# generated using pymatgen data_LiPa(TiPd6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.60645435 _cell_length_b 5.60645409 _cell_length_c 9.06664278 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000153 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiPa(TiPd6)2 _chemical_formula_sum 'Li1 Pa1 Ti2 Pd12' _cell_volume 246.80485062 _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 Li Li0 1 0.33333300 0.66666700 0.25000000 1.0 Pa Pa1 1 0.66666700 0.33333300 0.75000000 1.0 Ti Ti2 1 0.00000000 0.00000000 0.48489672 1.0 Ti Ti3 1 0.00000000 0.00000000 0.01510328 1.0 Pd Pd4 1 0.49876458 0.50123542 0.49624657 1.0 Pd Pd5 1 0.49876458 0.99753016 0.49624657 1.0 Pd Pd6 1 0.00246984 0.50123542 0.49624657 1.0 Pd Pd7 1 0.49876458 0.50123542 0.00375343 1.0 Pd Pd8 1 0.49876458 0.99753016 0.00375343 1.0 Pd Pd9 1 0.00246984 0.50123542 0.00375343 1.0 Pd Pd10 1 0.83372889 0.66745777 0.25000000 1.0 Pd Pd11 1 0.33254223 0.16627111 0.25000000 1.0 Pd Pd12 1 0.83372889 0.16627111 0.25000000 1.0 Pd Pd13 1 0.16635725 0.33271451 0.75000000 1.0 Pd Pd14 1 0.66728549 0.83364275 0.75000000 1.0 Pd Pd15 1 0.16635725 0.83364275 0.75000000 1.0