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{
"id": "jvasp-25646",
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"structure_string": "Ca10 As6 O24 F2\n1.0\n-7.013699 -0.044991 -0.046609\n-0.171886 -9.604162 0.017067\n0.313265 4.769583 8.470602\nCa As O F\n10 6 24 2\ndirect\n0.995377 0.358284 0.703925 Ca\n0.004624 0.641716 0.296075 Ca\n0.770278 0.225391 -0.006285 Ca\n0.269558 0.251837 0.248856 Ca\n0.730444 0.748162 0.751144 Ca\n0.498615 0.690419 0.345722 Ca\n0.501387 0.309581 0.654278 Ca\n0.741052 0.008964 0.244071 Ca\n0.258949 0.991036 0.755930 Ca\n0.229723 0.774609 0.006285 Ca\n0.764723 0.387269 0.370449 As\n0.766523 0.974425 0.604612 As\n0.721553 0.627466 0.024497 As\n0.235279 0.612730 0.629551 As\n0.233478 0.025574 0.395388 As\n0.278449 0.372534 0.975503 As\n0.448436 0.098383 0.377470 O\n0.781982 0.308099 0.494448 O\n0.200338 0.124194 0.596271 O\n0.285888 0.483986 0.880086 O\n0.714113 0.516014 0.119914 O\n0.706967 0.587145 0.468868 O\n0.241390 0.822246 0.308024 O\n0.452527 0.228528 0.896288 O\n0.293035 0.412855 0.531132 O\n0.547474 0.771472 0.103712 O\n0.799664 0.875806 0.403729 O\n0.398214 0.730549 0.775632 O\n0.711699 0.520359 0.822129 O\n0.062751 0.276053 0.915146 O\n0.218019 0.691901 0.505553 O\n0.929655 0.925200 0.709546 O\n0.034790 0.628149 0.733771 O\n0.758612 0.177754 0.691976 O\n0.288302 0.479641 0.177871 O\n0.601788 0.269451 0.224368 O\n0.551566 0.901617 0.622531 O\n0.937250 0.723947 0.084854 O\n0.070346 0.074799 0.290454 O\n0.965212 0.371851 0.266229 O\n0.756682 0.978474 0.992145 F\n0.243319 0.021526 0.007855 F\n",
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{
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{
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"updated_at": "2022-09-04T14:35:49.314254Z",
"structure_string": "Ba1 Li2 Fe1\n1.0\n4.318235 0.000000 0.000000\n0.000000 4.318235 -0.000000\n-0.000000 -0.000000 4.983329\nBa Li Fe\n1 2 1\ndirect\n0.499999 0.499999 0.500000 Ba\n0.499999 0.000000 0.000000 Li\n0.000000 0.499999 0.000000 Li\n0.000000 0.000000 0.500000 Fe\n",
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{
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"created_at": "2022-09-04T14:38:31.265475Z",
"updated_at": "2022-09-04T14:38:31.265500Z",
"structure_string": "Li2 Ti4 O8\n1.0\n5.160405 -0.000000 2.979361\n1.720135 4.865277 2.979361\n0.000000 0.000000 5.958722\nLi Ti O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Li\n0.875001 0.875001 0.874998 Li\n0.500001 0.500000 0.499999 Ti\n0.500000 0.000000 0.499999 Ti\n0.000000 0.500000 0.499999 Ti\n0.500001 0.500000 -0.000001 Ti\n0.261918 0.261918 0.714248 O\n0.738084 0.738083 0.738081 O\n0.738084 0.738083 0.285750 O\n0.261918 0.714249 0.261917 O\n0.261918 0.261918 0.261917 O\n0.285752 0.738083 0.738081 O\n0.738083 0.285752 0.738081 O\n0.714249 0.261918 0.261917 O\n",
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"structure_string": "Na4 V2 O6\n1.0\n2.652907 4.594619 -0.005360\n-2.652907 4.594619 0.005360\n-1.813738 0.000000 5.339552\nNa V O\n4 2 6\ndirect\n0.157682 0.157683 0.500000 Na\n0.842317 0.842318 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.667595 0.667595 0.000000 V\n0.332405 0.332405 0.000000 V\n0.308858 0.691142 0.797571 O\n0.068535 0.552708 0.200259 O\n0.447292 0.931465 0.200259 O\n0.931465 0.447292 0.799742 O\n0.552708 0.068535 0.799742 O\n0.691142 0.308858 0.202429 O\n",
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{
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"created_at": "2022-09-04T14:35:47.022072Z",
"updated_at": "2022-09-04T14:35:47.022098Z",
"structure_string": "Rb4 Cr4 F20\n1.0\n5.540073 0.000000 0.000000\n0.000000 7.794240 0.000000\n0.000000 0.000000 9.664776\nRb Cr F\n4 4 20\ndirect\n0.500000 0.877569 0.970450 Rb\n0.500000 0.122431 0.470450 Rb\n0.000000 0.351541 0.152836 Rb\n0.000000 0.648459 0.652836 Rb\n0.000000 0.862866 0.229647 Cr\n0.500000 0.577426 0.344778 Cr\n0.500000 0.422574 0.844778 Cr\n0.000000 0.137134 0.729647 Cr\n0.735387 0.471088 0.439746 F\n0.252787 0.685540 0.228537 F\n0.000000 0.850568 0.414164 F\n0.264612 0.471088 0.439746 F\n0.252787 0.314460 0.728537 F\n0.000000 0.149432 0.914165 F\n0.500000 0.403895 0.219385 F\n0.000000 0.165087 0.544403 F\n0.766905 0.024998 0.223103 F\n0.766905 0.975002 0.723103 F\n0.233095 0.975002 0.723103 F\n0.500000 0.596105 0.719385 F\n0.500000 0.763469 0.453078 F\n0.500000 0.236531 0.953078 F\n0.747212 0.314460 0.728537 F\n0.233095 0.024998 0.223103 F\n0.747212 0.685540 0.228537 F\n0.264612 0.528912 0.939746 F\n0.000000 0.834913 0.044403 F\n0.735387 0.528912 0.939746 F\n",
