# generated using pymatgen data_SrBr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.76406241 _cell_length_b 6.76406241 _cell_length_c 6.02425800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000403 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrBr3 _chemical_formula_sum 'Sr2 Br6' _cell_volume 238.69833487 _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 Sr Sr0 1 0.33333300 0.66666700 0.75000000 1.0 Sr Sr1 1 0.66666700 0.33333300 0.25000000 1.0 Br Br2 1 0.17269700 0.34539500 0.25000000 1.0 Br Br3 1 0.65460500 0.82730300 0.25000000 1.0 Br Br4 1 0.17269700 0.82730300 0.25000000 1.0 Br Br5 1 0.82730300 0.65460500 0.75000000 1.0 Br Br6 1 0.34539500 0.17269700 0.75000000 1.0 Br Br7 1 0.82730300 0.17269700 0.75000000 1.0