# generated using pymatgen data_CsReO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.76619300 _cell_length_b 6.76619300 _cell_length_c 8.64427503 _cell_angle_alpha 113.03967863 _cell_angle_beta 113.03967863 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsReO2 _chemical_formula_sum 'Cs4 Re4 O8' _cell_volume 329.60295685 _cell_formula_units_Z 4 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 Cs Cs0 1 0.62500000 0.87500000 0.25000000 1.0 Cs Cs1 1 0.62500000 0.37500000 0.25000000 1.0 Cs Cs2 1 0.62500000 0.37500000 0.75000000 1.0 Cs Cs3 1 0.12500000 0.37500000 0.75000000 1.0 Re Re4 1 0.12500000 0.37500000 0.25000000 1.0 Re Re5 1 0.12500000 0.87500000 0.25000000 1.0 Re Re6 1 0.12500000 0.87500000 0.75000000 1.0 Re Re7 1 0.62500000 0.87500000 0.75000000 1.0 O O8 1 0.30376800 0.14319200 0.27061800 1.0 O O9 1 0.96685100 0.12742600 0.27061800 1.0 O O10 1 0.37742600 0.05376800 0.77061800 1.0 O O11 1 0.94623200 0.60680800 0.22938200 1.0 O O12 1 0.39319200 0.71685100 0.77061800 1.0 O O13 1 0.28314900 0.62257400 0.22938200 1.0 O O14 1 0.87257400 0.69623200 0.72938200 1.0 O O15 1 0.85680800 0.03314900 0.72938200 1.0