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{
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"structure_string": "Na2 P2 H6 N2 O6\n1.0\n0.000000 5.785888 0.000058\n5.946822 0.000000 0.000000\n0.000000 -2.892915 -5.010744\nNa P H N O\n2 2 6 2 6\ndirect\n-0.000000 0.493971 0.000001 Na\n0.000000 0.993971 -0.000001 Na\n0.666668 0.805124 0.333333 P\n0.333331 0.305124 0.666666 P\n0.154525 0.668248 0.505045 H\n0.350518 0.668248 0.845472 H\n0.494953 0.668248 0.649480 H\n0.505046 0.168248 0.350519 H\n0.649481 0.168248 0.154527 H\n0.845474 0.168248 0.494953 H\n0.666667 0.106775 0.333333 N\n0.333332 0.606775 0.666666 N\n0.147885 0.245195 0.773434 O\n0.773433 0.745195 0.625546 O\n0.852114 0.745194 0.226565 O\n0.374452 0.745195 0.147886 O\n0.226566 0.245195 0.374453 O\n0.625547 0.245195 0.852113 O\n",
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{
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"structure_string": "Sr2 Mn1 Zn2 As2 O2\n1.0\n0.000000 -4.131335 0.000000\n-4.131335 0.000000 0.000000\n2.065667 2.065667 -9.389516\nSr Mn Zn As O\n2 1 2 2 2\ndirect\n0.587650 0.587650 0.175299 Sr\n0.412351 0.412351 0.824701 Sr\n0.000000 0.000000 0.000000 Mn\n0.750001 0.250000 0.500000 Zn\n0.250000 0.750001 0.500000 Zn\n0.166671 0.166671 0.333344 As\n0.833329 0.833329 0.666656 As\n0.500001 0.000000 0.000000 O\n0.000000 0.500001 0.000000 O\n",
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{
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"structure_string": "Li4 Mn3 V3 Sn2 O16\n1.0\n5.838458 -0.043435 0.029391\n-2.881680 5.150079 0.087854\n-0.049440 -0.094436 9.725242\nLi Mn V Sn O\n4 3 3 2 16\ndirect\n0.667146 0.334277 0.894449 Li\n0.000579 0.001281 0.994528 Li\n-0.002691 -0.005409 0.492682 Li\n0.331967 0.663972 0.398563 Li\n0.835117 0.670307 0.215305 Mn\n0.168880 0.829129 0.714855 Mn\n0.660296 0.829137 0.714862 Mn\n0.821484 0.171592 0.214415 V\n0.167754 0.335457 0.716748 V\n0.350035 0.171590 0.214417 V\n0.666531 0.333047 0.493356 Sn\n0.333539 0.667135 0.991604 Sn\n0.158915 0.317914 0.099290 O\n0.164371 0.845140 0.100329 O\n0.333925 0.667797 0.610532 O\n0.487136 0.519483 0.833384 O\n0.032353 0.519471 0.833375 O\n0.839901 0.679754 0.601596 O\n0.967049 0.480818 0.335395 O\n0.513448 0.026958 0.342356 O\n0.838105 0.151918 0.602455 O\n0.996482 0.992915 0.809136 O\n0.003202 0.006488 0.307108 O\n0.672111 0.344313 0.103327 O\n0.483825 0.967639 0.835573 O\n0.313847 0.151911 0.602455 O\n0.513717 0.480816 0.335402 O\n0.680680 0.845154 0.100340 O\n",
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{
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"created_at": "2022-09-04T14:37:33.529510Z",
"updated_at": "2022-09-04T14:37:33.529537Z",
"structure_string": "Te4 Mo2 W2 Se2 S2\n1.0\n3.401285 -0.000000 -0.000000\n-1.700643 2.945597 -0.000001\n-0.000000 -0.000003 36.556751\nTe Mo W Se S\n4 2 2 2 2\ndirect\n0.333336 0.666670 0.339235 Te\n0.666702 0.333401 0.036479 Te\n0.666700 0.333396 0.139141 Te\n0.333350 0.666699 0.236512 Te\n0.333367 0.666732 0.087754 Mo\n0.666676 0.333350 0.287868 Mo\n0.333270 0.666539 0.477234 W\n0.666691 0.333381 0.650025 W\n0.666595 0.333186 0.431925 Se\n0.666614 0.333224 0.522537 Se\n0.333360 0.666719 0.691279 S\n0.333357 0.666712 0.608761 S\n",
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{
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"created_at": "2022-09-04T14:37:16.770246Z",
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"structure_string": "Te2 Mo1 W2 Se2 S2\n1.0\n3.353902 0.000000 0.000000\n-1.676951 2.904567 -0.000047\n0.000000 -0.000537 29.198883\nTe Mo W Se S\n2 1 2 2 2\ndirect\n0.333392 0.666784 0.414860 Te\n0.333371 0.666742 0.284076 Te\n0.333273 0.666546 0.111236 Mo\n0.333325 0.666650 0.580237 W\n0.666713 0.333427 0.349444 W\n0.666589 0.333177 0.054296 Se\n0.666624 0.333248 0.168276 Se\n0.666654 0.333308 0.528064 S\n0.666661 0.333320 0.632351 S\n",
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{
