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{
"id": "jvasp-54565",
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{
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"structure_string": "Sb4 O4 F12\n1.0\n8.528462 0.000000 -0.000000\n-0.000000 8.528462 -0.000000\n0.000000 0.000000 3.761222\nSb O F\n4 4 12\ndirect\n0.642424 0.142424 0.749952 Sb\n0.142424 0.357576 0.250047 Sb\n0.857576 0.642424 0.250047 Sb\n0.357576 0.857576 0.749952 Sb\n0.618309 0.118309 0.249953 O\n0.118309 0.381691 0.750047 O\n0.881691 0.618309 0.750047 O\n0.381691 0.881691 0.249953 O\n0.876748 0.862800 0.250090 F\n0.376748 0.637200 0.749910 F\n0.637200 0.623252 0.250090 F\n0.102682 0.602682 0.250022 F\n0.897318 0.397318 0.250022 F\n0.862800 0.123252 0.749910 F\n0.623252 0.362800 0.749910 F\n0.123252 0.137200 0.250090 F\n0.137200 0.876748 0.749910 F\n0.397318 0.102682 0.749978 F\n0.362800 0.376748 0.250090 F\n0.602682 0.897318 0.749978 F\n",
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{
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{
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{
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"structure_string": "Li2 Fe2 P4 H2 O16\n1.0\n0.000000 4.757690 0.011371\n7.998810 0.000000 0.000000\n0.000000 -1.858020 -7.194030\nLi Fe P H O\n2 2 4 2 16\ndirect\n0.856562 0.625515 0.396615 Li\n0.143438 0.125515 0.603385 Li\n0.252087 0.499274 0.764451 Fe\n0.747913 -0.000726 0.235549 Fe\n0.879446 0.648576 0.011504 P\n0.120554 0.148576 0.988496 P\n0.377080 0.847442 0.501151 P\n0.622920 0.347442 0.498849 P\n0.717134 0.985804 0.736695 H\n0.282866 0.485804 0.263305 H\n0.607330 0.827859 0.385193 O\n0.499652 0.446619 0.316210 O\n0.378887 0.048154 0.113312 O\n0.209759 0.325514 0.948400 O\n0.500348 0.946619 0.683790 O\n0.392670 0.327859 0.614807 O\n0.106333 0.665080 0.890561 O\n0.893667 0.165080 0.109439 O\n0.263891 0.677961 0.542395 O\n0.124676 0.963327 0.396479 O\n0.000278 0.553620 0.190830 O\n0.736109 0.177961 0.457606 O\n0.790241 0.825514 0.051600 O\n0.875324 0.463327 0.603521 O\n0.999722 0.053620 0.809170 O\n0.621113 0.548154 0.886688 O\n",
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{
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"created_at": "2022-09-04T14:36:19.641284Z",
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"structure_string": "Mo2 W1 Se6\n1.0\n3.326203 0.000001 -0.000005\n-1.663101 2.880585 0.000015\n-0.000041 -0.000029 28.557660\nMo W Se\n2 1 6\ndirect\n0.333337 0.666653 0.116281 Mo\n0.666658 0.333320 0.346791 Mo\n0.333319 0.666656 0.577875 W\n0.333320 0.666638 0.405405 Se\n0.666663 0.333310 0.057732 Se\n0.666653 0.333327 0.518999 Se\n0.666662 0.333302 0.174906 Se\n0.666658 0.333332 0.636677 Se\n0.333323 0.666651 0.288177 Se\n",
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{
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"structure_string": "Rb2 Li1 Tb1 Cl6\n1.0\n6.311053 -0.000000 3.643688\n2.103684 5.950118 3.643688\n-0.000000 -0.000000 7.287377\nTb Rb Li Cl\n1 2 1 6\ndirect\n0.000000 0.000000 0.000000 Tb\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500001 Li\n0.744948 0.255051 0.255052 Cl\n0.255051 0.255051 0.744950 Cl\n0.255050 0.744949 0.744950 Cl\n0.255050 0.744949 0.255052 Cl\n0.744948 0.255051 0.744950 Cl\n0.744948 0.744949 0.255052 Cl\n",
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{
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"created_at": "2022-09-04T14:37:18.181490Z",
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"structure_string": "Ba1 Bi4 O8\n1.0\n3.217721 -5.573256 0.000000\n3.217721 5.573256 0.000000\n0.000000 0.000000 7.630499\nBa Bi O\n1 4 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666667 0.272534 Bi\n0.666667 0.333333 0.272534 Bi\n0.333333 0.666667 0.727466 Bi\n0.666667 0.333333 0.727466 Bi\n0.681102 0.681102 0.263838 O\n-0.000000 0.318898 0.263838 O\n0.318898 -0.000000 0.263838 O\n0.318898 0.318898 0.736162 O\n0.681102 -0.000000 0.736162 O\n-0.000000 0.681102 0.736162 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n",
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{
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"structure_string": "Ba2 Er2 Cu2 S6\n1.0\n3.999366 0.000000 0.000000\n-1.999684 6.753793 0.000000\n-0.000000 -0.000000 10.132289\nBa Er Cu S\n2 2 2 6\ndirect\n0.744196 0.488390 0.250000 Ba\n0.255806 0.511609 0.750000 Ba\n0.000000 0.000000 0.500000 Er\n0.000000 0.000000 0.000000 Er\n0.532970 0.065939 0.750000 Cu\n0.467032 0.934060 0.250000 Cu\n0.934333 0.868661 0.750000 S\n0.065669 0.131338 0.250000 S\n0.631732 0.263463 0.559492 S\n0.631732 0.263463 0.940509 S\n0.368270 0.736537 0.059492 S\n0.368270 0.736537 0.440508 S\n",
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{
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"structure_string": "Na8 Pt4 O12\n1.0\n5.436618 0.065244 -1.014294\n-2.094061 5.017544 -1.014400\n-0.024809 -0.037936 9.999800\nNa Pt O\n8 4 12\ndirect\n0.619424 0.869419 0.738838 Na\n0.295510 0.545507 0.091015 Na\n0.380576 0.130579 0.261161 Na\n0.869421 0.619421 0.238839 Na\n0.545505 0.295508 0.591015 Na\n0.704489 0.454491 0.908985 Na\n0.130579 0.380577 0.761161 Na\n0.454494 0.704489 0.408985 Na\n0.791414 0.041415 0.082831 Pt\n0.208586 0.958582 0.917169 Pt\n0.958582 0.208582 0.417170 Pt\n0.041417 0.791416 0.582830 Pt\n0.914592 0.664587 0.750000 O\n0.085407 0.335411 0.250000 O\n0.532674 0.243136 0.071175 O\n0.038494 0.828036 0.071172 O\n0.756865 0.467325 0.428828 O\n0.961505 0.171961 0.928828 O\n0.171963 0.961502 0.428825 O\n0.467326 0.756862 0.928826 O\n0.335415 0.085411 0.750000 O\n0.243134 0.532673 0.571172 O\n0.828037 0.038495 0.571175 O\n0.664584 0.914587 0.250000 O\n",
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}