# generated using pymatgen data_Zr5Ga4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.37586961 _cell_length_b 8.37586961 _cell_length_c 5.75520262 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999313 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5Ga4 _chemical_formula_sum 'Zr10 Ga8' _cell_volume 349.66414041 _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 0.66666700 0.33333300 0.00000000 1.0 Zr Zr1 1 0.33333300 0.66666700 0.00000000 1.0 Zr Zr2 1 0.33333300 0.66666700 0.50000000 1.0 Zr Zr3 1 0.66666700 0.33333300 0.50000000 1.0 Zr Zr4 1 0.72446174 0.72446174 0.75000000 1.0 Zr Zr5 1 0.27553826 -0.00000000 0.75000000 1.0 Zr Zr6 1 -0.00000000 0.27553826 0.75000000 1.0 Zr Zr7 1 0.27553826 0.27553826 0.25000000 1.0 Zr Zr8 1 0.72446174 0.00000000 0.25000000 1.0 Zr Zr9 1 0.00000000 0.72446174 0.25000000 1.0 Ga Ga10 1 -0.00000000 -0.00000000 0.00000000 1.0 Ga Ga11 1 -0.00000000 -0.00000000 0.50000000 1.0 Ga Ga12 1 0.37956666 0.37956666 0.75000000 1.0 Ga Ga13 1 0.62043334 -0.00000000 0.75000000 1.0 Ga Ga14 1 -0.00000000 0.62043334 0.75000000 1.0 Ga Ga15 1 0.62043334 0.62043334 0.25000000 1.0 Ga Ga16 1 0.37956666 0.00000000 0.25000000 1.0 Ga Ga17 1 0.00000000 0.37956666 0.25000000 1.0