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{
"id": "jvasp-57541",
"created_at": "2022-09-04T14:37:11.150496Z",
"updated_at": "2022-09-04T14:37:11.150517Z",
"structure_string": "Li2 Bi2 Pd4 O8\n1.0\n6.944098 0.000000 0.000000\n0.000000 6.944098 -0.000000\n0.000000 0.000000 4.360159\nLi Bi Pd O\n2 2 4 8\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.500000 Li\n0.500000 0.000000 0.524999 Bi\n0.000000 0.500000 0.475001 Bi\n0.750000 0.750000 0.000000 Pd\n0.750000 0.250000 0.000000 Pd\n0.250000 0.250000 0.000000 Pd\n0.250000 0.750000 0.000000 Pd\n0.724556 0.500000 0.760417 O\n0.500000 0.275444 0.239583 O\n0.275444 0.500000 0.760417 O\n0.775444 0.000000 0.239583 O\n0.500000 0.724556 0.239583 O\n0.000000 0.775444 0.760417 O\n0.224556 0.000000 0.239583 O\n0.000000 0.224556 0.760417 O\n",
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{
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"structure_string": "Mg2 Ni2 P2 O10\n1.0\n5.260443 -0.144592 0.410557\n-1.417056 5.128393 -0.070905\n-1.082326 -1.968729 5.941767\nMg Ni P O\n2 2 2 10\ndirect\n0.886534 0.725582 0.258560 Mg\n0.114655 0.277053 0.727687 Mg\n0.500593 0.001336 0.493147 Ni\n0.500577 0.001326 -0.006853 Ni\n0.237754 0.354866 0.238955 P\n0.763432 0.647812 0.747326 P\n0.523496 0.371403 0.179812 O\n0.180618 0.154418 0.385872 O\n0.477697 0.631255 0.806490 O\n0.820536 0.848220 0.600380 O\n0.775730 0.362936 0.604069 O\n-0.026854 0.734057 0.955056 O\n0.225464 0.639729 0.382256 O\n0.028068 0.268712 0.031223 O\n0.385335 0.076534 0.757532 O\n0.615849 0.926128 0.228761 O\n",
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{
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"structure_string": "Tb4 Cu4 S8\n1.0\n0.000000 6.377058 0.009707\n7.029975 0.000000 0.000000\n0.000000 -0.863632 -6.705889\nTb Cu S\n4 4 8\ndirect\n0.306595 0.047891 0.698576 Tb\n0.693406 0.547891 0.801423 Tb\n0.693406 0.952110 0.301423 Tb\n0.306595 0.452110 0.198576 Tb\n0.081485 0.840012 0.051157 Cu\n0.918515 0.159989 0.948842 Cu\n0.918515 0.340012 0.448842 Cu\n0.081485 0.659989 0.551157 Cu\n0.426183 0.726494 0.501186 S\n0.573817 0.226494 0.998814 S\n0.573817 0.273506 0.498814 S\n0.426183 0.773507 0.001186 S\n0.093666 0.386768 0.783297 S\n0.093666 0.113232 0.283297 S\n0.906335 0.613232 0.216702 S\n0.906335 0.886769 0.716702 S\n",
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{
"id": "jvasp-9407",
"created_at": "2022-09-04T14:37:11.194586Z",
"updated_at": "2022-09-04T14:37:11.194607Z",
"structure_string": "Li4 Al4 O8\n1.0\n5.201815 -0.000000 -0.000000\n0.000000 5.201815 0.000000\n-0.000000 -0.000000 6.267666\nLi Al O\n4 4 8\ndirect\n0.686555 0.313446 0.250000 Li\n0.186555 0.186555 0.500000 Li\n0.313446 0.686555 0.750001 Li\n0.813446 0.813446 0.000000 Li\n0.825174 0.825174 0.500000 Al\n0.674827 0.325174 0.750001 Al\n0.325174 0.674827 0.250000 Al\n0.174827 0.174827 0.000000 Al\n0.293083 0.334086 0.229840 O\n0.165914 0.793084 0.479840 O\n0.793084 0.165914 0.520160 O\n0.834087 0.206917 0.979841 O\n0.206917 0.834087 0.020160 O\n0.665915 0.706918 0.270160 O\n0.334086 0.293083 0.770160 O\n0.706918 0.665915 0.729841 O\n",
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{
"id": "jvasp-10886",
