# generated using pymatgen data_NdGa2CuNi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.89955392 _cell_length_b 8.89955393 _cell_length_c 4.08572059 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999994 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdGa2CuNi2 _chemical_formula_sum 'Nd3 Ga6 Cu3 Ni6' _cell_volume 280.24364515 _cell_formula_units_Z 3 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 Nd Nd0 1 0.33333300 0.66666700 0.50000000 1.0 Nd Nd1 1 0.66666700 0.33333300 0.50000000 1.0 Nd Nd2 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga3 1 0.47889458 0.00000000 0.00000000 1.0 Ga Ga4 1 0.00000000 0.47889458 0.00000000 1.0 Ga Ga5 1 0.52110542 0.52110542 0.00000000 1.0 Ga Ga6 1 0.71735453 0.00000000 0.50000000 1.0 Ga Ga7 1 1.00000000 0.71735453 0.50000000 1.0 Ga Ga8 1 0.28264547 0.28264547 0.50000000 1.0 Cu Cu9 1 0.28977685 0.00000000 0.50000000 1.0 Cu Cu10 1 0.00000000 0.28977685 0.50000000 1.0 Cu Cu11 1 0.71022315 0.71022315 0.50000000 1.0 Ni Ni12 1 0.20028344 0.37084956 0.00000000 1.0 Ni Ni13 1 0.62915044 0.82943388 0.00000000 1.0 Ni Ni14 1 0.17056612 0.79971656 0.00000000 1.0 Ni Ni15 1 0.82943388 0.62915044 0.00000000 1.0 Ni Ni16 1 0.79971656 0.17056612 0.00000000 1.0 Ni Ni17 1 0.37084956 0.20028344 0.00000000 1.0