# generated using pymatgen data_CsPbBr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.94863632 _cell_length_b 5.94862291 _cell_length_c 5.94863323 _cell_angle_alpha 89.99992044 _cell_angle_beta 90.00002976 _cell_angle_gamma 90.00013908 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsPbBr3 _chemical_formula_sum 'Cs1 Pb1 Br3' _cell_volume 210.49949127 _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 Cs Cs0 1 0.00000000 0.00000000 0.00000000 1.0 Pb Pb1 1 0.49999900 0.50000000 0.50000000 1.0 Br Br2 1 0.50000000 0.50000000 0.00000000 1.0 Br Br3 1 0.50000000 -0.00000000 0.50000000 1.0 Br Br4 1 -0.00000000 0.50000000 0.50000000 1.0