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{
"id": "jvasp-30643",
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{
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"structure_string": "Na1 Li1 Fe2 Si4 O12\n1.0\n4.753656 4.279410 -0.058260\n-4.753656 4.279410 0.058260\n-1.638799 0.000000 5.012880\nNa Li Fe Si O\n1 1 2 4 12\ndirect\n0.705976 0.705976 0.750000 Na\n0.257323 0.257323 0.250000 Li\n0.087663 0.087664 0.750000 Fe\n0.915484 0.915484 0.250000 Fe\n0.203632 0.610263 0.742833 Si\n0.390589 0.798864 0.240488 Si\n0.610263 0.203632 0.757167 Si\n0.798864 0.390589 0.259512 Si\n0.906848 0.630608 0.190797 O\n0.653805 0.369450 0.481530 O\n0.366619 0.105170 0.671518 O\n0.634454 0.348688 0.980990 O\n0.369450 0.653805 0.018470 O\n0.197292 0.975061 0.137918 O\n0.348687 0.634454 0.519010 O\n0.105169 0.366619 0.828482 O\n0.808968 0.033245 0.863688 O\n0.033245 0.808968 0.636312 O\n0.630608 0.906848 0.309203 O\n0.975061 0.197292 0.362082 O\n",
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{
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"structure_string": "V8 O8 F8\n1.0\n4.657675 -0.005562 -0.000165\n-0.005562 4.657501 -0.000121\n-0.000529 -0.000418 12.258574\nV O F\n8 8 8\ndirect\n0.971379 0.965097 0.999900 V\n0.034902 0.028625 0.250099 V\n0.986826 0.949169 0.500222 V\n0.050829 0.013173 0.749780 V\n0.535846 0.464154 0.125000 V\n0.478901 0.521101 0.625000 V\n0.476110 0.525099 0.875027 V\n0.474903 0.523890 0.374975 V\n0.818867 0.181138 0.125000 O\n0.686336 0.688942 0.500225 O\n0.689771 0.681192 0.999892 O\n0.311062 0.313660 0.749775 O\n0.318813 0.310226 0.250108 O\n0.191184 0.808813 0.624999 O\n0.188433 0.808835 0.376161 O\n0.191160 0.811563 0.873841 O\n0.211048 0.788949 0.125000 F\n0.297247 0.287651 0.999874 F\n0.279758 0.299613 0.500272 F\n0.712347 0.702756 0.250127 F\n0.700385 0.720244 0.749728 F\n0.798649 0.203450 0.374987 F\n0.798706 0.201299 0.625000 F\n0.796553 0.201354 0.875012 F\n",
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{
"id": "jvasp-42683",
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"structure_string": "Fe6 O8 F4\n1.0\n4.403454 0.001825 -0.002588\n0.001825 4.403454 -0.002588\n-0.002872 -0.002872 8.692314\nFe O F\n6 8 4\ndirect\n0.983449 0.960813 0.008793 Fe\n0.039186 0.016549 0.324540 Fe\n0.016385 0.983614 0.666666 Fe\n0.508100 0.491898 0.166667 Fe\n0.488234 0.530743 0.826365 Fe\n0.469256 0.511764 0.506967 Fe\n0.810220 0.189778 0.166667 O\n0.693656 0.703056 0.666922 O\n0.688851 0.683493 0.998774 O\n0.296943 0.306343 0.666411 O\n0.191543 0.805526 0.835206 O\n0.194472 0.808455 0.498126 O\n0.204239 0.795759 0.166667 O\n0.316506 0.311147 0.334559 O\n0.792054 0.195848 0.837448 F\n0.295640 0.292898 0.998891 F\n0.707100 0.704359 0.334441 F\n0.804151 0.207945 0.495884 F\n",
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{
"id": "jvasp-11055",
"created_at": "2022-09-04T14:37:30.714001Z",
"updated_at": "2022-09-04T14:37:30.714020Z",
