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{
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{
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"updated_at": "2022-09-04T14:38:35.921429Z",
"structure_string": "Nb1 W11 Se24\n1.0\n0.336788 5.784147 0.000000\n0.000000 0.000000 -13.131049\n-10.019936 0.583428 0.000000\nNb W Se\n1 11 24\ndirect\n0.664538 0.250000 0.000020 Nb\n0.833455 0.750000 0.499980 W\n0.668629 0.250000 0.664948 W\n0.833458 0.750000 0.833356 W\n0.164434 0.250000 0.831477 W\n0.333506 0.750000 0.999980 W\n0.164434 0.250000 0.168564 W\n0.333379 0.750000 0.333315 W\n0.168273 0.250000 0.500021 W\n0.333379 0.750000 0.666645 W\n0.668629 0.250000 0.335093 W\n0.833458 0.750000 0.166604 W\n0.324266 0.121700 0.000020 Se\n0.335238 0.377291 0.666268 Se\n0.166796 0.877572 0.499980 Se\n0.166796 0.622428 0.499980 Se\n0.335238 0.122709 0.666268 Se\n0.335238 0.377291 0.333773 Se\n0.166778 0.877566 0.166628 Se\n0.166778 0.622434 0.166628 Se\n0.335238 0.122709 0.333773 Se\n0.324266 0.378300 0.000020 Se\n0.834607 0.121198 0.170383 Se\n0.666767 0.622346 0.999980 Se\n0.666767 0.877654 0.999980 Se\n0.834607 0.378802 0.170383 Se\n0.835572 0.122171 0.500020 Se\n0.666787 0.622474 0.333291 Se\n0.666787 0.877527 0.333291 Se\n0.166778 0.877566 0.833331 Se\n0.834607 0.121198 0.829658 Se\n0.666788 0.622474 0.666668 Se\n0.666788 0.877527 0.666668 Se\n0.834607 0.378802 0.829658 Se\n0.166778 0.622434 0.833331 Se\n0.835572 0.377829 0.500021 Se\n",
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{
"id": "jvasp-21050",
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"updated_at": "2022-09-04T14:38:34.974675Z",
"structure_string": "Sr8 B8 O20\n1.0\n0.000000 7.767284 0.085702\n5.372750 0.000000 0.000000\n0.000000 -0.555701 -11.896733\nSr B O\n8 8 20\ndirect\n0.118593 0.953859 0.868033 Sr\n0.881407 0.453859 0.631967 Sr\n0.881407 0.046141 0.131967 Sr\n0.118593 0.546141 0.368033 Sr\n0.624100 0.910864 0.839622 Sr\n0.375900 0.410864 0.660378 Sr\n0.375900 0.089136 0.160378 Sr\n0.624100 0.589136 0.339622 Sr\n0.659330 0.930555 0.594605 B\n0.340669 0.430555 0.905395 B\n0.340669 0.069445 0.405395 B\n0.659330 0.569445 0.094605 B\n0.159575 0.546060 0.084140 B\n0.159575 0.953940 0.584140 B\n0.840424 0.453940 0.915860 B\n0.840424 0.046060 0.415860 B\n0.097574 0.095430 0.668374 O\n0.252202 0.397471 0.006186 O\n0.747798 0.897471 0.493814 O\n0.854397 0.202046 0.927587 O\n0.145603 0.702046 0.572413 O\n0.145603 0.797954 0.072413 O\n0.854397 0.297954 0.427587 O\n0.902425 0.595430 0.831626 O\n0.097574 0.404570 0.168374 O\n0.643219 0.347006 0.146946 O\n0.605488 0.713055 0.640763 O\n0.394512 0.213055 0.859237 O\n0.394512 0.286945 0.359237 O\n0.605488 0.786945 0.140763 O\n0.356781 0.652994 0.853054 O\n0.643219 0.152994 0.646946 O\n0.252202 0.102529 0.506186 O\n0.356781 0.847006 0.353054 O\n0.902425 0.904570 0.331626 O\n0.747798 0.602529 0.993814 O\n",
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{
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"created_at": "2022-09-04T14:38:36.087837Z",
"updated_at": "2022-09-04T14:38:36.087854Z",
