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{
"id": "jvasp-28609",
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"structure_string": "Te4 Mo2 W2 Se2 S2\n1.0\n3.410031 0.000001 0.000000\n-1.705016 2.953180 -0.000024\n-0.000001 -0.000358 37.102323\nTe Mo W Se S\n4 2 2 2 2\ndirect\n0.333330 0.666661 0.326202 Te\n0.666665 0.333331 0.421864 Te\n0.666674 0.333347 0.523396 Te\n0.333315 0.666633 0.224614 Te\n0.333318 0.666637 0.096397 Mo\n0.666687 0.333376 0.658479 Mo\n0.333335 0.666671 0.472642 W\n0.666657 0.333315 0.275435 W\n0.333356 0.666715 0.702799 Se\n0.333349 0.666700 0.614084 Se\n0.666643 0.333287 0.055985 S\n0.666661 0.333321 0.136850 S\n",
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{
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{
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"updated_at": "2022-09-04T14:37:55.071698Z",
"structure_string": "Te2 Mo1 W3 Se4 S2\n1.0\n3.353495 -0.000000 0.000000\n-1.676748 2.904204 -0.000015\n0.000000 -0.000195 37.867049\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.333355 0.666713 0.332132 Te\n0.333357 0.666715 0.231264 Te\n0.333313 0.666627 0.469734 Mo\n0.333310 0.666620 0.093942 W\n0.666687 0.333372 0.281780 W\n0.666683 0.333364 0.657518 W\n0.333353 0.666708 0.701425 Se\n0.666649 0.333296 0.425822 Se\n0.666649 0.333295 0.513675 Se\n0.333353 0.666707 0.613365 Se\n0.666642 0.333282 0.053889 S\n0.666645 0.333287 0.134201 S\n",
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{
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"structure_string": "Te2 Mo1 W3 Se4 S2\n1.0\n3.347535 0.000000 0.000000\n-1.673767 2.899051 -0.000020\n0.000000 -0.000370 35.949131\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.333336 0.666674 0.335849 Te\n0.333306 0.666615 0.229505 Te\n0.333368 0.666738 0.089095 Mo\n0.333305 0.666613 0.476945 W\n0.666656 0.333316 0.282666 W\n0.666664 0.333332 0.654184 W\n0.666692 0.333385 0.042787 Se\n0.666624 0.333250 0.430347 Se\n0.666717 0.333436 0.135481 Se\n0.666644 0.333290 0.523550 Se\n0.333341 0.666686 0.696588 S\n0.333330 0.666661 0.611751 S\n",
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"structure_string": "K6 Na2 U2 C6 O22\n1.0\n4.629361 -8.018287 0.000000\n4.629361 8.018287 -0.000000\n0.000000 -0.000000 8.242651\nK Na U C O\n6 2 2 6 22\ndirect\n0.700957 0.700957 0.000000 K\n0.700957 0.700957 0.500000 K\n-0.000000 0.299043 0.000000 K\n0.299043 -0.000000 0.500000 K\n-0.000000 0.299043 0.500000 K\n0.299043 -0.000000 0.000000 K\n0.666667 0.333333 0.750000 Na\n0.333333 0.666667 0.250000 Na\n0.666667 0.333333 0.250000 U\n0.333333 0.666667 0.750000 U\n0.990379 0.635530 0.250000 C\n0.009621 0.645152 0.750000 C\n0.354848 0.364469 0.750000 C\n0.645152 0.009621 0.250000 C\n0.635530 0.990379 0.750000 C\n0.364469 0.354848 0.250000 C\n0.233958 0.364947 0.250000 O\n0.364947 0.233958 0.750000 O\n0.635586 0.848299 0.750000 O\n0.970998 0.484544 0.250000 O\n0.666667 0.333333 0.474537 O\n0.333333 0.666667 0.974537 O\n0.364414 0.212713 0.250000 O\n0.484544 0.970998 0.750000 O\n0.787287 0.151701 0.250000 O\n0.486455 0.515456 0.750000 O\n0.333333 0.666667 0.525462 O\n0.212713 0.364414 0.750000 O\n0.130989 0.766042 0.250000 O\n0.848299 0.635586 0.250000 O\n0.029002 0.513545 0.750000 O\n0.666667 0.333333 0.025462 O\n0.151701 0.787287 0.750000 O\n0.869010 0.635053 0.750000 O\n0.766042 0.130989 0.750000 O\n0.515456 0.486455 0.250000 O\n0.513545 0.029002 0.250000 O\n0.635053 0.869010 0.250000 O\n",
