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{
"id": "jvasp-45891",
"created_at": "2022-09-04T14:38:07.882152Z",
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"structure_string": "Li3 Fe2 Si2 O8\n1.0\n5.003691 0.012395 0.013947\n-0.047986 5.313935 -0.003771\n0.007367 -0.064235 6.377099\nLi Fe Si O\n3 2 2 8\ndirect\n0.501893 0.176681 0.002317 Li\n0.005479 0.821332 0.501477 Li\n0.998777 0.342552 0.754176 Li\n0.005985 0.829645 0.017207 Fe\n0.501497 0.167351 0.500351 Fe\n0.009980 0.325715 0.252745 Si\n0.503419 0.678181 0.754769 Si\n0.894396 0.185685 0.035140 O\n0.333787 0.279253 0.253255 O\n0.934405 0.624263 0.254129 O\n0.891549 0.188932 0.469407 O\n0.394199 0.827575 0.547872 O\n0.836149 0.684905 0.761863 O\n0.400654 0.379838 0.746472 O\n0.385758 0.827647 0.961501 O\n",
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{
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{
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"structure_string": "Li1 Nb1 Te3 O12\n1.0\n0.000000 4.895073 0.044854\n8.552244 0.000000 0.000000\n0.000000 -0.140210 -5.276549\nLi Nb Te O\n1 1 3 12\ndirect\n0.500000 0.804042 0.500001 Li\n0.000000 0.899218 0.000000 Nb\n0.500000 0.576467 0.000000 Te\n0.500000 0.395243 0.500001 Te\n0.000000 0.086905 0.500000 Te\n0.795099 0.066715 0.799813 O\n0.293564 0.568387 0.672569 O\n0.219734 0.924591 0.679304 O\n0.249454 0.248095 0.642852 O\n0.750545 0.248095 0.357149 O\n0.706435 0.568387 0.327432 O\n0.715311 0.415214 0.820737 O\n0.204901 0.066715 0.200188 O\n0.284689 0.415214 0.179264 O\n0.267594 0.738917 0.123824 O\n0.780265 0.924591 0.320697 O\n0.732405 0.738917 0.876178 O\n",
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"formula_full": "Li1 Nb1 Te3 O12",
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{
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"created_at": "2022-09-04T14:36:16.870840Z",
"updated_at": "2022-09-04T14:36:16.870856Z",
"structure_string": "Ti1 Be1 Rh2\n1.0\n-1.768179 1.768179 4.184663\n1.768179 -1.768179 4.184663\n1.768179 1.768179 -4.184663\nTi Be Rh\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ti\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 Rh\n0.250000 0.750000 0.500000 Rh\n",
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{
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"created_at": "2022-09-04T14:36:56.966384Z",
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"structure_string": "Li4 Fe6 Te2 O16\n1.0\n2.885307 -4.997498 -0.000000\n2.885307 4.997498 0.000000\n-0.000000 -0.000000 9.828718\nLi Fe Te O\n4 6 2 16\ndirect\n0.666668 0.333333 0.087852 Li\n0.000000 0.000000 0.013601 Li\n0.000000 0.000000 0.510669 Li\n0.333333 0.666668 0.605369 Li\n0.645696 0.822849 0.282549 Fe\n0.177152 0.354305 0.282549 Fe\n0.177152 0.822849 0.282549 Fe\n0.345574 0.172787 0.785162 Fe\n0.827213 0.172787 0.785162 Fe\n0.827214 0.654427 0.785162 Fe\n0.666668 0.333333 0.509227 Te\n0.333333 0.666668 0.003145 Te\n0.153990 0.307981 0.896446 O\n0.692020 0.846011 0.896446 O\n0.333333 0.666668 0.395979 O\n0.027912 0.513956 0.147018 O\n0.486044 0.513956 0.147018 O\n0.836097 0.672195 0.404257 O\n0.513464 0.486537 0.675637 O\n0.513464 0.026927 0.675637 O\n0.327806 0.163904 0.404257 O\n0.000000 0.000000 0.203361 O\n0.000000 0.000000 0.698610 O\n0.666668 0.333333 0.891073 O\n0.486045 0.972089 0.147018 O\n0.836097 0.163904 0.404257 O\n0.973073 0.486537 0.675637 O\n0.153990 0.846011 0.896446 O\n",
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{
