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{
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{
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{
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"updated_at": "2022-09-04T14:38:01.916622Z",
"structure_string": "Mo1 W3 Se6 S2\n1.0\n3.291775 -0.000000 0.000000\n-1.645888 2.850765 -0.000009\n0.000000 -0.000096 35.044015\nMo W Se S\n1 3 6 2\ndirect\n0.333311 0.666625 0.468779 Mo\n0.333319 0.666640 0.096508 W\n0.666678 0.333358 0.279567 W\n0.666689 0.333379 0.658066 W\n0.333336 0.666676 0.327956 Se\n0.333357 0.666717 0.706403 Se\n0.666631 0.333262 0.420672 Se\n0.666659 0.333319 0.516885 Se\n0.333352 0.666707 0.231189 Se\n0.333353 0.666708 0.609666 Se\n0.666652 0.333305 0.052527 S\n0.666653 0.333308 0.140529 S\n",
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{
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"structure_string": "Li4 Cr3 Fe1 O8\n1.0\n0.000000 5.023406 0.000136\n5.800410 0.000000 0.000000\n0.000000 -1.675326 -4.754220\nLi Cr Fe O\n4 3 1 8\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.754514 -0.000000 Li\n0.500000 0.245486 -0.000000 Li\n-0.000000 0.752779 0.500000 Cr\n-0.000000 0.247221 0.500000 Cr\n0.500000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Fe\n0.755044 0.000000 0.272816 O\n0.758272 0.500000 0.272905 O\n0.740719 0.752560 0.726217 O\n0.259280 0.752560 0.273783 O\n0.740719 0.247440 0.726217 O\n0.244956 0.000000 0.727183 O\n0.259280 0.247440 0.273783 O\n0.241728 0.500000 0.727094 O\n",
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{
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"structure_string": "Ca6 Ti2 Ni2 O12\n1.0\n6.419142 -0.029826 -0.250770\n-0.259590 6.413960 -0.250770\n-0.028776 -0.029826 6.423974\nCa Ti Ni O\n6 2 2 12\ndirect\n0.608557 0.891444 0.250000 Ca\n0.108557 0.750000 0.391444 Ca\n0.750000 0.391443 0.108557 Ca\n0.391444 0.108555 0.749999 Ca\n0.891443 0.249999 0.608555 Ca\n0.249999 0.608556 0.891442 Ca\n0.499999 0.499998 0.499999 Ti\n0.000000 0.000000 0.000000 Ti\n0.749999 0.749999 0.749999 Ni\n0.250000 0.250000 0.250000 Ni\n0.543024 0.206681 0.419495 O\n0.956975 0.080503 0.293319 O\n0.080504 0.293319 0.956975 O\n0.293319 0.956975 0.080503 O\n0.919495 0.706680 0.043024 O\n0.206681 0.419495 0.543025 O\n0.456975 0.793319 0.580504 O\n0.580504 0.456975 0.793319 O\n0.793319 0.580503 0.456974 O\n0.419495 0.543024 0.206680 O\n0.043025 0.919496 0.706680 O\n0.706680 0.043023 0.919496 O\n",
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{
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"structure_string": "Nd1 Bi2 Cl1 O4\n1.0\n3.955113 0.000000 0.000000\n0.000000 3.955113 -0.000000\n0.000000 -0.000000 9.064947\nNd Bi Cl O\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.715901 Bi\n0.500000 0.500000 0.284100 Bi\n0.000000 0.000000 0.500000 Cl\n0.000000 0.500000 0.837934 O\n0.000000 0.500000 0.162067 O\n0.500000 0.000000 0.162067 O\n0.500000 0.000000 0.837934 O\n",
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{
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"updated_at": "2022-09-04T14:38:01.526268Z",
"structure_string": "Li3 Cu3 Te1 O8\n1.0\n5.861060 -0.239966 0.076359\n2.679542 5.285814 0.273650\n2.901677 1.901536 5.221327\nLi Cu Te O\n3 3 1 8\ndirect\n-0.000000 0.500000 -0.000000 Li\n0.500000 -0.000000 0.000000 Li\n-0.000000 0.000000 0.500000 Li\n0.500000 -0.000000 0.500000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.500000 0.499999 0.000000 Cu\n0.000000 0.000000 0.000000 Te\n0.249232 0.282016 0.302726 O\n0.821480 0.212617 0.730949 O\n0.248218 0.772627 0.795785 O\n0.750768 0.717983 0.697275 O\n0.767140 0.766078 0.172453 O\n0.178520 0.787382 0.269052 O\n0.751782 0.227372 0.204215 O\n0.232860 0.233921 0.827548 O\n",
