# generated using pymatgen data_Zr5Ga2AsO _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.04663087 _cell_length_b 8.01040449 _cell_length_c 5.62076837 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.85117497 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5Ga2AsO _chemical_formula_sum 'Zr10 Ga4 As2 O2' _cell_volume 314.22749895 _cell_formula_units_Z 2 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 Zr Zr0 1 1.00000000 0.76420841 0.75000000 1.0 Zr Zr1 1 0.00000000 0.23579159 0.25000000 1.0 Zr Zr2 1 0.32994793 0.66497447 0.00000000 1.0 Zr Zr3 1 0.32994793 0.66497447 0.50000000 1.0 Zr Zr4 1 0.24192465 0.24033704 0.75000000 1.0 Zr Zr5 1 0.24192465 0.00158761 0.25000000 1.0 Zr Zr6 1 0.75807535 0.75966296 0.25000000 1.0 Zr Zr7 1 0.67005207 0.33502553 0.00000000 1.0 Zr Zr8 1 0.67005207 0.33502553 0.50000000 1.0 Zr Zr9 1 0.75807535 0.99841239 0.75000000 1.0 Ga Ga10 1 0.40210125 0.40114009 0.25000000 1.0 Ga Ga11 1 0.59789875 0.59885991 0.75000000 1.0 Ga Ga12 1 0.40210125 0.00096116 0.75000000 1.0 Ga Ga13 1 0.59789875 0.99903884 0.25000000 1.0 As As14 1 1.00000000 0.60531423 0.25000000 1.0 As As15 1 0.00000000 0.39468577 0.75000000 1.0 O O16 1 0.00000000 0.00000000 0.00000000 1.0 O O17 1 0.00000000 0.00000000 0.50000000 1.0