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{
"id": "jvasp-22497",
"created_at": "2022-09-04T14:37:37.801173Z",
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"structure_string": "Ca4 Co2 N4\n1.0\n4.557211 0.000000 1.831516\n1.670752 5.096003 2.428226\n0.055930 -0.025086 6.446257\nCa Co N\n4 2 4\ndirect\n0.682569 0.236159 0.398705 Ca\n0.317430 0.763840 0.601297 Ca\n0.043214 0.687578 0.225992 Ca\n0.956786 0.312421 0.774010 Ca\n0.374926 0.126605 0.123545 Co\n0.625074 0.873393 0.876458 Co\n0.186443 0.235058 0.392058 N\n0.813557 0.764941 0.607945 N\n0.477095 0.240597 0.805212 N\n0.522904 0.759401 0.194790 N\n",
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{
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"created_at": "2022-09-04T14:36:56.067166Z",
"updated_at": "2022-09-04T14:36:56.067188Z",
"structure_string": "Li4 Ni4 C4 O16\n1.0\n0.000000 3.057665 0.009619\n9.164823 0.000000 0.000000\n0.000000 -2.647047 -9.044237\nLi Ni C O\n4 4 4 16\ndirect\n0.408082 0.602113 0.184367 Li\n0.591919 0.102113 0.315633 Li\n0.408082 0.897887 0.684368 Li\n0.591918 0.397887 0.815633 Li\n0.782887 0.881129 0.059559 Ni\n0.217114 0.381130 0.440441 Ni\n0.782887 0.618870 0.559560 Ni\n0.217114 0.118870 0.940441 Ni\n0.065847 0.661128 0.866302 C\n0.934154 0.161128 0.633699 C\n0.065847 0.838872 0.366302 C\n0.934154 0.338872 0.133698 C\n0.147396 0.527351 0.869352 O\n0.096606 0.233208 0.757775 O\n0.903395 0.733208 0.742225 O\n0.852605 0.027351 0.630648 O\n0.372617 0.493231 0.610671 O\n0.844289 0.234786 0.507369 O\n0.155712 0.765213 0.492631 O\n0.372617 0.006769 0.110670 O\n0.147396 0.972649 0.369352 O\n0.096606 0.266792 0.257775 O\n0.903395 0.766792 0.242225 O\n0.852605 0.472649 0.130648 O\n0.627384 0.993230 0.889330 O\n0.844289 0.265213 0.007369 O\n0.627384 0.506769 0.389330 O\n0.155712 0.734786 0.992631 O\n",
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{
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"structure_string": "Li4 Fe4 F12\n1.0\n5.259435 0.000000 0.000000\n-0.000000 5.221685 0.000000\n0.000000 0.000000 7.796842\nLi Fe F\n4 4 12\ndirect\n0.979078 0.979312 0.250000 Li\n0.520923 0.479313 0.750000 Li\n0.479078 0.520686 0.250000 Li\n0.020923 0.020687 0.750000 Li\n0.000000 0.500000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.168843 0.157543 0.076212 F\n0.331158 0.657543 0.923788 F\n0.331158 0.657543 0.576211 F\n0.384845 0.135791 0.750000 F\n0.615156 0.864209 0.250000 F\n0.831158 0.842456 0.923788 F\n0.668843 0.342456 0.076212 F\n0.831158 0.842456 0.576211 F\n0.168843 0.157543 0.423788 F\n0.884846 0.364209 0.750000 F\n0.668843 0.342456 0.423788 F\n0.115155 0.635790 0.250000 F\n",
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{
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"created_at": "2022-09-04T14:35:41.903085Z",
"updated_at": "2022-09-04T14:35:41.903117Z",
"structure_string": "Ba2 Be4 B4 O12\n1.0\n5.686771 0.000000 2.748927\n2.843385 5.895914 1.374463\n-0.007822 0.000000 7.272826\nBa Be B O\n2 4 4 12\ndirect\n0.375000 0.250000 0.250000 Ba\n0.625001 0.749999 0.750000 Ba\n0.217195 0.749999 0.565611 Be\n0.782805 0.250000 0.434389 Be\n0.967195 0.250000 0.065611 Be\n0.032806 0.749999 0.934389 Be\n0.340172 0.319656 0.750000 B\n0.090173 0.819656 0.250000 B\n0.909829 0.180343 0.750001 B\n0.659829 0.680343 0.250000 B\n0.266488 0.203550 0.927429 O\n0.806084 0.296449 0.927430 O\n0.777100 0.445802 0.250000 O\n0.222901 0.554197 0.750000 O\n0.733514 0.796449 0.072571 O\n0.027101 0.945802 0.750000 O\n0.193917 0.703550 0.072571 O\n0.897467 0.296449 0.572572 O\n0.470039 0.796449 0.427429 O\n0.972901 0.054198 0.250000 O\n0.529963 0.203550 0.572571 O\n0.102534 0.703550 0.427429 O\n",
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{
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"created_at": "2022-09-04T14:38:47.342275Z",
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"structure_string": "Ti1 Al1 N2\n1.0\n3.189419 0.000000 0.000000\n0.000000 3.189419 0.000000\n0.000000 0.000000 4.518883\nTi Al N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.499999 Al\n0.500000 0.000000 0.261874 N\n0.000000 0.500000 0.738124 N\n",
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{
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"created_at": "2022-09-04T14:37:50.329231Z",
"updated_at": "2022-09-04T14:37:50.329250Z",
"structure_string": "K1 Rb2 Mo1 F6\n1.0\n5.565460 0.000000 3.213218\n1.855153 5.247165 3.213218\n0.000000 0.000000 6.426439\nK Rb Mo F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.250000 0.250000 0.250000 Rb\n0.749999 0.750001 0.750000 Rb\n0.000000 0.000000 0.000000 Mo\n0.226604 0.773396 0.773396 F\n0.226604 0.773396 0.226605 F\n0.773395 0.226605 0.773396 F\n0.226604 0.226605 0.773396 F\n0.773395 0.226605 0.226605 F\n0.773395 0.773396 0.226605 F\n",
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"structure_string": "Ca2 Mg2 As2 O8 F2\n1.0\n5.474670 -0.007016 -1.337521\n-1.966809 5.109180 -1.337521\n-0.012334 -0.017940 7.115142\nCa Mg As O F\n2 2 2 8 2\ndirect\n0.167708 0.332292 0.250000 Ca\n0.832293 0.667707 0.750000 Ca\n0.500000 -0.000000 -0.000000 Mg\n0.500000 -0.000000 0.500000 Mg\n0.821166 0.678833 0.250000 As\n0.178834 0.321166 0.750000 As\n0.759716 0.381335 0.073932 O\n0.118664 0.740284 0.426068 O\n0.171143 0.099803 0.881166 O\n0.400197 0.328857 0.618833 O\n0.828857 0.900196 0.118833 O\n0.599803 0.671142 0.381167 O\n0.240284 0.618664 0.926068 O\n0.881336 0.259716 0.573932 O\n0.417973 0.082027 0.250000 F\n0.582027 0.917973 0.750000 F\n",
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}