# CIF generated by HEAS from Alexandria entry agm005017607 data_agm005017607 _cell_length_a 4.11968 _cell_length_b 4.11968 _cell_length_c 6.29838 _cell_angle_alpha 109.08940 _cell_angle_beta 109.08940 _cell_angle_gamma 90.00000 _cell_volume 94.77436 _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 Ti1 Ti 0.25000 0.75000 0.50000 1.00000 Al1 Al 0.75000 0.25000 0.50000 1.00000 Ir1 Ir 0.61607 0.61607 0.23214 1.00000 Ir2 Ir 0.38393 0.38393 0.76786 1.00000