# CIF generated by HEAS from Alexandria entry agm005666161 data_agm005666161 _cell_length_a 5.00602 _cell_length_b 5.00602 _cell_length_c 11.53675 _cell_angle_alpha 93.80451 _cell_angle_beta 93.80451 _cell_angle_gamma 66.82123 _cell_volume 264.93546 _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 Ba1 Ba 0.28787 0.28787 0.17768 1.00000 Ba2 Ba 0.71213 0.71213 0.82232 1.00000 S1 S 0.80821 0.19179 1.00000 1.00000 S2 S 0.19179 0.80821 0.00000 1.00000 I1 I 0.32956 0.32956 0.66663 1.00000 I2 I 0.67044 0.67044 0.33337 1.00000