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O\n0.761183 0.786896 0.373541 O\n0.257664 0.629326 0.775959 O\n0.757664 0.870674 0.224041 O\n0.742336 0.370674 0.224041 O\n0.242336 0.129326 0.775959 O\n0.453250 0.665958 0.385222 O\n0.953250 0.834042 0.614778 O\n0.546750 0.334042 0.614778 O\n0.046750 0.165958 0.385222 O\n0.987078 0.014221 0.302332 O\n0.487078 0.485779 0.697668 O\n0.012922 0.985779 0.697668 O\n0.512922 0.514221 0.302332 O\n0.995607 0.201152 0.231034 O\n0.495607 0.298848 0.768966 O\n0.004393 0.798848 0.768966 O\n0.504393 0.701152 0.231034 O\n","nsites":160,"nelements":4,"elements":["Al","H","N","O"],"chemical_system":"Al-H-N-O","density":1.6902129034340159,"density_atomic":0.10853408725839449,"volume":1474.1912337556873,"volume_molar":5.548616948021759,"formula_full":"Al4 H72 N12 O72","formula_reduced":"AlH18(NO6)3","formula_anonymous":"AB3C18D18","energy":-922.39916496,"energy_per_atom":-5.764994781,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-872.93516496,"band_gap":3.3950000000000005,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":false,"updated_at":"2021-11-28T01:34:52.940000Z","spacegroup":14}]}