# CIF generated by HEAS from Alexandria entry agm005017595 data_agm005017595 _cell_length_a 4.34790 _cell_length_b 4.34790 _cell_length_c 6.34937 _cell_angle_alpha 110.02243 _cell_angle_beta 110.02243 _cell_angle_gamma 90.00000 _cell_volume 105.02052 _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 Ca1 Ca 0.00000 0.00000 0.00000 1.00000 Hf1 Hf 0.75000 0.25000 0.50000 1.00000 Ti1 Ti 0.25000 0.75000 0.50000 1.00000 Ir1 Ir 0.61787 0.61787 0.23575 1.00000 Ir2 Ir 0.38213 0.38213 0.76425 1.00000