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{
"id": "jvasp-28681",
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"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.347755 0.000000 -0.000000\n-1.673877 2.899242 -0.000029\n-0.000000 -0.000342 36.019838\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.333349 0.666703 0.332343 Te\n0.333375 0.666753 0.226756 Te\n0.333362 0.666727 0.093342 Mo\n0.666695 0.333393 0.279582 Mo\n0.333320 0.666641 0.473474 W\n0.666622 0.333248 0.656545 W\n0.333296 0.666596 0.703003 Se\n0.666646 0.333293 0.426947 Se\n0.666665 0.333332 0.519977 Se\n0.333274 0.666551 0.610039 Se\n0.666678 0.333357 0.051246 S\n0.666702 0.333405 0.135495 S\n",
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{
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"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.350297 -0.000004 0.000004\n-1.675152 2.901435 -0.000016\n0.000042 -0.000222 36.160891\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.333334 0.666672 0.332894 Te\n0.333329 0.666659 0.227183 Te\n0.333283 0.666616 0.094571 Mo\n0.666713 0.333388 0.655117 Mo\n0.333348 0.666675 0.473184 W\n0.666666 0.333331 0.280066 W\n0.333394 0.666742 0.701134 Se\n0.666671 0.333328 0.426866 Se\n0.666691 0.333359 0.519485 Se\n0.333365 0.666699 0.609053 Se\n0.666604 0.333263 0.052659 S\n0.666620 0.333287 0.136536 S\n",
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{
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"created_at": "2022-09-04T14:37:48.694048Z",
"updated_at": "2022-09-04T14:37:48.694079Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.311721 -0.000000 0.000000\n-1.655862 2.868111 -0.000014\n0.000000 -0.000140 35.029458\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.666644 0.333285 0.039866 Te\n0.666648 0.333294 0.149085 Te\n0.333320 0.666640 0.094469 Mo\n0.666677 0.333356 0.282479 Mo\n0.333319 0.666637 0.469594 W\n0.666679 0.333359 0.656388 W\n0.666652 0.333304 0.421343 Se\n0.666655 0.333311 0.517835 Se\n0.333349 0.666698 0.326101 S\n0.333357 0.666715 0.700191 S\n0.333345 0.666689 0.238902 S\n0.333354 0.666709 0.612497 S\n",
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{
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"created_at": "2022-09-04T14:37:56.244829Z",
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"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.345227 -0.000011 -0.000017\n-1.672623 2.897048 -0.000103\n-0.000185 -0.001361 36.083224\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.666651 0.333306 0.418676 Te\n0.666719 0.333394 0.524107 Te\n0.333300 0.666621 0.095295 Mo\n0.333341 0.666682 0.471366 Mo\n0.666650 0.333309 0.277791 W\n0.666702 0.333383 0.658438 W\n0.333358 0.666699 0.324254 Se\n0.666591 0.333233 0.049137 Se\n0.666664 0.333331 0.141507 Se\n0.333288 0.666605 0.231347 Se\n0.333395 0.666750 0.700676 S\n0.333348 0.666696 0.616153 S\n",
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{
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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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"created_at": "2022-09-04T14:37:55.455150Z",
"updated_at": "2022-09-04T14:37:55.455176Z",
"structure_string": "Ba1 Na1 Cu1 Br1 O2\n1.0\n3.974440 -0.000000 0.000000\n0.000000 3.974440 0.000000\n-0.000000 -0.000000 7.188690\nBa Na Cu Br O\n1 1 1 1 2\ndirect\n0.000000 0.000000 0.472257 Ba\n0.000000 0.000000 0.033410 Na\n0.500000 0.500000 0.210915 Cu\n0.500000 0.500000 0.755728 Br\n-0.000000 0.500000 0.231885 O\n0.500000 0.000000 0.231885 O\n",
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{
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"created_at": "2022-09-04T14:35:52.578760Z",
"updated_at": "2022-09-04T14:35:52.578779Z",
"structure_string": "Si4 B4 H4 C12 N4 Cl8\n1.0\n8.070152 0.000000 0.487734\n0.000000 10.477005 0.000000\n1.570408 0.000000 6.140222\nSi B H C N Cl\n4 4 4 12 4 8\ndirect\n0.275278 0.838133 0.512039 Si\n0.724722 0.338133 0.987960 Si\n0.724722 0.161867 0.487960 Si\n0.275278 0.661867 0.012039 Si\n0.898857 0.936017 0.598825 B\n0.101144 0.436017 0.901174 B\n0.101143 0.063984 0.401174 B\n0.898857 0.563984 0.098825 B\n0.105691 0.503077 0.225302 H\n0.894309 0.003076 0.274698 H\n0.105691 -0.003076 0.725301 H\n0.894309 0.496924 0.774697 H\n0.440032 0.637147 0.224083 C\n0.313240 0.726150 0.271912 C\n0.686760 0.226149 0.228087 C\n0.686760 0.273851 0.728087 C\n0.313240 -0.226149 0.771912 C\n0.559968 0.137146 0.275917 C\n0.559968 0.362854 0.775916 C\n0.440032 -0.137146 0.724082 C\n0.457909 0.554517 0.037802 C\n0.542091 0.054517 0.462197 C\n0.542091 0.445483 0.962197 C\n0.457910 -0.054517 0.537802 C\n0.902711 0.045345 0.418039 N\n0.097289 0.545345 0.081961 N\n0.097289 -0.045345 0.581960 N\n0.902711 0.454656 0.918038 N\n0.148256 0.219630 0.488932 Cl\n0.756076 0.988058 0.871540 Cl\n0.243924 0.488057 0.628459 Cl\n0.243924 0.011943 0.128459 Cl\n0.756076 0.511943 0.371540 Cl\n-0.148256 0.780370 0.511068 Cl\n0.148256 0.280370 0.988932 Cl\n-0.148256 0.719630 0.011068 Cl\n",
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