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"id": "jvasp-106423",
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"structure_string": "K2 Ag1 Mo1 Br6\n1.0\n6.594008 -0.000000 3.807052\n2.198003 6.216890 3.807052\n-0.000000 -0.000000 7.614105\nK Ag Mo Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Ag\n0.000000 0.000000 0.000000 Mo\n0.758352 0.241648 0.241648 Br\n0.241648 0.241648 0.758351 Br\n0.241648 0.758352 0.758351 Br\n0.241648 0.758352 0.241648 Br\n0.758352 0.241648 0.758351 Br\n0.758352 0.758352 0.241648 Br\n",
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{
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"structure_string": "Na2 Fe2 N2\n1.0\n3.009076 0.000000 0.000000\n-1.504538 2.605930 0.000000\n0.000000 0.000000 9.706416\nNa Fe N\n2 2 2\ndirect\n0.666667 0.333332 0.761682 Na\n0.333333 0.666668 0.261682 Na\n-0.000001 -0.000003 0.517901 Fe\n0.000001 0.000003 0.017901 Fe\n0.333332 0.666665 0.565057 N\n0.666669 0.333335 0.065056 N\n",
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{
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"created_at": "2022-09-04T14:38:02.206860Z",
"updated_at": "2022-09-04T14:38:02.206880Z",
"structure_string": "Li4 Co3 O2 F6\n1.0\n-5.021002 -0.017938 0.001793\n0.896732 5.186222 -0.036170\n-0.072901 -1.767044 -5.509315\nLi Co O F\n4 3 2 6\ndirect\n0.256893 0.974251 0.866078 Li\n0.761007 -0.003277 0.633068 Li\n0.238993 0.003277 0.366933 Li\n0.743107 0.025750 0.133923 Li\n0.501617 0.495754 0.778912 Co\n0.498383 0.504246 0.221089 Co\n0.000000 0.500000 -0.000000 Co\n0.642269 0.254955 0.937170 O\n0.357731 0.745046 0.062831 O\n0.134084 0.207013 0.687748 F\n0.872105 0.771716 0.826577 F\n0.401265 0.744937 0.564562 F\n0.598735 0.255063 0.435439 F\n0.865916 0.792987 0.312254 F\n0.127895 0.228284 0.173424 F\n",
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{
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"structure_string": "Mg4 Fe4 B4 O16\n1.0\n3.003601 -0.000000 0.000000\n0.000000 9.085249 0.000000\n-0.000000 -0.000000 9.310361\nMg Fe B O\n4 4 4 16\ndirect\n0.250000 0.607734 0.178048 Mg\n0.750000 0.392266 0.821952 Mg\n0.750000 0.892266 0.678048 Mg\n0.250000 0.107734 0.321952 Mg\n0.250000 0.613444 0.555599 Fe\n0.750000 0.386557 0.444401 Fe\n0.750000 0.886557 0.055599 Fe\n0.250000 0.113444 0.944401 Fe\n0.250000 0.169323 0.634481 B\n0.750000 0.830677 0.365519 B\n0.750000 0.330677 0.134481 B\n0.250000 0.669323 0.865518 B\n0.750000 0.477088 0.125528 O\n0.250000 0.522912 0.874472 O\n0.250000 0.505032 0.384106 O\n0.750000 0.494968 0.615894 O\n0.750000 0.994968 0.884106 O\n0.250000 0.005032 0.115894 O\n0.250000 0.241950 0.765799 O\n0.750000 0.247069 0.004856 O\n0.750000 0.258050 0.265799 O\n0.250000 0.741950 0.734201 O\n0.250000 0.252931 0.504856 O\n0.750000 0.747069 0.495144 O\n0.750000 0.977088 0.374472 O\n0.250000 0.752931 -0.004856 O\n0.750000 0.758050 0.234201 O\n0.250000 0.022912 0.625528 O\n",
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{
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"structure_string": "Fe4 P2 O10\n1.0\n5.015838 -0.000000 -1.977086\n-0.779305 4.954928 -1.977086\n-0.002037 -0.002384 7.345927\nFe P O\n4 2 10\ndirect\n0.500000 0.000000 -0.000000 Fe\n0.500000 0.500001 0.500000 Fe\n0.000000 0.500001 0.500000 Fe\n0.500001 0.500000 -0.000000 Fe\n0.875000 0.125001 0.750000 P\n0.125001 0.875000 0.250000 P\n0.625001 0.375000 0.250000 O\n0.375000 0.625001 0.750000 O\n0.806845 0.818592 0.613688 O\n0.704903 0.193156 0.886312 O\n0.181408 0.193156 0.886312 O\n0.193155 0.181409 0.386312 O\n0.806845 0.295097 0.613688 O\n0.818593 0.806845 0.113688 O\n0.295098 0.806845 0.113688 O\n0.193156 0.704904 0.386312 O\n",
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{
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"structure_string": "Zn2 P2\n1.0\n1.805786 -3.127714 -0.000000\n1.805786 3.127714 0.000000\n0.000000 0.000000 6.993879\nZn P\n2 2\ndirect\n0.333334 0.666668 0.353599 Zn\n0.666668 0.333334 0.853599 Zn\n0.333334 0.666668 0.021401 P\n0.666668 0.333334 0.521401 P\n",
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{
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"created_at": "2022-09-04T14:38:03.817290Z",
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"structure_string": "Si6 Sb4 O18\n1.0\n6.920375 0.000001 -0.000008\n-3.460186 5.993225 -0.000008\n-0.000008 -0.000019 9.323547\nSi Sb O\n6 4 18\ndirect\n0.206877 0.926026 0.249999 Si\n0.073977 0.280847 0.250000 Si\n0.280849 0.206873 0.750000 Si\n0.719157 0.793126 0.250000 Si\n0.926029 0.719152 0.750000 Si\n0.793130 0.073973 0.750001 Si\n0.666671 0.333334 0.018465 Sb\n0.666669 0.333332 0.481536 Sb\n0.333336 0.666665 0.981536 Sb\n0.333337 0.666668 0.518465 Sb\n0.421571 0.325764 0.604827 O\n0.674238 0.095802 0.604828 O\n0.904200 0.578431 0.895172 O\n0.904201 0.578432 0.604826 O\n0.935572 0.752523 0.249999 O\n0.752526 0.816954 0.750000 O\n0.421569 0.325765 0.895174 O\n0.578437 0.674236 0.395174 O\n0.095806 0.421568 0.104827 O\n0.247481 0.183045 0.250000 O\n0.064435 0.247476 0.750001 O\n0.095806 0.421568 0.395174 O\n0.674239 0.095803 0.895174 O\n0.325768 0.904197 0.395172 O\n0.325768 0.904196 0.104826 O\n0.183047 0.935566 0.750000 O\n0.578436 0.674234 0.104827 O\n0.816960 0.064433 0.250000 O\n",
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}