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"structure_string": "Ti1 Ni1 O6\n1.0\n4.417163 0.107315 3.293122\n1.711759 4.073417 3.293122\n0.157322 0.107315 5.507379\nTi Ni O\n1 1 6\ndirect\n0.855874 0.855873 0.855875 Ti\n0.656484 0.656483 0.656485 Ni\n0.023036 0.748490 0.458865 O\n0.458865 0.023034 0.748491 O\n0.748490 0.458865 0.023036 O\n0.268624 0.588512 0.892913 O\n0.588513 0.892913 0.268624 O\n0.892913 0.268622 0.588514 O\n",
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{
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"structure_string": "Ti1 Ni1 O6\n1.0\n4.417401 0.106875 3.292502\n1.711437 4.073798 3.292502\n0.156678 0.106876 5.507218\nTi Ni O\n1 1 6\ndirect\n0.855896 0.855898 0.855894 Ti\n0.656469 0.656471 0.656468 Ni\n0.023053 0.748314 0.459020 O\n0.459021 0.023054 0.748312 O\n0.748313 0.459022 0.023052 O\n0.268617 0.588577 0.892855 O\n0.588575 0.892857 0.268616 O\n0.892856 0.268619 0.588574 O\n",
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{
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"updated_at": "2022-09-04T14:36:53.298537Z",
"structure_string": "Ba3 V6 O18\n1.0\n7.666802 0.001738 0.000000\n-2.888682 7.101787 0.000000\n0.000000 0.000000 7.972262\nBa V O\n3 6 18\ndirect\n0.000000 0.000000 0.000000 Ba\n0.835980 0.164020 0.499999 Ba\n0.164020 0.835979 0.499999 Ba\n0.395395 0.250681 0.739320 V\n0.604606 0.749321 0.739320 V\n0.749321 0.604606 0.260680 V\n0.250680 0.395396 0.260680 V\n0.500000 0.000000 0.065562 V\n0.000000 0.500000 0.934437 V\n0.170244 0.162504 0.301216 O\n0.680741 0.135197 0.182975 O\n0.319260 0.864805 0.182975 O\n0.829757 0.837495 0.301216 O\n0.859976 0.595160 0.061970 O\n0.162505 0.170243 0.698784 O\n0.500000 0.500000 0.245086 O\n0.500000 0.500000 0.754913 O\n0.135196 0.680740 0.817025 O\n0.489640 0.170955 0.584522 O\n0.510360 0.829047 0.584522 O\n0.170955 0.489641 0.415478 O\n0.829045 0.510360 0.415478 O\n0.404842 0.140026 0.938030 O\n0.595160 0.859976 0.938030 O\n0.140025 0.404841 0.061970 O\n0.837495 0.829757 0.698784 O\n0.864804 0.319260 0.817025 O\n",
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{
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"structure_string": "Na2 Al2 H4 C2 O10\n1.0\n-3.372025 5.196913 2.811792\n3.372025 -5.196913 2.811792\n3.372025 5.196913 -2.811792\nNa Al H C O\n2 2 4 2 10\ndirect\n0.000033 0.990883 0.490916 Na\n-0.000033 0.490884 -0.009149 Na\n0.500000 0.491013 0.991013 Al\n-0.000000 0.991013 0.991013 Al\n0.279512 0.936344 0.715856 H\n0.720488 0.436345 0.656832 H\n0.720518 0.045706 0.266225 H\n0.279481 0.545705 0.325186 H\n0.500436 0.241004 0.241440 C\n0.499563 0.741003 0.740567 C\n0.775228 0.557735 0.832964 O\n0.622494 0.241022 0.363515 O\n0.377506 0.741021 0.618527 O\n0.764408 0.942524 0.803882 O\n0.235591 0.039474 0.178116 O\n0.638641 0.442525 0.178116 O\n0.361358 0.539474 0.803882 O\n0.224764 0.424290 0.149054 O\n0.775235 0.924290 0.199527 O\n0.224771 0.057736 0.782507 O\n",
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{
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{
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"created_at": "2022-09-04T14:38:46.761164Z",
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"structure_string": "Li2 Al1 N2\n1.0\n3.036284 -0.000000 0.000000\n-1.518142 2.629499 0.000000\n0.000000 -0.000000 5.331078\nLi Al N\n2 1 2\ndirect\n0.666666 0.333333 0.366021 Li\n0.333333 0.666666 0.633979 Li\n0.000000 0.000000 0.000000 Al\n0.666666 0.333333 0.793136 N\n0.333333 0.666666 0.206864 N\n",
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]
}