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{
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"created_at": "2022-09-04T14:35:40.762844Z",
"updated_at": "2022-09-04T14:35:40.762869Z",
"structure_string": "Te2 S8 N8 Cl8\n1.0\n7.035868 0.027496 1.088873\n1.245859 8.719087 0.788060\n0.033325 0.015588 8.842756\nTe S N Cl\n2 8 8 8\ndirect\n0.577211 0.697552 0.949123 Te\n0.077211 0.949123 0.697552 Te\n0.029056 0.496339 0.963394 S\n0.882194 0.242908 0.170299 S\n0.910734 0.707540 0.186669 S\n0.410734 0.186670 0.707540 S\n0.382194 0.170299 0.242907 S\n0.261222 0.411860 0.467774 S\n0.761222 0.467775 0.411860 S\n0.529057 0.963394 0.496338 S\n0.009231 0.329214 0.041195 N\n0.350996 0.040427 0.626311 N\n0.351939 0.344768 0.613683 N\n0.851939 0.613684 0.344768 N\n0.245463 0.299755 0.339829 N\n0.850997 0.626311 0.040426 N\n0.509230 0.041195 0.329214 N\n0.745463 0.339830 0.299754 N\n0.308498 0.697732 0.674393 Cl\n0.172611 0.954244 0.964543 Cl\n0.928411 0.223434 0.697462 Cl\n0.808499 0.674393 0.697731 Cl\n0.049580 0.951293 0.417487 Cl\n0.428412 0.697463 0.223434 Cl\n0.549580 0.417487 0.951293 Cl\n0.672611 0.964544 0.954243 Cl\n",
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{
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"structure_string": "Te1 Pb3 Cl2 O4\n1.0\n6.869743 0.038488 0.000000\n-4.603843 5.098968 0.000000\n-0.000000 -0.000000 5.610859\nTe Pb Cl O\n1 3 2 4\ndirect\n0.071903 0.928098 0.500000 Te\n0.611506 0.388495 -0.000000 Pb\n0.389251 0.610749 0.500000 Pb\n0.895121 0.104880 -0.000000 Pb\n0.259757 0.740244 -0.000000 Cl\n0.748874 0.251127 0.500000 Cl\n0.772818 0.761024 0.266570 O\n0.772818 0.761024 0.733430 O\n0.238977 0.227183 0.266570 O\n0.238977 0.227183 0.733430 O\n",
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{
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"structure_string": "Te1 Pb3 Br2 O4\n1.0\n7.082244 0.033409 0.000000\n-4.829510 5.180263 0.000000\n0.000000 -0.000000 5.671780\nTe Pb Br O\n1 3 2 4\ndirect\n0.815349 0.184650 -0.000000 Te\n0.141854 0.858145 -0.000000 Pb\n0.645929 0.354071 0.500000 Pb\n0.353357 0.646642 0.500000 Pb\n0.492787 0.507213 -0.000000 Br\n0.002481 0.997519 0.500000 Br\n0.983555 0.479570 0.767707 O\n0.520430 0.016445 0.232293 O\n0.520430 0.016445 0.767707 O\n0.983555 0.479570 0.232293 O\n",
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{
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"created_at": "2022-09-04T14:37:16.978614Z",
"updated_at": "2022-09-04T14:37:16.978638Z",
"structure_string": "Te2 Mo3 W1 Se6\n1.0\n3.384419 -0.000002 0.000028\n-1.692211 2.930995 -0.000040\n0.000281 -0.000434 35.959869\nTe Mo W Se\n2 3 1 6\ndirect\n0.333328 0.666661 0.334178 Te\n0.333322 0.666622 0.229413 Te\n0.333384 0.666640 0.089407 Mo\n0.666659 0.333309 0.281798 Mo\n0.666639 0.333355 0.656865 Mo\n0.333315 0.666700 0.474844 W\n0.333307 0.666698 0.702820 Se\n0.666728 0.333299 0.043457 Se\n0.666652 0.333356 0.428599 Se\n0.666718 0.333315 0.135448 Se\n0.666648 0.333388 0.521063 Se\n0.333308 0.666678 0.610858 Se\n",
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{
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"created_at": "2022-09-04T14:37:43.858113Z",
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"structure_string": "Te4 Mo2 W2 Se4\n1.0\n3.440998 -0.000000 0.000002\n-1.720499 2.979994 -0.000019\n0.000019 -0.000231 36.737197\nTe Mo W Se\n4 2 2 4\ndirect\n0.666653 0.333301 0.044076 Te\n0.666651 0.333296 0.418772 Te\n0.666650 0.333299 0.145308 Te\n0.666668 0.333334 0.520046 Te\n0.333318 0.666633 0.094653 Mo\n0.333326 0.666648 0.469409 Mo\n0.666675 0.333350 0.282051 W\n0.666681 0.333368 0.656804 W\n0.333342 0.666685 0.326790 Se\n0.333352 0.666711 0.701473 Se\n0.333341 0.666682 0.237313 Se\n0.333342 0.666690 0.612054 Se\n",
