# CIF generated by HEAS from Alexandria entry agm002138331 data_agm002138331 _cell_length_a 5.62170 _cell_length_b 5.62170 _cell_length_c 5.62170 _cell_angle_alpha 60.00000 _cell_angle_beta 60.00000 _cell_angle_gamma 60.00000 _cell_volume 125.62826 _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 Ir1 Ir 0.50000 0.50000 0.50000 1.00000 Ir2 Ir 0.00000 0.00000 0.50000 1.00000 Ir3 Ir 0.00000 0.50000 0.50000 1.00000 Ir4 Ir 0.00000 0.50000 0.00000 1.00000 Ba1 Ba 0.37500 0.87500 0.87500 1.00000 Ba2 Ba 0.62500 0.12500 0.12500 1.00000