# CIF generated by HEAS from Alexandria entry agm002952078 data_agm002952078 _cell_length_a 5.42672 _cell_length_b 5.42672 _cell_length_c 9.37955 _cell_angle_alpha 73.18486 _cell_angle_beta 73.18486 _cell_angle_gamma 90.00000 _cell_volume 252.04783 _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 I1 I 0.75000 0.25000 0.50000 1.00000 I2 I 0.25000 0.75000 0.50000 1.00000 Ba1 Ba 0.37719 0.37719 0.24562 1.00000 Ba2 Ba 0.62281 0.62281 0.75438 1.00000 Zr1 Zr 0.00000 0.00000 0.00000 1.00000