# generated using pymatgen data_Re9Mo3Se16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73157100 _cell_length_b 6.73309808 _cell_length_c 13.45821302 _cell_angle_alpha 93.39931956 _cell_angle_beta 93.64129238 _cell_angle_gamma 93.53777881 _symmetry_Int_Tables_number 1 _chemical_formula_structural Re9Mo3Se16 _chemical_formula_sum 'Re9 Mo3 Se16' _cell_volume 606.36818430 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Re Re0 1 0.41393200 0.23558900 0.27368700 1.0 Re Re1 1 0.54455400 0.41436700 0.61787600 1.0 Re Re2 1 0.54617100 0.41541400 0.11787000 1.0 Re Re3 1 0.76412500 0.45421900 0.79290800 1.0 Re Re4 1 0.76378200 0.45505800 0.29207100 1.0 Re Re5 1 0.58396800 0.76501000 0.72688100 1.0 Re Re6 1 0.58488000 0.76611600 0.22640500 1.0 Re Re7 1 0.45332700 0.58571100 0.88273400 1.0 Re Re8 1 0.45302700 0.58510900 0.38261800 1.0 Mo Mo9 1 0.23314500 0.54494300 0.70675600 1.0 Mo Mo10 1 0.23377600 0.54587800 0.20706900 1.0 Mo Mo11 1 0.41325500 0.23425900 0.77374200 1.0 Se Se12 1 0.21401800 0.21087100 0.60432600 1.0 Se Se13 1 0.21630200 0.20945800 0.10627800 1.0 Se Se14 1 0.78683500 0.78692900 0.89309400 1.0 Se Se15 1 0.78634500 0.78649500 0.39302500 1.0 Se Se16 1 0.12476200 0.36959800 0.86885100 1.0 Se Se17 1 0.12649100 0.36743900 0.36848900 1.0 Se Se18 1 0.73738700 0.12790100 0.68367200 1.0 Se Se19 1 0.73462800 0.12669900 0.18463000 1.0 Se Se20 1 0.37134000 0.73444500 0.56209000 1.0 Se Se21 1 0.37038900 0.73360700 0.06229600 1.0 Se Se22 1 0.86934100 0.63043400 0.63370400 1.0 Se Se23 1 0.87063500 0.63177700 0.13315600 1.0 Se Se24 1 0.26968800 0.87210900 0.81523700 1.0 Se Se25 1 0.26993000 0.87636200 0.31553300 1.0 Se Se26 1 0.63250900 0.26857600 0.93828900 1.0 Se Se27 1 0.63145600 0.26562700 0.43671100 1.0