"structure_string": "Tb8 Ti12 Si16\n1.0\n7.087031 0.000000 0.000000\n-0.000000 7.087031 0.000000\n-0.000000 0.000000 13.019942\nTb Ti Si\n8 12 16\ndirect\n0.339840 0.002125 0.466951 Tb\n0.497875 0.839840 0.716951 Tb\n0.502125 0.160159 0.216951 Tb\n0.839840 0.497875 0.283049 Tb\n0.160159 0.502125 0.783049 Tb\n0.660159 0.997875 0.966951 Tb\n0.002125 0.339840 0.533049 Tb\n0.997875 0.660159 0.033049 Tb\n0.992092 0.846259 0.623628 Ti\n0.007908 0.153741 0.123628 Ti\n0.346259 0.507908 0.373628 Ti\n0.653741 0.492092 0.873628 Ti\n0.507908 0.346259 0.626372 Ti\n0.846259 0.992092 0.376372 Ti\n0.153741 0.007908 0.876372 Ti\n0.672301 0.672301 0.500000 Ti\n0.827699 0.172301 0.750000 Ti\n0.172301 0.827699 0.250000 Ti\n0.327699 0.327699 0.000000 Ti\n0.492092 0.653741 0.126372 Ti\n0.709614 0.045230 0.565112 Si\n0.209614 0.454770 0.184888 Si\n0.790386 0.545230 0.684888 Si\n0.454770 0.209614 0.815112 Si\n0.545230 0.790386 0.315112 Si\n0.290386 0.954770 0.065112 Si\n0.870821 0.798234 0.815851 Si\n0.298234 0.629178 0.565851 Si\n0.798234 0.870821 0.184149 Si\n0.701766 0.370821 0.065851 Si\n0.629178 0.298234 0.434149 Si\n0.370821 0.701766 0.934149 Si\n0.201766 0.129179 0.684149 Si\n0.954770 0.290386 0.934887 Si\n0.129179 0.201766 0.315851 Si\n0.045230 0.709614 0.434888 Si\n",
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{
"id": "jvasp-112011",
"created_at": "2022-09-04T14:38:42.892285Z",
"updated_at": "2022-09-04T14:38:42.892309Z",
"structure_string": "Ti1 H20 C11 O4\n1.0\n4.777061 -0.167630 0.362164\n0.082657 6.972412 1.591519\n-0.233627 -0.546211 9.121700\nTi H C O\n1 20 11 4\ndirect\n0.028891 0.113594 0.112420 Ti\n0.862077 0.585591 0.517746 H\n0.036597 0.805426 0.322614 H\n0.084515 0.017480 0.401663 H\n0.093448 0.393087 -0.105184 H\n0.032145 0.187618 0.810657 H\n0.774309 0.431655 0.684962 H\n0.378061 0.913458 0.316096 H\n0.385527 0.288704 0.559468 H\n0.725427 0.260508 0.481989 H\n0.379307 0.241135 -0.139426 H\n0.250638 0.494243 0.342211 H\n0.439613 0.923812 0.705278 H\n0.723880 0.907836 0.577580 H\n0.340759 0.701651 0.534411 H\n0.330359 0.578883 0.717568 H\n0.495770 0.600682 0.946227 H\n0.816611 0.641233 0.028910 H\n0.953181 0.675608 0.774832 H\n0.930631 0.907462 0.811167 H\n0.593643 0.593670 0.306425 H\n0.658183 0.706650 0.954683 C\n0.804028 0.782429 0.801205 C\n0.471942 0.652910 0.627963 C\n0.604951 0.828304 0.674765 C\n0.473431 0.460539 0.341551 C\n0.530984 0.866593 0.022641 C\n0.685206 0.509779 0.584709 C\n0.538462 0.336503 0.226418 C\n0.153751 0.940377 0.311379 C\n0.155656 0.245381 -0.108484 C\n0.564859 0.366162 0.496660 C\n0.798643 0.299583 0.202971 O\n0.706005 -0.019707 0.070611 O\n0.272462 -0.108463 0.029709 O\n0.348493 0.274598 0.157005 O\n",
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{
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"structure_string": "H18 C16 N2\n1.0\n5.260260 -0.023842 -1.056874\n-1.461076 6.735197 -1.960450\n-0.355180 -0.035289 8.934371\nH C N\n18 16 2\ndirect\n0.582699 0.359713 0.261419 H\n0.727836 0.069615 0.118191 H\n0.314316 0.538746 0.644874 H\n0.314356 0.538729 0.144871 H\n0.452554 0.244772 0.001855 H\n0.452565 0.244803 0.501881 H\n0.820832 0.799957 0.263557 H\n0.820738 0.799961 0.763506 H\n0.374013 0.943779 0.789782 H\n0.727791 0.069638 0.618197 H\n0.641204 0.607781 0.005185 H\n0.641149 0.607745 0.505147 H\n0.180560 0.937683 0.597817 H\n0.180646 0.937685 0.097850 H\n0.071342 0.668132 0.279110 H\n0.071248 0.668137 0.779097 H\n0.582705 0.359752 0.761447 H\n0.374077 0.943807 0.289829 H\n0.856659 0.171488 0.734735 C\n0.856686 0.171473 0.234731 C\n0.774984 0.335103 0.813588 C\n0.774982 0.335079 0.313572 C\n0.973274 0.754315 0.708193 C\n0.973351 0.754320 0.208225 C\n0.100182 0.132623 0.802008 C\n0.100216 0.132628 0.302019 C\n0.260899 0.269659 0.448577 C\n0.934366 0.469811 0.464703 C\n0.260890 0.269642 0.948563 C\n0.184377 0.437944 0.028777 C\n0.184356 0.437952 0.528777 C\n0.174317 0.943905 0.721480 C\n0.174382 0.943917 0.221511 C\n0.934392 0.469822 0.964718 C\n0.839898 0.626248 0.042483 N\n0.839846 0.626229 0.542452 N\n",
