# CIF generated by HEAS from Alexandria entry agm005487702 data_agm005487702 _cell_length_a 6.45472 _cell_length_b 6.45472 _cell_length_c 7.62271 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 275.03968 _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 0.00000 0.00000 0.23866 1.00000 Ba2 Ba 0.00000 0.00000 0.76134 1.00000 Ba3 Ba 0.66667 0.33333 0.50000 1.00000 Ba4 Ba 0.33333 0.66667 0.50000 1.00000 Zr1 Zr 0.00000 0.50000 0.00000 1.00000 Zr2 Zr 0.50000 0.50000 0.00000 1.00000 Zr3 Zr 0.50000 0.00000 0.00000 1.00000