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{
"id": "jvasp-3021",
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{
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{
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"updated_at": "2022-09-04T14:37:06.770292Z",
"structure_string": "Li4 Cu2 P2 O8\n1.0\n3.637737 3.818734 0.008012\n-3.637737 3.818734 -0.008012\n0.044606 0.000000 6.176060\nLi Cu P O\n4 2 2 8\ndirect\n0.314723 0.685276 0.750843 Li\n0.178129 0.178128 0.500000 Li\n0.821871 0.821870 0.500000 Li\n0.685276 0.314723 0.249157 Li\n0.183493 0.183493 -0.000000 Cu\n0.816506 0.816506 -0.000000 Cu\n0.327241 0.672758 0.261435 P\n0.672758 0.327241 0.738565 P\n0.217104 0.782895 0.045991 O\n0.196743 0.803256 0.461272 O\n0.619214 0.705747 0.267135 O\n0.294252 0.380785 0.267135 O\n0.380785 0.294252 0.732865 O\n0.705747 0.619214 0.732865 O\n0.803257 0.196742 0.538728 O\n0.782895 0.217104 0.954009 O\n",
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{
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"created_at": "2022-09-04T14:36:53.710300Z",
"updated_at": "2022-09-04T14:36:53.710320Z",
"structure_string": "Rb3 Sc1 Br6\n1.0\n7.093460 -0.000000 4.095411\n2.364487 6.687779 4.095411\n-0.000000 -0.000000 8.190823\nRb Sc Br\n3 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sc\n0.772313 0.227687 0.227686 Br\n0.227687 0.227687 0.772313 Br\n0.227687 0.772313 0.772313 Br\n0.227687 0.772313 0.227686 Br\n0.772313 0.227687 0.772313 Br\n0.772314 0.772313 0.227686 Br\n",
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{
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"created_at": "2022-09-04T14:37:05.395036Z",
"updated_at": "2022-09-04T14:37:05.395062Z",
"structure_string": "Tc4 S4 O24 F4\n1.0\n6.841974 0.000000 -0.925321\n0.000000 7.986451 0.000000\n-0.044181 0.000000 8.933835\nTc S O F\n4 4 24 4\ndirect\n0.736285 0.344509 0.158067 Tc\n0.736285 0.155491 0.658067 Tc\n0.263714 0.655491 0.841932 Tc\n0.263714 0.844509 0.341933 Tc\n0.903858 0.767120 0.563244 S\n0.096141 0.232879 0.436756 S\n0.903858 0.732879 0.063244 S\n0.096142 0.267121 0.936756 S\n0.752431 0.134572 0.172260 O\n0.162090 0.114130 0.331580 O\n0.563088 0.399472 0.264018 O\n0.036075 0.341003 0.071168 O\n0.964276 0.360039 0.364052 O\n0.035724 0.639961 0.635948 O\n0.436912 0.600528 0.735981 O\n0.247569 0.865427 0.827740 O\n0.837910 0.885870 0.668419 O\n0.162090 0.385870 0.831580 O\n0.837909 0.614130 0.168419 O\n0.752431 0.365427 0.672259 O\n0.637529 0.379963 0.977262 O\n0.963925 0.658997 0.928831 O\n0.362471 0.879963 0.522737 O\n0.362471 0.620037 0.022737 O\n0.436912 0.899472 0.235981 O\n0.963925 0.841003 0.428832 O\n0.964276 0.139961 0.864051 O\n0.036075 0.158997 0.571168 O\n0.637529 0.120037 0.477262 O\n0.035724 0.860039 0.135948 O\n0.563088 0.100528 0.764018 O\n0.247569 0.634572 0.327740 O\n0.283763 0.334273 0.500115 F\n0.283763 0.165727 1.000115 F\n0.716237 0.665727 0.499884 F\n0.716237 0.834273 -0.000116 F\n",
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{
"id": "jvasp-30552",
"created_at": "2022-09-04T14:37:12.219570Z",
"updated_at": "2022-09-04T14:37:12.219591Z",
"structure_string": "Mg2 Co4 S10\n1.0\n3.562566 0.000037 0.000000\n0.000067 6.392597 -0.000962\n0.000006 -0.000976 13.221327\nMg Co S\n2 4 10\ndirect\n0.749994 0.908886 0.249909 Mg\n0.250009 0.091114 0.750099 Mg\n0.250000 0.471414 0.101607 Co\n0.750002 0.528587 0.898393 Co\n0.750002 0.528558 0.601612 Co\n0.249999 0.471441 0.398387 Co\n0.750000 0.361455 0.749990 S\n0.250002 0.638547 0.250010 S\n0.749994 0.655389 0.053410 S\n0.250008 0.344613 0.946589 S\n0.749993 0.655385 0.446631 S\n0.250007 0.344615 0.553369 S\n0.249984 0.163784 0.331853 S\n0.750018 0.836218 0.668145 S\n0.750018 0.836228 0.831893 S\n0.249986 0.163772 0.168105 S\n",
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{
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"created_at": "2022-09-04T14:38:48.919918Z",
"updated_at": "2022-09-04T14:38:48.919953Z",
"structure_string": "S1 F1\n1.0\n2.656765 -0.000000 0.000000\n-0.000000 3.092957 -0.000000\n-0.000000 -0.000000 3.092957\nS F\n1 1\ndirect\n0.005038 0.000000 -0.000000 S\n0.504963 0.500001 0.500001 F\n",
