# generated using pymatgen data_Zr4GaAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43317307 _cell_length_b 5.43317179 _cell_length_c 5.43317251 _cell_angle_alpha 104.35323353 _cell_angle_beta 104.35323674 _cell_angle_gamma 120.27836605 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4GaAs _chemical_formula_sum 'Zr4 Ga1 As1' _cell_volume 120.11688479 _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 Zr Zr0 1 0.34458799 0.15541201 0.50000000 1.0 Zr Zr1 1 0.15541201 0.65541201 0.81082202 1.0 Zr Zr2 1 0.65541201 0.84458799 0.50000000 1.0 Zr Zr3 1 0.84458799 0.34458799 0.18917798 1.0 Ga Ga4 1 0.75000000 0.75000000 0.00000000 1.0 As As5 1 0.25000000 0.25000000 0.00000000 1.0