# generated using pymatgen data_LiTa3(TiOs3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.40768103 _cell_length_b 6.24097872 _cell_length_c 13.18543520 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00043540 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiTa3(TiOs3)2 _chemical_formula_sum 'Li2 Ta6 Ti4 Os12' _cell_volume 362.70816245 _cell_formula_units_Z 2 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 0.00000200 0.00000000 0.00055223 1.0 Li Li1 1 0.49998912 0.50000000 0.16611928 1.0 Ta Ta2 1 0.00000497 0.50000000 0.00762676 1.0 Ta Ta3 1 0.49998528 0.00000000 0.15906464 1.0 Ta Ta4 1 0.99999231 0.50000000 0.32376427 1.0 Ta Ta5 1 0.50000135 0.00000000 0.49747395 1.0 Ta Ta6 1 0.00000314 0.50000000 0.66916911 1.0 Ta Ta7 1 0.50001232 0.00000000 0.84290707 1.0 Ti Ti8 1 0.99999225 0.00000000 0.32662680 1.0 Ti Ti9 1 0.49999776 0.50000000 0.49734678 1.0 Ti Ti10 1 0.00000779 0.00000000 0.66929946 1.0 Ti Ti11 1 0.50000861 0.50000000 0.84004143 1.0 Os Os12 1 0.50000300 0.25311069 0.99854916 1.0 Os Os13 1 0.50000300 0.74688931 0.99854916 1.0 Os Os14 1 0.99998884 0.24688527 0.16814986 1.0 Os Os15 1 0.99998884 0.75311473 0.16814986 1.0 Os Os16 1 0.49999470 0.24775707 0.33547115 1.0 Os Os17 1 0.49999470 0.75224293 0.33547115 1.0 Os Os18 1 0.00000043 0.25070135 0.49999445 1.0 Os Os19 1 0.00000043 0.74929865 0.49999445 1.0 Os Os20 1 0.50000388 0.24929657 0.66664173 1.0 Os Os21 1 0.50000388 0.75070343 0.66664173 1.0 Os Os22 1 0.00000770 0.25224015 0.83119726 1.0 Os Os23 1 0.00000770 0.74775985 0.83119726 1.0