# generated using pymatgen data_ZrGa2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.98483322 _cell_length_b 4.12734508 _cell_length_c 6.75735286 _cell_angle_alpha 89.99999947 _cell_angle_beta 107.11950014 _cell_angle_gamma 90.00000063 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrGa2 _chemical_formula_sum 'Zr2 Ga4' _cell_volume 106.21256113 _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 0.64959412 -0.00000000 0.29921531 1.0 Zr Zr1 1 0.35040588 0.00000001 0.70078469 1.0 Ga Ga2 1 0.00000000 -0.00000000 0.00000000 1.0 Ga Ga3 1 0.50000000 0.50000000 1.00000000 1.0 Ga Ga4 1 0.82185524 0.50000000 0.64358349 1.0 Ga Ga5 1 0.17814476 0.50000000 0.35641650 1.0