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{
"id": "jvasp-3678",
"created_at": "2022-09-04T14:36:06.044301Z",
"updated_at": "2022-09-04T14:36:06.044327Z",
"structure_string": "Rb2 Pb1 Cl6\n1.0\n6.245357 -0.000000 3.605759\n2.081786 5.888180 3.605759\n0.000000 0.000000 7.211518\nRb Pb Cl\n2 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750001 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Pb\n0.251490 0.748511 0.748511 Cl\n0.251490 0.748511 0.251489 Cl\n0.748511 0.251489 0.748511 Cl\n0.748511 0.251489 0.251489 Cl\n0.748511 0.748511 0.251489 Cl\n0.251490 0.251489 0.748511 Cl\n",
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{
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"created_at": "2022-09-04T14:37:12.325828Z",
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"structure_string": "Mg2 Cd2\n1.0\n4.982638 0.000000 0.000000\n-2.491318 4.315090 -0.000000\n0.000000 0.000000 5.708269\nMg Cd\n2 2\ndirect\n0.333333 0.666667 0.437517 Mg\n0.666667 0.333333 0.937517 Mg\n0.333333 0.666667 0.937483 Cd\n0.666667 0.333333 0.437483 Cd\n",
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{
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"updated_at": "2022-09-04T14:38:18.914535Z",
"structure_string": "Nb1 O3\n1.0\n3.983237 -0.000000 0.000000\n0.000000 3.983237 0.000000\n-0.000000 0.000000 3.986218\nNb O\n1 3\ndirect\n0.000000 0.000000 0.993838 Nb\n0.500000 0.000000 0.004344 O\n0.000000 0.000000 0.501612 O\n-0.000000 0.500000 0.004344 O\n",
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},
{
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"created_at": "2022-09-04T14:38:44.973197Z",
"updated_at": "2022-09-04T14:38:44.973224Z",
"structure_string": "Li1 Cr4 In1 S8\n1.0\n6.211893 0.020735 3.847529\n2.152924 5.826917 3.847529\n0.029660 0.020735 7.306861\nLi Cr In S\n1 4 1 8\ndirect\n0.369611 0.369611 0.369612 Li\n0.490236 0.002944 0.002944 Cr\n0.002944 0.002944 0.490236 Cr\n0.002944 0.490236 0.002944 Cr\n0.627404 0.627403 0.627405 Cr\n0.005085 0.005085 0.005085 In\n0.230907 0.745821 0.745822 S\n0.745821 0.745821 0.230909 S\n0.745821 0.230907 0.745822 S\n0.758527 0.758527 0.758529 S\n0.770746 0.256545 0.256546 S\n0.256546 0.256545 0.770747 S\n0.256545 0.770746 0.256546 S\n0.236860 0.236860 0.236861 S\n",
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"structure_string": "Sb4 S4 Br12 F24\n1.0\n8.038151 0.000000 0.000000\n0.000000 9.036977 0.000000\n0.000000 0.000000 12.546583\nSb S Br F\n4 4 12 24\ndirect\n0.313699 0.965518 0.185355 Sb\n0.686301 0.465518 0.314645 Sb\n0.186301 0.034483 0.685355 Sb\n0.813699 0.534483 0.814645 Sb\n0.644629 0.024956 0.476025 S\n0.355371 0.524956 0.023975 S\n0.144629 0.475045 0.523975 S\n0.855371 0.975045 0.976024 S\n0.208996 0.315360 0.399089 Br\n0.708996 0.184640 0.600910 Br\n0.640395 0.813041 0.562250 Br\n0.791004 0.815360 0.100910 Br\n0.133188 0.503558 0.127549 Br\n0.859605 0.186960 0.062250 Br\n0.866812 0.003558 0.372451 Br\n0.633188 0.996443 0.872451 Br\n0.140395 0.686960 0.437750 Br\n0.366812 0.496442 0.627549 Br\n0.291004 0.684640 0.899089 Br\n0.359605 0.313041 0.937750 Br\n0.220216 0.155345 0.222906 F\n0.302230 0.027851 0.551325 F\n0.900720 0.726375 0.850937 F\n0.400720 0.773626 0.149063 F\n0.619663 0.625178 0.750470 F\n0.802230 0.472149 0.448674 F\n0.002009 0.437720 0.875965 F\n0.697770 0.527851 0.948674 F\n0.497991 0.562280 0.375965 F\n0.119663 0.874822 0.249530 F\n0.921748 0.548090 0.678793 F\n0.720216 0.344655 0.777094 F\n0.880337 0.374822 0.250470 F\n0.197770 0.972150 0.051326 F\n0.779783 0.655345 0.277094 F\n0.421748 0.951911 0.321207 F\n0.279784 0.844655 0.722906 F\n0.099280 0.226375 0.649062 F\n0.599280 0.273625 0.350937 F\n0.380337 0.125178 0.749530 F\n0.078252 0.048089 0.821207 F\n0.578251 0.451911 0.178793 F\n-0.002009 0.937720 0.624035 F\n0.502009 0.062280 0.124035 F\n",
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]
}