# generated using pymatgen data_Ti6Be15Pd8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.83406437 _cell_length_b 7.83406447 _cell_length_c 7.83406439 _cell_angle_alpha 59.99999612 _cell_angle_beta 59.99999572 _cell_angle_gamma 59.99999755 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6Be15Pd8 _chemical_formula_sum 'Ti6 Be15 Pd8' _cell_volume 339.97452925 _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 Ti Ti0 1 0.69145122 0.30854878 0.30854878 1.0 Ti Ti1 1 0.30854878 0.69145122 0.69145122 1.0 Ti Ti2 1 0.30854878 0.69145122 0.30854878 1.0 Ti Ti3 1 0.69145122 0.30854878 0.69145122 1.0 Ti Ti4 1 0.30854878 0.30854878 0.69145122 1.0 Ti Ti5 1 0.69145122 0.69145122 0.30854878 1.0 Be Be6 1 0.32854580 0.32854580 0.32854580 1.0 Be Be7 1 0.67145420 0.67145420 0.67145420 1.0 Be Be8 1 0.32854580 0.32854580 0.01436261 1.0 Be Be9 1 0.32854580 0.01436261 0.32854580 1.0 Be Be10 1 0.67145420 0.67145420 0.98563739 1.0 Be Be11 1 0.67145420 0.98563739 0.67145420 1.0 Be Be12 1 0.01436261 0.32854580 0.32854580 1.0 Be Be13 1 0.98563739 0.67145420 0.67145420 1.0 Be Be14 1 0.50000000 0.00000000 0.00000000 1.0 Be Be15 1 0.00000000 0.50000000 0.50000000 1.0 Be Be16 1 0.00000000 0.50000000 0.00000000 1.0 Be Be17 1 0.50000000 0.00000000 0.50000000 1.0 Be Be18 1 0.00000000 0.00000000 0.50000000 1.0 Be Be19 1 0.50000000 0.50000000 0.00000000 1.0 Be Be20 1 0.00000000 0.00000000 0.00000000 1.0 Pd Pd21 1 0.12477879 0.12477879 0.12477879 1.0 Pd Pd22 1 0.87522121 0.87522121 0.87522121 1.0 Pd Pd23 1 0.12477879 0.12477879 0.62566362 1.0 Pd Pd24 1 0.12477879 0.62566362 0.12477879 1.0 Pd Pd25 1 0.87522121 0.87522121 0.37433638 1.0 Pd Pd26 1 0.87522121 0.37433638 0.87522121 1.0 Pd Pd27 1 0.62566362 0.12477879 0.12477879 1.0 Pd Pd28 1 0.37433638 0.87522121 0.87522121 1.0