# generated using pymatgen data_TbNd2(Ga2Ni3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.08849489 _cell_length_b 8.77980059 _cell_length_c 8.77979968 _cell_angle_alpha 60.00765515 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbNd2(Ga2Ni3)3 _chemical_formula_sum 'Tb1 Nd2 Ga6 Ni9' _cell_volume 272.95863980 _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 Tb Tb0 1 0.00000000 0.99990559 0.00009441 1.0 Nd Nd1 1 0.50000000 0.33333241 0.33330631 1.0 Nd Nd2 1 0.50000000 0.66669369 0.66666759 1.0 Ga Ga3 1 0.50000000 0.73171158 0.26828842 1.0 Ga Ga4 1 0.50000000 0.26824298 0.00002995 1.0 Ga Ga5 1 0.50000000 0.99997005 0.73175702 1.0 Ga Ga6 1 0.00000000 0.47664417 0.52335583 1.0 Ga Ga7 1 0.00000000 0.52339768 0.99998130 1.0 Ga Ga8 1 0.00000000 0.00001870 0.47660232 1.0 Ni Ni9 1 0.00000000 0.19905480 0.16917501 1.0 Ni Ni10 1 0.00000000 0.16911606 0.63175257 1.0 Ni Ni11 1 0.00000000 0.63180382 0.19904499 1.0 Ni Ni12 1 0.00000000 0.83082399 0.80094520 1.0 Ni Ni13 1 0.00000000 0.36824743 0.83088394 1.0 Ni Ni14 1 0.00000000 0.80095501 0.36819618 1.0 Ni Ni15 1 0.50000000 0.28693643 0.71306357 1.0 Ni Ni16 1 0.50000000 0.71307545 0.00002983 1.0 Ni Ni17 1 0.50000000 0.99997017 0.28692455 1.0