0.825730 0.651414 S\n",
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{
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"structure_string": "Dy2 Mo2 Cl2 O8\n1.0\n6.091449 0.001456 1.513380\n1.776958 5.826506 1.513380\n0.012407 0.009189 6.848161\nDy Mo Cl O\n2 2 2 8\ndirect\n0.778265 0.778266 0.108968 Dy\n0.221736 0.221736 0.891031 Dy\n0.362498 0.362498 0.269742 Mo\n0.637503 0.637504 0.730258 Mo\n0.009082 0.009081 0.237916 Cl\n0.990919 0.990920 0.762084 Cl\n0.490168 0.110308 0.153655 O\n0.110308 0.490168 0.153655 O\n0.294670 0.294670 0.536175 O\n0.889693 0.509833 0.846345 O\n0.705331 0.705332 0.463825 O\n0.509832 0.889693 0.846345 O\n0.542218 0.542219 0.201451 O\n0.457783 0.457783 0.798549 O\n",
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{
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"created_at": "2022-09-04T14:38:16.158143Z",
"updated_at": "2022-09-04T14:38:16.158170Z",
"structure_string": "Ba4 Se1 Br1\n1.0\n-0.000000 4.952026 4.952026\n4.952026 -0.000000 4.952026\n4.952026 4.952026 -0.000000\nBa Se Br\n4 1 1\ndirect\n0.122788 0.625738 0.625738 Ba\n0.625738 0.625738 0.625738 Ba\n0.625738 0.122788 0.625738 Ba\n0.625738 0.625738 0.122788 Ba\n0.000000 0.000000 0.000000 Se\n0.250000 0.250000 0.250000 Br\n",
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{
"id": "jvasp-42166",
"created_at": "2022-09-04T14:37:55.321995Z",
"updated_at": "2022-09-04T14:37:55.322025Z",
"structure_string": "Li4 Mn2 Fe2 B4 O12\n1.0\n5.149024 -0.112854 -0.054432\n0.126917 5.969120 0.050397\n0.083040 1.602439 7.912070\nLi Mn Fe B O\n4 2 2 4 12\ndirect\n0.915907 0.537662 0.147619 Li\n0.427133 0.032160 0.648048 Li\n0.572867 0.967840 0.351952 Li\n0.084092 0.462338 0.852382 Li\n0.906876 0.257814 0.502579 Mn\n0.093124 0.742187 0.497422 Mn\n0.423231 0.793312 0.014756 Fe\n0.576768 0.206689 0.985245 Fe\n0.590277 0.571159 0.670161 B\n0.928524 0.904432 0.827839 B\n0.071475 0.095569 0.172161 B\n0.409722 0.428842 0.329840 B\n0.060865 0.002920 0.682925 O\n0.950390 0.248669 0.044218 O\n0.939135 0.997081 0.317076 O\n0.336167 0.045176 0.160196 O\n0.554410 0.549316 0.196235 O\n0.518568 0.253052 0.448212 O\n0.146455 0.482541 0.342395 O\n0.853544 0.517459 0.657606 O\n0.481431 0.746949 0.551789 O\n0.445590 0.450685 0.803765 O\n0.663833 0.954825 0.839805 O\n0.049609 0.751332 0.955783 O\n",
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{
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"created_at": "2022-09-04T14:37:10.629065Z",
"updated_at": "2022-09-04T14:37:10.629091Z",
"structure_string": "V4 Zn6 O14\n1.0\n5.172984 -0.000000 -0.000000\n-0.000000 4.973816 -1.341606\n0.000000 -0.113252 9.470793\nV Zn O\n4 6 14\ndirect\n0.756289 0.357098 0.202602 V\n0.256289 0.642903 0.797397 V\n0.256289 0.845505 0.202602 V\n0.756289 0.154496 0.797397 V\n0.718008 0.758082 -0.000000 Zn\n0.218008 0.241919 -0.000000 Zn\n0.795839 0.575344 0.601088 Zn\n0.295839 0.424657 0.398911 Zn\n0.795839 0.974255 0.398911 Zn\n0.295839 0.025746 0.601088 Zn\n0.300519 0.629270 -0.000000 O\n0.800519 0.370731 -0.000000 O\n0.443415 0.141872 0.153748 O\n0.943415 0.858129 0.846252 O\n0.072243 0.549847 0.254454 O\n0.572242 0.450155 0.745545 O\n0.182950 0.056416 0.405700 O\n0.072243 0.295392 0.745545 O\n0.682950 0.349286 0.405700 O\n0.182950 0.650715 0.594300 O\n0.943415 0.011876 0.153748 O\n0.682950 0.943586 0.594300 O\n0.572242 0.704609 0.254454 O\n0.443415 -0.011876 0.846252 O\n",
