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{
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{
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"created_at": "2022-09-04T14:37:05.149884Z",
"updated_at": "2022-09-04T14:37:05.149901Z",
"structure_string": "Ba2 Fe2 S2 O1 F2\n1.0\n4.019145 0.002279 -0.830363\n-0.173833 4.015262 -0.830722\n-0.011514 -0.011502 10.086259\nBa Fe S O F\n2 2 2 1 2\ndirect\n0.335103 0.335108 0.670208 Ba\n0.664887 0.664888 0.329795 Ba\n0.500040 0.999999 0.999998 Fe\n0.999997 0.500017 0.000002 Fe\n0.914558 0.914564 0.829094 S\n0.085430 0.085432 0.170907 S\n0.499994 0.499998 -0.000002 O\n0.750001 0.250001 0.500005 F\n0.249990 0.749995 0.499997 F\n",
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"updated_at": "2022-09-04T14:37:00.525047Z",
"structure_string": "Te2 Mo3 W1 Se4 S2\n1.0\n3.347932 0.000023 -0.000378\n-1.673946 2.899381 0.001186\n-0.004002 0.012110 35.024152\nTe Mo W Se S\n2 3 1 4 2\ndirect\n0.333241 0.666289 0.718703 Te\n0.333444 0.667346 0.610246 Te\n0.333354 0.666525 0.096544 Mo\n0.666748 0.333470 0.277088 Mo\n0.666677 0.333495 0.664533 Mo\n0.333213 0.666512 0.464791 W\n0.333317 0.666348 0.324635 Se\n0.666590 0.333529 0.416951 Se\n0.666461 0.332716 0.512622 Se\n0.333482 0.667213 0.229509 Se\n0.666761 0.333593 0.053224 S\n0.666701 0.332956 0.139905 S\n",
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"created_at": "2022-09-04T14:36:43.442269Z",
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"structure_string": "Ba1 Al1 Cr1 Cu1 O5\n1.0\n3.757773 0.000000 0.000000\n0.000000 3.757773 0.000000\n0.000000 -0.000000 7.631716\nBa Al Cr Cu O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.996918 Ba\n0.000000 0.000000 0.457895 Al\n0.500000 0.500000 0.685426 Cr\n0.500000 0.500000 0.270803 Cu\n0.000000 0.500000 0.624194 O\n0.500000 0.000000 0.624194 O\n0.000000 0.500000 0.300818 O\n0.500000 0.000000 0.300818 O\n0.500000 0.500000 0.926856 O\n",
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{
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"created_at": "2022-09-04T14:37:02.015206Z",
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"structure_string": "Al1 H16 C10 Cl1 O4\n1.0\n4.757365 -0.013961 0.833531\n0.641731 6.436852 2.552180\n0.043223 -0.203279 9.248469\nAl H C Cl O\n1 16 10 1 4\ndirect\n0.143802 0.746251 0.902399 Al\n0.349397 0.276375 0.390406 H\n0.502815 0.512411 0.495959 H\n0.532435 0.319064 0.676522 H\n-0.008337 0.299158 0.707497 H\n0.982992 0.524957 0.542660 H\n0.824079 0.201320 0.174403 H\n0.926281 0.951417 0.163428 H\n0.301984 0.084134 0.574583 H\n0.638808 0.836929 0.456684 H\n0.872384 0.243181 0.411572 H\n0.812642 0.048030 0.593593 H\n0.241290 0.169215 0.980086 H\n0.572670 0.272219 0.955398 H\n0.421579 0.875493 0.220928 H\n0.315029 0.123813 0.234569 H\n0.001376 0.875271 0.414049 H\n0.462594 0.131299 0.000795 C\n0.478863 0.035143 0.178758 C\n0.739033 0.117604 0.478715 C\n0.788168 0.954553 0.397500 C\n0.768229 0.040960 0.221530 C\n0.407880 0.374745 0.578615 C\n0.432626 0.208810 0.502205 C\n0.090804 0.562942 0.742392 C\n0.601587 0.983329 0.918768 C\n0.102316 0.435801 0.639897 C\n0.175300 0.561151 0.141909 Cl\n0.274941 0.695094 0.714141 O\n0.875399 0.959750 0.897593 O\n0.460534 0.882262 0.872217 O\n0.916846 0.545714 0.866384 O\n",
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"structure_string": "Ba1 Sr1 Mg1 Te1 O6\n1.0\n4.955637 -0.000000 2.861139\n1.651879 4.672220 2.861139\n-0.000000 -0.000000 5.722277\nBa Sr Mg Te O\n1 1 1 1 6\ndirect\n0.750001 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Te\n0.741302 0.741302 0.258699 O\n0.258699 0.741302 0.258699 O\n0.741302 0.258698 0.258699 O\n0.258699 0.258698 0.741302 O\n0.741302 0.258698 0.741302 O\n0.258699 0.741302 0.741302 O\n",
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}