# generated using pymatgen data_Ba2Tl2Zn3(WO3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.81366951 _cell_length_b 3.81367003 _cell_length_c 23.70042197 _cell_angle_alpha 94.61476260 _cell_angle_beta 94.61476192 _cell_angle_gamma 90.00000008 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Tl2Zn3(WO3)4 _chemical_formula_sum 'Ba2 Tl2 Zn3 W4 O12' _cell_volume 342.46220459 _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 Ba Ba0 1 0.16559500 0.16559500 0.33118800 1.0 Ba Ba1 1 0.83440500 0.83440500 0.66881200 1.0 Tl Tl2 1 0.72509300 0.72509300 0.45018600 1.0 Tl Tl3 1 0.27490700 0.27490700 0.54981400 1.0 Zn Zn4 1 0.07254100 0.07254100 0.14508400 1.0 Zn Zn5 1 0.92745900 0.92745900 0.85491600 1.0 Zn Zn6 1 0.00000000 0.00000000 0.00000000 1.0 W W7 1 0.54710300 0.54710300 0.09420700 1.0 W W8 1 0.39336700 0.39336700 0.78673500 1.0 W W9 1 0.60663300 0.60663300 0.21326500 1.0 W W10 1 0.45289700 0.45289700 0.90579300 1.0 O O11 1 0.38162200 0.88162200 0.76324400 1.0 O O12 1 0.52845600 0.02845600 0.05691400 1.0 O O13 1 0.22733000 0.22733000 0.45465900 1.0 O O14 1 0.97154400 0.47154400 0.94308600 1.0 O O15 1 0.77267000 0.77267000 0.54534100 1.0 O O16 1 0.11837800 0.61837800 0.23675600 1.0 O O17 1 0.61837800 0.11837800 0.23675600 1.0 O O18 1 0.32155400 0.32155400 0.64310600 1.0 O O19 1 0.88162200 0.38162200 0.76324400 1.0 O O20 1 0.02845600 0.52845600 0.05691400 1.0 O O21 1 0.47154400 0.97154400 0.94308600 1.0 O O22 1 0.67844600 0.67844600 0.35689400 1.0