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{
"id": "jvasp-45969",
"created_at": "2022-09-04T14:38:01.616308Z",
"updated_at": "2022-09-04T14:38:01.616327Z",
"structure_string": "Li6 Mg2 P2 C2 O14\n1.0\n0.000000 4.942839 0.115693\n6.378307 0.000000 0.000000\n0.000000 -0.653872 -8.335854\nLi Mg P C O\n6 2 2 2 14\ndirect\n0.208772 0.750000 0.103493 Li\n0.734817 0.982330 0.269846 Li\n0.734817 0.517671 0.269846 Li\n0.265184 0.482330 0.730154 Li\n0.265184 0.017671 0.730154 Li\n0.791229 0.250000 0.896507 Li\n0.208503 0.250000 0.335745 Mg\n0.791498 0.750000 0.664255 Mg\n0.731626 0.250000 0.588275 P\n0.268374 0.750000 0.411725 P\n0.318515 0.250000 0.040632 C\n0.681485 0.750000 0.959368 C\n0.497580 0.750000 0.835976 O\n0.835380 0.060537 0.693392 O\n0.835380 0.439464 0.693392 O\n0.414528 0.250000 0.563689 O\n0.162063 0.750000 0.577971 O\n0.837937 0.250000 0.422029 O\n0.066775 0.250000 0.068571 O\n0.164620 0.560537 0.306608 O\n0.164620 0.939464 0.306608 O\n0.502420 0.250000 0.164023 O\n0.609783 0.750000 0.104524 O\n0.390218 0.250000 0.895476 O\n0.585473 0.750000 0.436311 O\n0.933226 0.750000 0.931428 O\n",
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{
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"structure_string": "Li4 Mn2 B2 P2 O14\n1.0\n0.000000 5.030195 0.043028\n6.167006 0.000000 0.000000\n0.000000 -0.538745 -8.526293\nLi Mn B P O\n4 2 2 2 14\ndirect\n0.764927 0.483204 0.199093 Li\n0.764927 0.016796 0.199093 Li\n0.235073 0.516797 0.800906 Li\n0.235073 0.983204 0.800906 Li\n0.211104 0.250000 0.331905 Mn\n0.788896 0.750001 0.668094 Mn\n0.265860 0.250000 0.057228 B\n0.734140 0.750001 0.942772 B\n0.274368 0.750001 0.428047 P\n0.725632 0.250000 0.571953 P\n0.530474 0.750001 0.817546 O\n0.813029 0.054970 0.676081 O\n0.813029 0.445030 0.676081 O\n0.138358 0.750001 0.583987 O\n0.419823 0.250000 0.531121 O\n0.580177 0.750001 0.468878 O\n0.022422 0.250000 0.131243 O\n0.186971 0.554970 0.323918 O\n0.186971 0.945031 0.323918 O\n0.469526 0.250000 0.182454 O\n0.977578 0.750001 0.868756 O\n0.701626 0.750001 0.094123 O\n0.861642 0.250000 0.416012 O\n0.298374 0.250000 0.905876 O\n",
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{
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"structure_string": "Ba1 La1 Ti1 Cu1 O6\n1.0\n4.850076 -0.000000 2.800193\n1.616692 4.572695 2.800193\n-0.000000 -0.000000 5.600385\nBa La Ti Cu O\n1 1 1 1 6\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500001 0.500000 La\n0.250000 0.250000 0.250000 Ti\n0.750000 0.750001 0.750000 Cu\n0.003178 0.496822 0.496822 O\n0.496822 0.003179 0.003178 O\n0.003178 0.496822 0.003178 O\n0.496822 0.003179 0.496821 O\n0.496822 0.496822 0.003178 O\n0.003179 0.003179 0.496822 O\n",
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