# CIF generated by HEAS from Alexandria entry agm005769578 data_agm005769578 _cell_length_a 4.04213 _cell_length_b 8.17397 _cell_length_c 8.17402 _cell_angle_alpha 116.71058 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 241.25214 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Mg1 Mg 0.50000 0.28944 0.28944 1.00000 Mg2 Mg 0.00000 0.71056 0.71056 1.00000 S1 S 0.64802 0.99070 0.79802 1.00000 S2 S 0.85198 0.20198 0.00930 1.00000 S3 S 0.35198 0.79802 0.99070 1.00000 S4 S 0.14802 0.00930 0.20198 1.00000 Br1 Br 0.25000 0.38574 0.61425 1.00000 Br2 Br 0.75000 0.61426 0.38575 1.00000