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{
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{
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"structure_string": "Ti12 Mn12 Ge24\n1.0\n0.000000 0.000000 -7.967393\n0.000000 -8.992129 0.000000\n-9.911979 0.000000 0.000000\nTi Mn Ge\n12 12 24\ndirect\n0.741537 0.830506 0.046681 Ti\n0.741537 0.169494 0.953319 Ti\n0.258463 0.669494 0.546681 Ti\n0.258463 0.330506 0.453319 Ti\n0.258463 0.169494 0.953319 Ti\n0.258463 0.830506 0.046681 Ti\n0.741537 0.330506 0.453319 Ti\n0.741537 0.669494 0.546681 Ti\n0.500000 0.835817 0.321645 Ti\n0.500000 0.164183 0.678355 Ti\n0.500000 0.664183 0.821645 Ti\n0.500000 0.335817 0.178355 Ti\n0.747578 0.587930 0.249449 Mn\n0.747578 0.412070 0.750551 Mn\n0.252422 0.912070 0.749449 Mn\n0.252422 0.087930 0.250551 Mn\n0.252422 0.412070 0.750551 Mn\n0.252422 0.587930 0.249449 Mn\n0.747578 0.087930 0.250551 Mn\n0.747578 0.912070 0.749449 Mn\n0.742648 0.000000 0.500000 Mn\n0.257352 0.500000 0.000000 Mn\n0.257352 0.000000 0.500000 Mn\n0.742648 0.500000 0.000000 Mn\n0.836525 0.835235 0.316295 Ge\n0.836525 0.164765 0.683705 Ge\n0.163475 0.664765 0.816295 Ge\n0.163475 0.335235 0.183705 Ge\n0.163475 0.164765 0.683705 Ge\n0.163475 0.835235 0.316295 Ge\n0.836525 0.335235 0.183705 Ge\n0.836525 0.664765 0.816295 Ge\n0.500000 0.539903 0.379684 Ge\n0.500000 0.460097 0.620316 Ge\n0.500000 0.960097 0.879684 Ge\n0.500000 0.039903 0.120316 Ge\n0.000000 0.546239 0.379893 Ge\n0.000000 0.453761 0.620107 Ge\n0.000000 0.953761 0.879893 Ge\n0.000000 0.046239 0.120107 Ge\n0.500000 0.638659 0.100630 Ge\n0.500000 0.361341 0.899370 Ge\n0.500000 0.861341 0.600630 Ge\n0.500000 0.138659 0.399370 Ge\n0.000000 0.634426 0.095636 Ge\n0.000000 0.365574 0.904364 Ge\n0.000000 0.865574 0.595636 Ge\n0.000000 0.134426 0.404364 Ge\n",
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{
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"created_at": "2022-09-04T14:47:00.388460Z",
"structure_string": "Li6 Ti1 Fe3 P6 O24\n1.0\n8.577264 0.000000 0.000000\n4.107318 7.595455 0.000000\n4.089045 2.457388 7.203990\nLi Ti Fe P O\n6 1 3 6 24\ndirect\n0.972899 0.000111 0.991756 Li\n0.253277 0.642961 0.846644 Li\n0.519911 0.502989 0.492005 Li\n0.718088 0.347438 0.152242 Li\n0.345818 0.154697 0.711780 Li\n0.154635 0.717918 0.345963 Li\n0.148885 0.149350 0.150401 Ti\n0.853647 0.861072 0.852511 Fe\n0.645941 0.646183 0.635678 Fe\n0.351669 0.351182 0.349615 Fe\n0.950013 0.556253 0.252511 P\n0.554460 0.254269 0.950360 P\n0.252078 0.952245 0.552960 P\n0.756105 0.041114 0.454552 P\n0.452121 0.755320 0.035759 P\n0.043732 0.460331 0.757012 P\n0.868915 0.501433 0.716921 O\n0.706073 0.878347 0.483364 O\n0.941655 0.735679 0.082239 O\n0.461629 0.709738 0.877745 O\n0.760346 0.560331 0.408820 O\n0.010489 0.382719 0.193752 O\n0.741008 0.096584 0.918293 O\n0.534610 0.423534 0.771374 O\n0.407342 0.759407 0.560820 O\n0.821683 0.997916 0.610646 O\n0.914923 0.071926 0.260013 O\n0.621010 0.808460 0.982477 O\n0.382777 0.189315 0.015516 O\n0.095816 0.922553 0.743625 O\n0.188877 0.008687 0.384878 O\n0.595377 0.229917 0.438473 O\n0.438418 0.596537 0.224851 O\n0.262365 0.919198 0.070748 O\n0.025038 0.615058 0.812098 O\n0.229180 0.434825 0.594978 O\n0.537884 0.310199 0.102110 O\n0.067788 0.267318 0.918265 O\n0.313326 0.101978 0.530965 O\n0.100190 0.533912 0.316282 O\n",
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"formula_full": "Li6 Ti1 Fe3 P6 O24",
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{
"id": "mp-1105583",
"created_at": "2022-09-04T14:47:00.393260Z",
"structure_string": "Er7 Co1 I12\n1.0\n5.759732 -7.760139 0.000000\n5.759732 7.760139 0.000000\n-4.695572 0.000000 8.446648\nEr Co I\n7 1 12\ndirect\n0.500000 0.500000 0.500000 Er\n0.285081 0.090382 0.021485 Er\n0.021485 0.285081 0.090382 Er\n0.090382 0.021485 0.285081 Er\n0.714919 0.909618 0.978515 Er\n0.978515 0.714919 0.909618 Er\n0.909618 0.978515 0.714919 Er\n0.000000 0.000000 0.000000 Co\n0.463399 0.161257 0.386882 I\n0.386882 0.463399 0.161257 I\n0.161257 0.386882 0.463399 I\n0.536601 0.838743 0.613118 I\n0.613118 0.536601 0.838743 I\n0.838743 0.613118 0.536601 I\n0.323320 0.775811 0.929307 I\n0.929307 0.323320 0.775811 I\n0.775811 0.929307 0.323320 I\n0.676680 0.224189 0.070693 I\n0.070693 0.676680 0.224189 I\n0.224189 0.070693 0.676680 I\n",
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{
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{
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"structure_string": "Mg14 Cr1 Cu1\n1.0\n6.274426 0.000000 -0.000000\n-3.137213 5.433812 -0.000000\n0.000000 -0.000000 9.935446\nMg Cr Cu\n14 1 1\ndirect\n0.165272 0.832636 0.125000 Mg\n0.168842 0.834420 0.625000 Mg\n0.667364 0.334728 0.125000 Mg\n0.665580 0.331158 0.625000 Mg\n0.667364 0.832636 0.125000 Mg\n0.665580 0.834420 0.625000 Mg\n0.327498 0.172502 0.371737 Mg\n0.327498 0.172502 0.878263 Mg\n0.327498 0.654997 0.371737 Mg\n0.327498 0.654997 0.878263 Mg\n0.845003 0.172502 0.371737 Mg\n0.845003 0.172502 0.878263 Mg\n0.833333 0.666667 0.374957 Mg\n0.833333 0.666667 0.875043 Mg\n0.166667 0.333333 0.625000 Cr\n0.166667 0.333333 0.125000 Cu\n",
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