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"structure_string": "Mn2 Cu4 Si2 S8\n1.0\n6.194471 0.000000 0.000000\n0.000000 6.402772 0.000000\n0.000000 0.000000 7.494359\nMn Cu Si S\n2 4 2 8\ndirect\n0.329737 0.155914 0.000000 Mn\n0.829737 0.844086 0.500000 Mn\n0.319779 0.677145 0.748723 Cu\n0.819779 0.322855 0.751277 Cu\n0.319779 0.677145 0.251277 Cu\n0.819779 0.322855 0.248723 Cu\n0.330892 0.174819 0.500000 Si\n0.830892 0.825181 0.000000 Si\n0.982302 0.185371 0.500000 S\n0.482302 0.814628 0.000000 S\n0.449694 0.335276 0.266230 S\n0.949693 0.664724 0.233770 S\n0.943223 0.143657 0.000000 S\n0.443223 0.856343 0.500000 S\n0.449694 0.335276 0.733770 S\n0.949693 0.664724 0.766230 S\n",
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{
"id": "jvasp-34586",
"created_at": "2022-09-04T14:37:11.324193Z",
"updated_at": "2022-09-04T14:37:11.324218Z",
"structure_string": "Zn8 S8\n1.0\n1.920298 -3.326054 0.000000\n1.920298 3.326054 -0.000000\n0.000000 0.000000 25.126885\nZn S\n8 8\ndirect\n0.333334 0.666667 0.874758 Zn\n0.000000 -0.000000 0.999612 Zn\n0.666667 0.333334 0.375239 Zn\n0.666667 0.333334 0.124755 Zn\n0.000000 -0.000000 0.250148 Zn\n0.333334 0.666667 0.500119 Zn\n0.000000 -0.000000 0.625001 Zn\n0.666667 0.333334 0.749876 Zn\n0.666667 0.333334 0.656240 S\n0.666667 0.333334 0.281608 S\n0.333334 0.666667 0.781119 S\n0.000000 -0.000000 0.156324 S\n0.666667 0.333334 0.030957 S\n0.000000 -0.000000 0.906003 S\n0.333334 0.666667 0.406480 S\n0.000000 -0.000000 0.531363 S\n",
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{
"id": "jvasp-10875",
"created_at": "2022-09-04T14:37:11.388346Z",
"updated_at": "2022-09-04T14:37:11.388364Z",
"structure_string": "Al4 Ag4 O8\n1.0\n5.433318 0.000000 0.000000\n0.000000 5.481462 0.000000\n0.000000 0.000000 6.986104\nAl Ag O\n4 4 8\ndirect\n0.933203 0.000179 0.124299 Al\n0.566797 0.500178 0.624299 Al\n0.066797 0.500178 0.875700 Al\n0.433203 0.000179 0.375701 Al\n0.446813 0.997053 0.861697 Ag\n0.553187 0.497053 0.138302 Ag\n0.053187 0.497053 0.361697 Ag\n0.946813 0.997053 0.638302 Ag\n0.382203 0.564490 0.828846 O\n0.617797 0.064491 0.171153 O\n0.117797 0.064491 0.328847 O\n0.882203 0.564490 0.671153 O\n0.468021 0.686178 0.431616 O\n0.968021 0.686178 0.068384 O\n0.031979 0.186178 0.931616 O\n0.531980 0.186178 0.568383 O\n",
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{
"id": "jvasp-10696",
"created_at": "2022-09-04T14:37:11.550842Z",
"updated_at": "2022-09-04T14:37:11.550875Z",
"structure_string": "Sr4 Li2 Re2 N8\n1.0\n0.000000 6.188251 0.011755\n5.865837 0.000000 0.000000\n0.000000 -1.961897 -6.620717\nSr Li Re N\n4 2 2 8\ndirect\n0.261582 0.250000 0.942714 Sr\n0.738417 0.750000 0.057286 Sr\n0.783174 0.750000 0.569148 Sr\n0.216825 0.250000 0.430852 Sr\n0.307162 0.750000 0.689107 Li\n0.692837 0.250000 0.310893 Li\n0.716693 0.250000 0.798112 Re\n0.283307 0.750000 0.201888 Re\n0.472674 0.503800 0.252274 N\n0.527326 0.003800 0.747726 N\n0.527326 0.496201 0.747726 N\n0.472674 0.996201 0.252274 N\n0.099760 0.750000 0.373613 N\n0.900239 0.250000 0.626387 N\n0.116795 0.750000 0.934099 N\n0.883204 0.250000 0.065901 N\n",
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],
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"volume": 240.19192659160092,
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{
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"updated_at": "2022-09-04T14:37:11.432641Z",
