# generated using pymatgen data_TbCe3(NbRu3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.85681294 _cell_length_b 5.85681159 _cell_length_c 7.67089821 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000195 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbCe3(NbRu3)2 _chemical_formula_sum 'Tb1 Ce3 Nb2 Ru6' _cell_volume 227.87645221 _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 0.33333300 0.66666700 0.06959254 1.0 Ce Ce1 1 0.33333300 0.66666700 0.46729715 1.0 Ce Ce2 1 0.66666700 0.33333300 0.56266109 1.0 Ce Ce3 1 0.66666700 0.33333300 0.94863516 1.0 Nb Nb4 1 0.00000000 0.00000000 0.49030007 1.0 Nb Nb5 1 0.00000000 0.00000000 0.99594436 1.0 Ru Ru6 1 0.82832007 0.17167993 0.24458328 1.0 Ru Ru7 1 0.82832007 0.65664013 0.24458328 1.0 Ru Ru8 1 0.34335987 0.17167993 0.24458328 1.0 Ru Ru9 1 0.17010456 0.82989544 0.74393993 1.0 Ru Ru10 1 0.17010456 0.34020913 0.74393993 1.0 Ru Ru11 1 0.65979087 0.82989544 0.74393993 1.0