# generated using pymatgen data_LiTa4O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.00001624 _cell_length_b 7.00001624 _cell_length_c 9.59301081 _cell_angle_alpha 86.13411270 _cell_angle_beta 86.13411480 _cell_angle_gamma 93.27389331 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiTa4O8 _chemical_formula_sum 'Li3 Ta12 O24' _cell_volume 467.02463183 _cell_formula_units_Z 3 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 0.87493819 0.87493819 0.17093200 1.0 Li Li1 1 0.22373994 0.22373994 0.79816985 1.0 Li Li2 1 0.61863532 0.61863532 0.33598802 1.0 Ta Ta3 1 0.14692772 0.14692772 0.35403384 1.0 Ta Ta4 1 0.64371691 0.64371691 0.85556063 1.0 Ta Ta5 1 0.85095859 0.85095859 0.64810009 1.0 Ta Ta6 1 0.34865799 0.34865799 0.15065347 1.0 Ta Ta7 1 0.84304485 0.41034023 0.63146937 1.0 Ta Ta8 1 0.35650254 0.91535535 0.13813423 1.0 Ta Ta9 1 0.91535535 0.35650254 0.13813423 1.0 Ta Ta10 1 0.41034023 0.84304485 0.63146937 1.0 Ta Ta11 1 0.08484431 0.65259601 0.87171780 1.0 Ta Ta12 1 0.57990310 0.13941492 0.36580350 1.0 Ta Ta13 1 0.13941492 0.57990310 0.36580350 1.0 Ta Ta14 1 0.65259601 0.08484431 0.87171780 1.0 O O15 1 0.33904988 0.06234663 0.48673257 1.0 O O16 1 0.83941265 0.56770034 0.98674116 1.0 O O17 1 0.84702098 0.11948961 0.70545677 1.0 O O18 1 0.35138807 0.61913003 0.21061794 1.0 O O19 1 0.92817863 0.65618593 0.51728105 1.0 O O20 1 0.42902939 0.15697202 0.01469739 1.0 O O21 1 0.87667036 0.14391147 0.29245111 1.0 O O22 1 0.37534207 0.64949185 0.79877481 1.0 O O23 1 0.65618593 0.92817863 0.51728105 1.0 O O24 1 0.15697202 0.42902939 0.01469739 1.0 O O25 1 0.14391147 0.87667036 0.29245111 1.0 O O26 1 0.64949185 0.37534207 0.79877481 1.0 O O27 1 0.06234663 0.33904988 0.48673257 1.0 O O28 1 0.56770034 0.83941265 0.98674116 1.0 O O29 1 0.11948961 0.84702098 0.70545677 1.0 O O30 1 0.61913003 0.35138807 0.21061794 1.0 O O31 1 0.33476239 0.66457457 0.49545519 1.0 O O32 1 0.83222920 0.16047936 0.00729087 1.0 O O33 1 0.66457457 0.33476239 0.49545519 1.0 O O34 1 0.16047936 0.83222920 0.00729087 1.0 O O35 1 0.06007350 0.43250392 0.75329258 1.0 O O36 1 0.58498950 0.91048569 0.25186172 1.0 O O37 1 0.91048569 0.58498950 0.25186172 1.0 O O38 1 0.43250392 0.06007350 0.75329258 1.0