# generated using pymatgen data_Zr2GaFe3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.03209400 _cell_length_b 5.03209379 _cell_length_c 8.21093900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000136 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2GaFe3 _chemical_formula_sum 'Zr4 Ga2 Fe6' _cell_volume 180.06152501 _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 0.33333300 0.66666700 0.43446400 1.0 Zr Zr1 1 0.66666700 0.33333300 0.56553600 1.0 Zr Zr2 1 0.66666700 0.33333300 0.93446400 1.0 Zr Zr3 1 0.33333300 0.66666700 0.06553600 1.0 Ga Ga4 1 0.00000000 0.00000000 0.50000000 1.0 Ga Ga5 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe6 1 0.82768800 0.17231200 0.25000000 1.0 Fe Fe7 1 0.82768800 0.65537600 0.25000000 1.0 Fe Fe8 1 0.34462400 0.17231200 0.25000000 1.0 Fe Fe9 1 0.17231200 0.82768800 0.75000000 1.0 Fe Fe10 1 0.17231200 0.34462400 0.75000000 1.0 Fe Fe11 1 0.65537600 0.82768800 0.75000000 1.0