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{
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"created_at": "2022-09-04T14:37:42.420922Z",
"updated_at": "2022-09-04T14:37:42.420942Z",
"structure_string": "Ba2 Mg1 B6 O12\n1.0\n3.562082 2.056467 5.527140\n-3.562000 2.056470 5.527084\n0.000044 -4.113222 5.527218\nBa Mg B O\n2 1 6 12\ndirect\n0.212853 0.212854 0.212851 Ba\n0.787147 0.787147 0.787147 Ba\n0.000000 0.000000 0.000000 Mg\n0.363369 0.644964 0.756828 B\n0.644963 0.756830 0.363368 B\n0.756828 0.363371 0.644963 B\n0.636631 0.355037 0.243171 B\n0.355036 0.243171 0.636631 B\n0.243171 0.636630 0.355036 B\n0.464647 0.572827 0.196407 O\n0.803591 0.535353 0.427173 O\n0.427171 0.803592 0.535350 O\n0.535353 0.427174 0.803592 O\n0.312082 0.084251 0.841886 O\n0.158115 0.687915 0.915749 O\n0.084250 0.841886 0.312082 O\n0.687917 0.915750 0.158113 O\n0.572828 0.196409 0.464649 O\n0.915750 0.158115 0.687917 O\n0.841885 0.312086 0.084250 O\n0.196409 0.464648 0.572826 O\n",
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{
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"structure_string": "Li4 V4 O4 F12\n1.0\n4.440173 -0.025613 -0.000049\n-0.166395 11.446259 -0.000070\n0.000068 0.000031 4.780455\nLi V O F\n4 4 4 12\ndirect\n0.010869 0.055372 0.253292 Li\n0.989128 0.944628 0.746709 Li\n0.510870 0.555373 0.246707 Li\n0.489130 0.444628 0.753289 Li\n0.030352 0.684843 0.724265 V\n0.969648 0.315156 0.275735 V\n0.469645 0.815156 0.224266 V\n0.530352 0.184843 0.775736 V\n0.740743 0.298325 0.565503 O\n0.759256 0.201675 0.065503 O\n0.240743 0.798325 0.934495 O\n0.259254 0.701675 0.434495 O\n0.747090 0.931536 0.092202 F\n0.237905 0.193529 0.428113 F\n0.252908 0.068464 0.907798 F\n0.259432 0.933128 0.413002 F\n0.240565 0.566871 0.913001 F\n0.247091 0.431536 0.407797 F\n0.262097 0.306471 0.928112 F\n0.737903 0.693529 0.071888 F\n0.759433 0.433129 0.086995 F\n0.752907 0.568464 0.592199 F\n0.740566 0.066871 0.586997 F\n0.762094 0.806472 0.571887 F\n",
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{
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"created_at": "2022-09-04T14:35:51.062641Z",
"updated_at": "2022-09-04T14:35:51.062656Z",
"structure_string": "Sm2 Fe17\n1.0\n6.240972 0.033997 0.794405\n0.703953 6.201237 0.794405\n0.037866 0.033997 6.291214\nSm Fe\n2 17\ndirect\n0.344551 0.344552 0.344552 Sm\n0.655448 0.655450 0.655449 Sm\n0.847528 0.335686 0.335686 Fe\n0.152472 0.664315 0.664315 Fe\n0.664314 0.664315 0.152473 Fe\n0.664314 0.152472 0.664315 Fe\n0.290726 0.000000 0.709274 Fe\n-0.000000 0.709275 0.290726 Fe\n0.709274 0.290726 0.000001 Fe\n0.335686 0.335686 0.847528 Fe\n0.290725 0.709275 0.000001 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.909184 0.909185 0.909185 Fe\n0.090816 0.090816 0.090816 Fe\n0.335685 0.847529 0.335686 Fe\n0.000000 0.290726 0.709274 Fe\n0.709274 0.000000 0.290726 Fe\n",
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}