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{
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"created_at": "2022-09-04T14:38:51.154594Z",
"updated_at": "2022-09-04T14:38:51.154617Z",
"structure_string": "K1 Cu2 S2 O10\n1.0\n4.891670 -0.031815 2.122152\n1.235407 4.733203 2.122152\n-0.194533 -0.149267 8.241651\nK Cu S O\n1 2 2 10\ndirect\n0.500001 0.500000 0.500000 K\n0.000000 0.500000 -0.000000 Cu\n0.500000 0.000001 -0.000000 Cu\n0.062770 0.062769 0.724447 S\n0.937231 0.937231 0.275553 S\n0.162739 0.162738 0.826433 O\n0.837262 0.837262 0.173566 O\n0.166655 0.166654 0.528014 O\n0.833346 0.833346 0.471985 O\n0.742979 0.157389 0.773091 O\n0.157390 0.742978 0.773091 O\n0.257022 0.842610 0.226909 O\n0.842611 0.257022 0.226909 O\n0.338761 0.338761 0.043159 O\n0.661240 0.661239 0.956840 O\n",
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"structure_string": "Sr4 Al6 Mo1 O16\n1.0\n7.740985 0.003553 -2.817165\n-3.794571 6.747154 -2.817165\n-0.002077 -0.003553 8.237673\nSr Al Mo O\n4 6 1 16\ndirect\n0.491622 0.991622 0.983244 Sr\n0.008377 0.991622 0.499999 Sr\n0.008377 0.508377 0.016754 Sr\n0.491622 0.508377 0.499999 Sr\n0.747593 0.495715 0.251876 Al\n0.250000 0.750000 0.499999 Al\n0.504284 0.756161 0.251876 Al\n0.749999 0.250000 0.499999 Al\n0.504284 0.252406 0.748122 Al\n0.243838 0.495716 0.748122 Al\n0.000000 0.000000 0.000000 Mo\n0.338003 0.661996 -0.000001 O\n0.045364 0.891842 0.153519 O\n0.108157 0.954636 0.846479 O\n0.338003 0.338004 0.676006 O\n0.668064 0.333301 0.334762 O\n0.348790 0.695007 0.346215 O\n0.997424 0.651209 0.346214 O\n0.661996 0.338003 -0.000001 O\n0.661996 0.661996 0.323991 O\n0.998538 0.333301 0.665235 O\n0.348790 0.002575 0.653783 O\n0.108157 0.261677 0.153520 O\n0.304992 0.651209 0.653783 O\n0.666698 0.001461 0.334762 O\n0.666698 0.331935 0.665236 O\n0.738322 0.891842 0.846478 O\n",
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"structure_string": "Rb4 Ga12 S20\n1.0\n7.185208 0.027608 0.000000\n-2.152187 9.884328 0.000000\n0.000000 0.000000 12.743839\nRb Ga S\n4 12 20\ndirect\n0.161608 0.408120 0.608301 Rb\n0.838392 0.091880 0.108301 Rb\n0.838392 0.591880 0.391699 Rb\n0.161608 0.908120 0.891699 Rb\n0.714633 0.376228 0.833218 Ga\n0.285367 0.623773 0.166783 Ga\n0.557575 0.701559 0.899228 Ga\n0.796765 0.600364 0.084046 Ga\n0.557576 0.201559 0.600772 Ga\n0.714633 0.876228 0.666783 Ga\n0.442425 0.298442 0.100772 Ga\n0.442424 0.798442 0.399228 Ga\n0.796765 0.100364 0.415954 Ga\n0.203235 0.899636 0.584046 Ga\n0.203235 0.399636 0.915954 Ga\n0.285367 0.123773 0.333218 Ga\n0.058066 0.247248 0.358678 S\n0.345163 0.585353 0.338939 S\n0.654837 0.914647 0.838939 S\n0.058066 0.747248 0.141322 S\n0.941934 0.252752 0.858678 S\n0.435988 0.262728 0.916854 S\n0.564012 0.737272 0.083146 S\n0.719453 0.403817 0.170771 S\n0.941934 0.752752 0.641322 S\n0.185779 0.406677 0.099980 S\n0.814221 0.093323 0.599980 S\n0.435988 0.762728 0.583146 S\n0.654837 0.414647 0.661061 S\n0.719453 0.903818 0.329229 S\n0.185779 0.906677 0.400020 S\n0.280547 0.096183 0.670771 S\n0.564012 0.237272 0.416854 S\n0.280547 0.596183 0.829229 S\n0.814221 0.593323 0.900020 S\n0.345163 0.085353 0.161061 S\n",
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{
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"created_at": "2022-09-04T14:37:14.084745Z",
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"structure_string": "Mg2 Co4 S10\n1.0\n0.000000 6.392487 -0.001399\n3.563080 0.000000 0.000000\n0.000000 0.000910 -13.221185\nMg Co S\n2 4 10\ndirect\n0.091099 0.500000 0.249886 Mg\n0.908901 0.000000 0.750117 Mg\n0.528580 0.000000 0.101609 Co\n0.471423 0.500000 0.898391 Co\n0.471460 0.500000 0.601617 Co\n0.528538 0.000000 0.398385 Co\n0.638575 0.500000 0.749986 S\n0.361425 0.000000 0.250013 S\n0.344650 0.500000 0.053425 S\n0.655354 0.000000 0.946575 S\n0.344648 0.500000 0.446630 S\n0.655349 0.000000 0.553369 S\n0.836215 0.000000 0.331852 S\n0.163786 0.500000 0.668149 S\n0.163764 0.500000 0.831911 S\n0.836236 0.000000 0.168090 S\n",
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}