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"structure_string": "K5 Bi4\n1.0\n6.453522 -0.014627 2.279994\n4.059614 5.016741 2.279994\n-0.018772 -0.008932 11.623816\nK Bi\n5 4\ndirect\n0.747696 0.747696 0.667452 K\n0.255009 0.255009 0.335079 K\n0.408565 0.408565 0.887678 K\n0.593924 0.593924 0.114759 K\n0.501865 0.501865 0.500913 K\n0.048519 0.048519 0.668865 Bi\n0.953936 0.953936 0.333718 Bi\n0.115575 0.115576 0.893210 Bi\n0.886908 0.886908 0.109325 Bi\n",
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"structure_string": "Sr2 Al4 Se8\n1.0\n6.308245 -0.035815 0.000000\n-3.167724 5.455343 0.000000\n0.000000 0.000000 10.996902\nSr Al Se\n2 4 8\ndirect\n0.500000 0.499999 0.750000 Sr\n0.500000 0.499999 0.250000 Sr\n0.240990 0.761445 0.500000 Al\n0.759011 0.238553 0.500000 Al\n0.761446 0.240989 0.000000 Al\n0.238555 0.759010 0.000000 Al\n0.000000 0.500000 0.832139 Se\n0.000000 0.500000 0.167860 Se\n0.500000 -0.000000 0.332140 Se\n0.652560 0.817709 0.000000 Se\n0.347440 0.182289 0.000000 Se\n0.817711 0.652559 0.500000 Se\n0.182290 0.347440 0.500000 Se\n0.500000 -0.000000 0.667860 Se\n",
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"chemical_system": "Al-B-O-Pr",
"density": 4.025526984696188,
"density_atomic": 0.10607250077604648,
"volume": 377.1005652487915,
"volume_molar": 5.677381711509467,
"formula_full": "Pr2 Al6 B8 O24",
"formula_reduced": "PrAl3(BO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 3.235332029166667,
"spacegroup": 15
}
]
}