"structure_string": "Ca1 Mn2 Si4 O12\n1.0\n5.299833 -0.050897 0.987635\n1.181505 6.327213 0.589526\n0.026418 0.029683 6.463400\nCa Mn Si O\n1 2 4 12\ndirect\n0.250001 0.699137 0.300861 Ca\n0.750001 0.911265 0.088733 Mn\n0.249999 0.099621 0.900379 Mn\n0.251528 0.205591 0.386073 Si\n0.248472 0.613927 0.794407 Si\n0.759678 0.381145 0.205857 Si\n0.740324 0.794141 0.618856 Si\n0.655199 0.952843 0.811383 O\n0.844802 0.188617 0.047155 O\n0.684635 0.624011 0.109981 O\n0.815364 0.890018 0.375989 O\n0.291940 0.381414 0.909368 O\n0.505041 0.660374 0.621395 O\n-0.005040 0.378605 0.339625 O\n0.333337 0.037907 0.198517 O\n0.018516 0.640168 0.650589 O\n0.481485 0.349412 0.359831 O\n0.208061 0.090632 0.618585 O\n0.166667 0.801482 0.962094 O\n",
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{
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"structure_string": "H4 N2 O3\n1.0\n3.057389 0.066976 -0.066976\n0.141898 5.513144 0.281672\n-0.141898 0.281672 5.513144\nH N O\n4 2 3\ndirect\n0.194506 0.380357 0.531706 H\n0.805494 0.531706 0.380356 H\n0.974050 0.206986 0.988299 H\n0.025950 0.988300 0.206985 H\n-0.000000 0.018031 0.018031 N\n0.500000 0.733057 0.733056 N\n-0.000000 0.386119 0.386119 O\n0.526596 0.649514 0.945220 O\n0.473404 0.945221 0.649513 O\n",
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{
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"created_at": "2022-09-04T14:37:33.666315Z",
"updated_at": "2022-09-04T14:37:33.666324Z",
"structure_string": "Ca2 Al4 Si2 O12\n1.0\n0.019980 0.000000 5.318751\n-4.654223 4.342904 1.324817\n-4.654223 -4.342904 1.324817\nCa Al Si O\n2 4 2 12\ndirect\n0.250001 0.311804 0.688196 Ca\n0.750001 0.688398 0.311601 Ca\n0.213809 0.813940 0.615168 Al\n0.286192 0.384832 0.186059 Al\n0.250001 0.911238 0.088761 Al\n0.750001 0.089790 0.910209 Al\n0.782079 0.194644 0.387056 Si\n0.717922 0.612943 0.805355 Si\n0.632302 0.804817 0.968989 O\n0.014439 0.327781 0.381189 O\n0.692888 0.096346 0.626494 O\n0.867699 0.031010 0.195182 O\n0.527004 0.372847 0.341464 O\n0.324502 0.899513 0.356727 O\n0.387202 0.178902 0.012938 O\n0.972997 0.658535 0.627152 O\n0.807113 0.373506 0.903653 O\n0.112799 0.987061 0.821098 O\n0.175499 0.643272 0.100486 O\n0.485562 0.618810 0.672218 O\n",
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{
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"structure_string": "Ca1 Mn2 F10\n1.0\n5.053650 0.056367 -1.984187\n-2.035547 4.990701 -0.654987\n-0.269807 -0.056165 7.455273\nCa Mn F\n1 2 10\ndirect\n0.288789 0.538789 0.749999 Ca\n-0.000338 0.008406 0.007797 Mn\n0.500608 0.991865 0.492202 Mn\n0.331021 0.081022 0.250000 F\n0.669566 0.919567 0.749999 F\n0.549110 0.724334 0.374308 F\n0.850024 0.174803 0.125691 F\n0.786703 0.692707 0.022292 F\n0.170413 0.764411 0.477707 F\n0.186182 0.316504 0.965277 F\n0.851226 0.220905 0.534721 F\n0.150369 0.836251 0.876102 F\n0.460148 0.274266 0.623896 F\n",
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{
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}