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"updated_at": "2022-09-04T14:36:49.201277Z",
"structure_string": "Ca16 C4 N16\n1.0\n3.554153 -0.000000 0.000000\n0.000000 11.433818 0.000000\n0.000000 0.000000 13.849219\nCa C N\n16 4 16\ndirect\n0.250000 0.139738 0.239935 Ca\n0.749999 0.386647 0.327897 Ca\n0.250000 0.613353 0.672103 Ca\n0.749999 0.886647 0.172103 Ca\n0.250000 0.113353 0.827897 Ca\n0.749999 0.620675 0.460372 Ca\n0.250000 0.379325 0.539628 Ca\n0.749999 0.120675 0.039628 Ca\n0.250000 0.879325 0.960372 Ca\n0.749999 0.123552 0.615577 Ca\n0.250000 0.876448 0.384423 Ca\n0.749999 0.623552 0.884423 Ca\n0.250000 0.376448 0.115577 Ca\n0.749999 0.360262 0.739935 Ca\n0.250000 0.639738 0.260065 Ca\n0.749999 0.860262 0.760065 Ca\n0.749999 0.139467 0.412836 C\n0.250000 0.860533 0.587164 C\n0.749999 0.639467 0.087164 C\n0.250000 0.360533 0.912836 C\n0.250000 0.233819 0.684567 N\n0.749999 0.766181 0.315433 N\n0.749999 0.499644 0.616636 N\n0.250000 0.500356 0.383364 N\n0.749999 -0.000356 0.883364 N\n0.250000 0.000356 0.116636 N\n0.749999 0.266181 0.184567 N\n0.749999 0.233138 0.457861 N\n0.749999 0.733138 0.042139 N\n0.250000 0.266862 0.957861 N\n0.749999 0.045034 0.368398 N\n0.250000 0.954966 0.631602 N\n0.749999 0.545034 0.131602 N\n0.250000 0.454966 0.868398 N\n0.250000 0.766862 0.542139 N\n0.250000 0.733819 0.815433 N\n",
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{
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"created_at": "2022-09-04T14:36:48.212932Z",
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"structure_string": "Na20 Sn4 As12\n1.0\n0.000000 8.587215 -0.004956\n7.629628 0.000000 0.000000\n0.000000 -8.463847 -13.656540\nNa Sn As\n20 4 12\ndirect\n0.992739 0.159992 0.417440 Na\n0.747668 0.975193 0.913863 Na\n0.007261 0.659992 0.082560 Na\n0.007260 0.840008 0.582560 Na\n0.685530 0.640832 0.756312 Na\n0.314469 0.140832 0.743689 Na\n0.314469 0.359168 0.243689 Na\n0.685530 0.859169 0.256312 Na\n0.252331 0.475193 0.586138 Na\n0.252331 0.024807 0.086138 Na\n0.992739 0.340008 0.917440 Na\n0.590089 0.460856 0.911278 Na\n0.409910 0.960857 0.588723 Na\n0.409910 0.539144 0.088723 Na\n0.590090 0.039144 0.411278 Na\n0.907415 0.003883 0.741478 Na\n0.092584 0.503883 0.758522 Na\n0.747668 0.524808 0.413863 Na\n0.092584 0.996118 0.258522 Na\n0.907415 0.496117 0.241478 Na\n0.662139 0.147890 0.090857 Sn\n0.337861 0.647890 0.409143 Sn\n0.337861 0.852111 0.909143 Sn\n0.662139 0.352111 0.590857 Sn\n0.637266 0.248647 0.240541 As\n0.362734 0.751354 0.759460 As\n0.669947 0.709837 0.571609 As\n0.330052 0.209837 0.928392 As\n0.330052 0.290163 0.428392 As\n0.669947 0.790163 0.071609 As\n0.056796 0.769373 0.416617 As\n0.943203 0.269373 0.083383 As\n0.943203 0.230627 0.583383 As\n0.056796 0.730627 0.916617 As\n0.362734 0.748647 0.259460 As\n0.637266 0.251353 0.740541 As\n",
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{
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