"structure_string": "Ga2 H6 N2 F6\n1.0\n5.522376 0.000000 0.000000\n0.000000 2.761918 4.813368\n0.000000 -2.761918 4.813368\nGa H N F\n2 6 2 6\ndirect\n0.251143 0.641546 0.141546 Ga\n0.748858 0.141546 0.641546 Ga\n0.024469 0.873133 0.373133 H\n0.975532 0.373133 0.873133 H\n0.284091 0.040812 0.237415 H\n0.715910 0.237415 0.040812 H\n0.715910 0.540813 0.737415 H\n0.284091 0.737415 0.540813 H\n0.205712 0.845678 0.345678 N\n0.794288 0.345678 0.845678 N\n0.500000 0.906196 0.906196 F\n0.500000 0.406196 0.406196 F\n0.000000 0.869147 0.869147 F\n0.000000 0.369147 0.369147 F\n0.288482 0.447673 0.947673 F\n0.711519 0.947673 0.447673 F\n",
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{
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"created_at": "2022-09-04T14:37:11.441679Z",
"updated_at": "2022-09-04T14:37:11.441707Z",
"structure_string": "Mg2 Co2 P2 O10\n1.0\n5.420128 -0.237313 -0.100810\n-1.427334 4.899628 0.274326\n-1.677044 -1.599404 6.012222\nMg Co P O\n2 2 2 10\ndirect\n0.776413 0.618920 0.224355 Mg\n0.233718 0.372575 0.746546 Mg\n0.505067 0.995733 0.485440 Co\n0.505095 0.995755 0.985435 Co\n0.158783 0.283033 0.240242 P\n0.851378 0.708468 0.730655 P\n0.350481 0.325458 0.093494 O\n0.132230 -0.008130 0.305788 O\n0.659684 0.666047 0.877405 O\n0.877909 0.999621 0.665094 O\n0.750110 0.475452 0.518822 O\n0.132815 0.702026 0.867646 O\n0.260075 0.516042 0.452082 O\n0.877362 0.289504 0.103252 O\n0.435793 0.101328 0.728117 O\n0.574364 0.890198 0.242758 O\n",
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},
{
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"created_at": "2022-09-04T14:37:11.489638Z",
"updated_at": "2022-09-04T14:37:11.489656Z",
"structure_string": "Ag6 Se2 N2 O6\n1.0\n6.253653 0.061015 0.463948\n0.435288 6.238784 0.463948\n0.064783 0.061015 6.270504\nAg Se N O\n6 2 2 6\ndirect\n0.799900 0.257668 0.934122 Ag\n0.934122 0.799899 0.257669 Ag\n0.257669 0.934120 0.799901 Ag\n0.299900 0.434121 0.757669 Ag\n0.434122 0.757668 0.299901 Ag\n0.757669 0.299900 0.434122 Ag\n0.280878 0.280878 0.280878 Se\n0.780878 0.780877 0.780879 Se\n0.431135 0.431135 0.431135 N\n0.931135 0.931134 0.931136 N\n0.656747 0.584446 0.936800 O\n0.584447 0.936799 0.656748 O\n0.936800 0.656746 0.584448 O\n0.436800 0.084447 0.156748 O\n0.084447 0.156747 0.436800 O\n0.156748 0.436800 0.084447 O\n",
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"formula_full": "Ag6 Se2 N2 O6",
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},
{
"id": "jvasp-57303",
"created_at": "2022-09-04T14:37:11.514771Z",
"updated_at": "2022-09-04T14:37:11.514800Z",
"structure_string": "Li4 Mn4 O8\n1.0\n5.025583 -0.000000 -2.621439\n-1.367392 4.835983 -2.621439\n0.007564 0.009999 6.142515\nLi Mn O\n4 4 8\ndirect\n0.500000 0.000000 -0.000000 Li\n0.499999 0.500000 0.500000 Li\n0.500000 0.500000 -0.000000 Li\n-0.000000 0.500000 0.500000 Li\n-0.000000 0.000000 0.500000 Mn\n0.000000 0.500000 -0.000000 Mn\n0.499999 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.253261 0.771778 0.506521 O\n0.234743 0.253261 0.006521 O\n0.746738 0.228222 0.493479 O\n0.746738 0.765257 0.493479 O\n0.228221 0.746739 0.993479 O\n0.765256 0.746739 0.993479 O\n0.771777 0.253261 0.006521 O\n0.253261 0.234743 0.506521 O\n",
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"formula_full": "Li4 Mn4 O8",
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}
]
}