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{
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"created_at": "2022-09-04T14:37:36.679793Z",
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"structure_string": "Te2 Mo1 W3 Se6\n1.0\n3.384135 0.000001 -0.000000\n-1.692066 2.930735 -0.000001\n0.000002 -0.000016 38.419895\nTe Mo W Se\n2 1 3 6\ndirect\n0.666644 0.333290 0.420459 Te\n0.666643 0.333288 0.518853 Te\n0.666687 0.333378 0.281776 Mo\n0.333310 0.666621 0.093928 W\n0.333308 0.666618 0.469651 W\n0.666686 0.333377 0.657548 W\n0.333351 0.666705 0.324825 Se\n0.333355 0.666714 0.700649 Se\n0.666643 0.333287 0.050822 Se\n0.666643 0.333287 0.137143 Se\n0.333354 0.666712 0.238754 Se\n0.333350 0.666705 0.614338 Se\n",
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"formula_full": "Te2 Mo1 W3 Se6",
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{
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"created_at": "2022-09-04T14:37:40.985995Z",
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"structure_string": "Te2 Mo2 W2 Se6\n1.0\n3.386359 -0.000000 0.000000\n-1.693180 2.932680 -0.000012\n0.000000 -0.000151 36.190690\nTe Mo W Se\n2 2 2 6\ndirect\n0.666659 0.333316 0.416801 Te\n0.666666 0.333331 0.521421 Te\n0.333333 0.666665 0.096399 Mo\n0.666698 0.333395 0.660225 Mo\n0.333328 0.666656 0.469110 W\n0.666645 0.333289 0.277185 W\n0.333311 0.666622 0.323115 Se\n0.333380 0.666759 0.705864 Se\n0.666679 0.333357 0.050754 Se\n0.666653 0.333305 0.142097 Se\n0.333304 0.666611 0.231280 Se\n0.333348 0.666697 0.614497 Se\n",
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"structure_string": "Te4 Mo2 W1 Se2\n1.0\n3.485355 -0.000000 0.000000\n-1.742678 3.013983 -0.000000\n0.000000 -0.000000 25.726147\nTe Mo W Se\n4 2 1 2\ndirect\n0.672559 0.345118 0.011105 Te\n0.671248 0.342498 0.539609 Te\n0.671248 0.342498 0.154356 Te\n0.672559 0.345118 0.682860 Te\n0.338717 0.677436 0.082685 Mo\n0.338717 0.677436 0.611281 Mo\n0.656500 0.313002 0.346982 W\n0.322521 0.645043 0.410303 Se\n0.322521 0.645043 0.283662 Se\n",
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{
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"created_at": "2022-09-04T14:35:52.777675Z",
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"structure_string": "Te4 Mo2 W2 Se4\n1.0\n3.441202 0.000043 -0.000040\n-1.720564 2.979411 0.000046\n-0.000431 0.000322 35.612423\nTe Mo W Se\n4 2 2 4\ndirect\n0.333328 0.666605 0.712767 Te\n0.666672 0.333393 0.038691 Te\n0.666653 0.333332 0.143106 Te\n0.333347 0.666666 0.608352 Te\n0.333338 0.666583 0.090853 Mo\n0.666662 0.333415 0.660605 Mo\n0.333303 0.666743 0.467164 W\n0.666697 0.333255 0.284294 W\n0.333329 0.666716 0.330417 Se\n0.666671 0.333282 0.421041 Se\n0.666696 0.333378 0.513316 Se\n0.333304 0.666621 0.238142 Se\n",
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"structure_string": "Te4 Mo2 W2 Se4\n1.0\n3.444021 -0.000009 0.000033\n-1.722018 2.982620 -0.000141\n0.000357 -0.001550 36.292358\nTe Mo W Se\n4 2 2 4\ndirect\n0.333327 0.666733 0.716705 Te\n0.666650 0.333279 0.413714 Te\n0.666699 0.333424 0.516691 Te\n0.333306 0.666667 0.614286 Te\n0.333342 0.666624 0.096705 Mo\n0.666654 0.333370 0.665541 Mo\n0.333337 0.666681 0.465192 W\n0.666663 0.333316 0.275479 W\n0.333340 0.666695 0.320738 Se\n0.666668 0.333248 0.051692 Se\n0.666699 0.333355 0.141765 Se\n0.333310 0.666607 0.230241 Se\n",
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]
}