# generated using pymatgen data_Hf2Nb(ReSi)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.88151998 _cell_length_b 6.88151919 _cell_length_c 3.35650626 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.33034415 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2Nb(ReSi)3 _chemical_formula_sum 'Hf2 Nb1 Re3 Si3' _cell_volume 138.57280045 _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 Hf Hf0 1 0.40329678 0.00291320 0.50000000 1.0 Hf Hf1 1 0.00291320 0.40329678 0.50000000 1.0 Nb Nb2 1 0.59614991 0.59614991 0.50000000 1.0 Re Re3 1 0.74364209 0.99826471 0.00000000 1.0 Re Re4 1 0.99826471 0.74364209 0.00000000 1.0 Re Re5 1 0.25431383 0.25431383 0.00000000 1.0 Si Si6 1 0.33786489 0.66669465 0.00000000 1.0 Si Si7 1 0.66669465 0.33786489 0.00000000 1.0 Si Si8 1 0.99685992 0.99685992 0.50000000 1.0