# generated using pymatgen data_Mg2GaNi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.75127317 _cell_length_b 4.75127327 _cell_length_c 4.75127298 _cell_angle_alpha 63.11902572 _cell_angle_beta 63.11903388 _cell_angle_gamma 63.11901461 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2GaNi3 _chemical_formula_sum 'Mg2 Ga1 Ni3' _cell_volume 81.08971946 _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 Mg Mg0 1 0.37652397 0.37652397 0.37652397 1.0 Mg Mg1 1 0.62347603 0.62347603 0.62347603 1.0 Ga Ga2 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni3 1 0.00000000 0.50000000 0.00000000 1.0 Ni Ni4 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni5 1 0.50000000 0.00000000 0.00000000 1.0