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"structure_string": "Ca2 Zn2 Si2 H4 O10\n1.0\n2.504434 7.979290 -0.592295\n-2.504434 7.979290 0.592295\n-0.002108 0.000000 5.454666\nCa Zn Si H O\n2 2 2 4 10\ndirect\n0.783907 0.072633 0.145122 Ca\n0.927366 0.216093 0.645123 Ca\n0.755936 0.743556 0.504837 Zn\n0.256445 0.244064 0.004836 Zn\n0.654287 0.620801 0.024226 Si\n0.379199 0.345713 0.524227 Si\n0.339936 0.686571 0.398705 H\n0.313429 0.660064 0.898706 H\n0.233813 0.934189 0.222720 H\n0.065811 0.766187 0.722720 H\n0.563091 0.347821 0.448299 O\n0.188568 0.896684 0.360282 O\n0.103316 0.811432 0.860282 O\n0.043961 0.669701 0.458182 O\n0.330299 0.956039 0.958182 O\n0.849519 0.565975 0.853505 O\n0.434025 0.150481 0.353505 O\n0.793255 0.523145 0.324126 O\n0.476855 0.206745 0.824126 O\n0.652179 0.436909 0.948300 O\n",
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"structure_string": "Te4 Mo2 W2 Se2 S2\n1.0\n3.399607 -0.000000 -0.000000\n-1.699803 2.944140 -0.000001\n-0.000000 -0.000023 38.681609\nTe Mo W Se S\n4 2 2 2 2\ndirect\n0.666647 0.333291 0.045549 Te\n0.666649 0.333294 0.421190 Te\n0.666649 0.333295 0.142391 Te\n0.666647 0.333290 0.518195 Te\n0.333313 0.666624 0.093907 Mo\n0.333313 0.666625 0.469672 Mo\n0.666687 0.333372 0.281792 W\n0.666691 0.333381 0.657515 W\n0.333354 0.666705 0.324611 Se\n0.333350 0.666702 0.238975 Se\n0.333358 0.666716 0.696415 S\n0.333355 0.666711 0.618536 S\n",
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"structure_string": "Sr1 Ni2 P2 H4 O10\n1.0\n-4.481253 -3.011150 -0.006255\n4.481253 -3.011150 0.006255\n-3.037094 0.000000 6.772364\nSr Ni P H O\n1 2 2 4 10\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.000000 0.499998 Ni\n0.999999 0.500000 0.500000 Ni\n0.586399 0.413601 0.222549 P\n0.413601 0.586399 0.777451 P\n0.255280 0.744720 0.207464 H\n0.073840 0.926160 0.365868 H\n0.926160 0.073840 0.634132 H\n0.744720 0.255280 0.792535 H\n0.299338 0.700661 0.661728 O\n0.814736 0.185263 0.638991 O\n0.185263 0.814737 0.361009 O\n0.700661 0.299339 0.338272 O\n0.703526 0.296474 0.003303 O\n0.265680 0.307247 0.272658 O\n0.296474 0.703526 0.996697 O\n0.307248 0.265680 0.727342 O\n0.692752 0.734320 0.272658 O\n0.734321 0.692753 0.727342 O\n",
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{
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"created_at": "2022-09-04T14:37:27.445480Z",
"updated_at": "2022-09-04T14:37:27.445501Z",
"structure_string": "Ba2 Ca1 Cu2 Hg1 O6\n1.0\n3.894056 0.000000 0.000000\n-0.000000 3.894056 -0.000000\n0.000000 -0.000000 12.926727\nBa Ca Cu Hg O\n2 1 2 1 6\ndirect\n0.500001 0.500001 0.229060 Ba\n0.500001 0.500001 0.770941 Ba\n0.500001 0.500001 0.500000 Ca\n0.000000 0.000000 0.385604 Cu\n0.000000 0.000000 0.614397 Cu\n0.000000 0.000000 0.000000 Hg\n0.000000 0.000000 0.844625 O\n0.000000 0.000000 0.155375 O\n0.500001 0.000000 0.620824 O\n0.000000 0.500001 0.620824 O\n0.500001 0.000000 0.379176 O\n0.000000 0.500001 0.379176 O\n",
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{
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"structure_string": "Yb4 Be4 Si4 Ni2 O20\n1.0\n0.000000 4.581494 -0.050595\n7.460362 0.000000 0.000000\n0.000000 -0.001307 -10.057220\nYb Be Si Ni O\n4 4 4 2 20\ndirect\n0.996866 0.394623 0.170540 Yb\n0.003133 0.894623 0.329460 Yb\n0.003133 0.605377 0.829460 Yb\n0.996865 0.105377 0.670540 Yb\n0.447237 0.911763 0.845669 Be\n0.552761 0.088237 0.154332 Be\n0.447238 0.588237 0.345669 Be\n0.552761 0.411763 0.654332 Be\n0.514829 0.780483 0.580679 Si\n0.485169 0.280483 0.919321 Si\n0.485169 0.219517 0.419321 Si\n0.514830 0.719516 0.080679 Si\n-0.000000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.253890 0.422838 0.975016 O\n0.720240 0.196504 0.030634 O\n0.279759 0.696504 0.469366 O\n0.279758 0.803495 0.969366 O\n0.720240 0.303496 0.530634 O\n0.253891 0.077161 0.475016 O\n0.746108 0.577161 0.024984 O\n0.746108 0.922838 0.524984 O\n0.791497 0.586295 0.349862 O\n0.725065 0.604420 0.627282 O\n0.208502 0.086295 0.150139 O\n0.208501 0.413705 0.650139 O\n0.319964 0.669452 0.211622 O\n0.680034 0.169452 0.288379 O\n0.274933 0.104420 0.872719 O\n0.680034 0.330548 0.788379 O\n0.725065 0.895580 0.127282 O\n0.274934 0.395580 0.372719 O\n0.791497 0.913705 0.849862 O\n0.319964 0.830548 0.711622 O\n",
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