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{
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"structure_string": "Sn2 H24 C12 F4\n1.0\n4.210319 -0.131787 -0.002001\n-2.111169 4.316970 -0.001730\n0.008685 0.009265 19.706980\nSn H C F\n2 24 12 4\ndirect\n0.094879 0.017716 0.526459 Sn\n0.514091 0.913513 0.026446 Sn\n0.165281 0.682063 0.910619 H\n0.481120 0.540567 0.926554 H\n0.988156 0.079062 0.891264 H\n0.665582 0.201176 0.870212 H\n0.620767 0.852205 0.391251 H\n0.443647 0.249178 0.410651 H\n0.127806 0.390662 0.426599 H\n0.213744 0.167646 0.283924 H\n0.892240 0.290821 0.305662 H\n0.716715 0.640432 0.247247 H\n0.395216 0.763618 0.268982 H\n-0.056680 0.730057 0.370201 H\n0.395227 0.763600 0.783898 H\n0.716746 0.640449 0.805639 H\n0.620803 0.852189 0.661647 H\n-0.056615 0.730079 0.682700 H\n0.127831 0.390671 0.626347 H\n0.988219 0.079056 0.161660 H\n0.443680 0.249190 0.642288 H\n0.665672 0.201214 0.182707 H\n0.165336 0.682102 0.142256 H\n0.481164 0.540600 0.126313 H\n0.892226 0.290823 0.747268 H\n0.213751 0.167679 0.769010 H\n0.935310 0.080886 0.302240 C\n0.709672 0.991925 0.873268 C\n0.161819 0.177346 0.423408 C\n0.899255 0.939320 0.373270 C\n0.447110 0.753886 0.923384 C\n0.673655 0.850374 0.250670 C\n0.709726 0.991944 0.179638 C\n0.899293 0.939332 0.679641 C\n0.935319 0.080897 0.750681 C\n0.447162 0.753921 0.129499 C\n0.161850 0.177358 0.629521 C\n0.673654 0.850374 0.802228 C\n0.081940 0.030782 0.026445 F\n0.527028 0.900453 0.526442 F\n0.830239 0.538261 0.526464 F\n0.778751 0.392977 0.026446 F\n",
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"structure_string": "Li2 Fe1 P2 S6\n1.0\n6.010929 -0.005645 0.008003\n-3.000570 5.208372 0.016294\n-0.009073 -0.025231 6.473862\nLi Fe P S\n2 1 2 6\ndirect\n0.333374 0.666699 0.499999 Li\n0.333390 0.666689 0.000000 Li\n0.666663 0.333342 0.500003 Fe\n0.999995 0.000011 0.327560 P\n0.000021 0.000003 0.672434 P\n0.986859 0.662191 0.254110 S\n0.986897 0.324698 0.745883 S\n0.675296 0.013153 0.254120 S\n0.675344 0.662172 0.745900 S\n0.337853 0.013138 0.745874 S\n0.337811 0.324704 0.254111 S\n",
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{
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"structure_string": "Nb2 Bi2 Pb1 O9\n1.0\n3.922732 0.000580 -0.591131\n-0.089575 3.921709 -0.591131\n-0.087844 -0.089887 12.727893\nNb Bi Pb O\n2 2 1 9\ndirect\n0.411775 0.411774 0.823539 Nb\n0.588224 0.588225 0.176461 Nb\n0.200654 0.200654 0.401248 Bi\n0.799345 0.799345 0.598752 Bi\n0.000000 0.000000 0.000000 Pb\n0.080280 0.580268 0.160580 O\n0.419731 0.919718 0.839419 O\n0.919719 0.419731 0.839419 O\n0.580268 0.080281 0.160580 O\n0.249998 0.750002 0.500000 O\n0.499999 0.500000 0.000000 O\n0.664765 0.664766 0.329603 O\n0.335234 0.335233 0.670397 O\n0.750002 0.249998 0.500000 O\n",
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{
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"structure_string": "Li4 Si2 Ni2 O8\n1.0\n5.145032 -0.005501 0.014010\n-0.311809 5.387909 -0.109227\n-0.007294 -0.149035 6.134405\nLi Si Ni O\n4 2 2 8\ndirect\n0.799584 0.828016 0.241386 Li\n0.312167 0.685130 0.487443 Li\n0.691003 0.319843 0.009995 Li\n0.200107 0.170488 0.756348 Li\n0.820586 0.824815 0.742331 Si\n0.179250 0.174911 0.255981 Si\n0.307023 0.662502 0.990666 Ni\n0.687456 0.332182 0.521320 Ni\n0.210371 0.870617 0.241753 O\n0.141311 0.806416 0.745560 O\n0.695012 0.684538 0.956187 O\n0.693079 0.700138 0.513697 O\n0.312786 0.304180 0.041418 O\n0.303450 0.309833 0.482379 O\n0.860018 0.202495 0.259314 O\n0.784000 0.126703 0.754223 O\n",
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