# generated using pymatgen data_TlAgBr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.40856411 _cell_length_b 5.40856411 _cell_length_c 5.40652560 _cell_angle_alpha 89.88538659 _cell_angle_beta 89.88538659 _cell_angle_gamma 89.90345912 _symmetry_Int_Tables_number 1 _chemical_formula_structural TlAgBr3 _chemical_formula_sum 'Tl1 Ag1 Br3' _cell_volume 158.15388902 _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 Tl Tl0 1 0.00234300 0.00234300 0.99856700 1.0 Ag Ag1 1 0.50143300 0.50143300 0.51490500 1.0 Br Br2 1 0.00011400 0.50545300 0.51781400 1.0 Br Br3 1 0.49371900 0.49371900 0.01504300 1.0 Br Br4 1 0.50545300 0.00011400 0.51781400 1.0