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{
"id": "jvasp-29019",
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{
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"structure_string": "Li3 Al2 V1 O6\n1.0\n2.490928 4.312284 0.013878\n-2.490928 4.312284 -0.013878\n-1.692513 0.000000 4.748198\nLi Al V O\n3 2 1 6\ndirect\n0.167951 0.167951 0.500000 Li\n0.500000 0.499999 0.500000 Li\n0.832048 0.832048 0.500000 Li\n0.333466 0.333466 0.000000 Al\n0.666533 0.666533 -0.000000 Al\n0.000000 0.000000 0.000000 V\n0.273990 0.726009 0.778796 O\n0.420678 0.926545 0.219272 O\n0.073454 0.579321 0.219272 O\n0.926545 0.420677 0.780728 O\n0.579322 0.073454 0.780728 O\n0.726010 0.273990 0.221205 O\n",
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{
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"updated_at": "2022-09-04T14:38:16.345894Z",
"structure_string": "Mo3 W1 Se2 S6\n1.0\n3.225722 -0.000001 0.000000\n-1.612862 2.793461 0.002588\n-0.000001 -0.024961 25.322881\nMo W Se S\n3 1 2 6\ndirect\n0.333090 0.666179 0.005563 Mo\n0.333844 0.667686 0.495914 Mo\n0.666609 0.333220 0.250762 Mo\n0.666460 0.332921 0.750677 W\n0.333133 0.666266 0.818646 Se\n0.333110 0.666220 0.682709 Se\n0.333289 0.666582 0.312197 S\n0.666410 0.332820 -0.055895 S\n0.667169 0.334339 0.434484 S\n0.666443 0.332885 0.066995 S\n0.667191 0.334379 0.557370 S\n0.333252 0.666506 0.189327 S\n",
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{
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"structure_string": "Li3 Y1 Ni2 O6\n1.0\n5.218352 0.011899 -0.778855\n2.857840 4.368008 0.774255\n0.004848 -0.006262 5.128341\nLi Y Ni O\n3 1 2 6\ndirect\n0.195463 0.195662 0.499987 Li\n0.473606 0.473305 0.500126 Li\n0.808313 0.807892 0.500161 Li\n0.003606 0.003462 0.000139 Y\n0.336100 0.336159 -0.000036 Ni\n0.667442 0.667538 -0.000078 Ni\n0.292897 0.693041 0.765627 O\n0.087261 0.560502 0.230434 O\n0.428308 0.953727 0.230457 O\n0.953551 0.428087 0.769475 O\n0.560526 0.087240 0.769547 O\n0.692923 0.293389 0.234160 O\n",
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"created_at": "2022-09-04T14:37:02.620496Z",
"updated_at": "2022-09-04T14:37:02.620511Z",
"structure_string": "Te2 Mo3 W1 Se6\n1.0\n3.387317 0.000000 0.000000\n-1.693658 2.933508 -0.000239\n-0.000005 -0.003496 36.205557\nTe Mo W Se\n2 3 1 6\ndirect\n0.666760 0.333522 0.416283 Te\n0.666843 0.333681 0.520849 Te\n0.332982 0.665964 0.097248 Mo\n0.666631 0.333256 0.277526 Mo\n0.666917 0.333844 0.659576 Mo\n0.333469 0.666938 0.468567 W\n0.333351 0.666697 0.323217 Se\n0.333634 0.667279 0.705188 Se\n0.666268 0.332535 0.051633 Se\n0.666370 0.332734 0.142922 Se\n0.333239 0.666475 0.231862 Se\n0.333531 0.667074 0.613878 Se\n",
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"structure_string": "Te6 Mo3 W1 S2\n1.0\n3.461379 -0.000037 0.000000\n-1.730722 2.997359 0.000042\n0.000002 0.000465 36.208993\nTe Mo W S\n6 3 1 2\ndirect\n0.333633 0.667224 0.339364 Te\n0.333166 0.666332 0.705938 Te\n0.666952 0.333853 0.037230 Te\n0.666336 0.332709 0.139530 Te\n0.333026 0.666105 0.236991 Te\n0.333520 0.667103 0.603612 Te\n0.333337 0.666694 0.088336 Mo\n0.666638 0.333257 0.288179 Mo\n0.666653 0.333307 0.654849 Mo\n0.333371 0.666729 0.471575 W\n0.666512 0.332958 0.430404 S\n0.666857 0.333722 0.512739 S\n",
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"structure_string": "Te2 Mo1 W3 Se6\n1.0\n3.383183 0.000000 0.000000\n-1.691591 2.929934 0.000059\n0.000000 0.001332 33.777151\nTe Mo W Se\n2 1 3 6\ndirect\n0.666972 0.333941 0.019917 Te\n0.666825 0.333649 0.131391 Te\n0.333585 0.667170 0.075616 Mo\n0.334372 0.668744 0.475659 W\n0.666014 0.332028 0.281385 W\n0.666061 0.332120 0.670259 W\n0.332667 0.665333 0.330588 Se\n0.332736 0.665471 0.719428 Se\n0.667694 0.335385 0.426447 Se\n0.667688 0.335376 0.524875 Se\n0.332688 0.665376 0.232149 Se\n0.332697 0.665395 0.621032 Se\n",
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{
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"structure_string": "Li4 Ni6 O2 F12\n1.0\n5.543691 -0.006718 2.119496\n0.319336 5.972181 2.575446\n-0.059686 0.011177 7.811783\nLi Ni O F\n4 6 2 12\ndirect\n0.316238 0.855772 0.468492 Li\n0.126114 0.301046 0.069506 Li\n0.873886 0.698955 0.930495 Li\n0.683762 0.144228 0.531509 Li\n0.781454 0.569634 0.655440 Ni\n0.925421 0.837139 0.220114 Ni\n0.352424 0.726079 0.931171 Ni\n0.647576 0.273921 0.068830 Ni\n0.074579 0.162861 0.779887 Ni\n0.218546 0.430366 0.344561 Ni\n0.068567 0.584906 0.136270 O\n0.931433 0.415094 0.863731 O\n0.539735 0.563061 0.133976 F\n0.095656 0.705778 0.436793 F\n0.460265 0.436939 0.866025 F\n0.626593 0.719354 0.438514 F\n0.771585 0.986713 0.000578 F\n0.173184 0.863510 0.727609 F\n0.323279 0.153316 0.270060 F\n0.676721 0.846684 0.729940 F\n0.826816 0.136490 0.272392 F\n0.228415 0.013287 0.999423 F\n0.373406 0.280646 0.561487 F\n0.904343 0.294222 0.563207 F\n",
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}