# CIF generated by HEAS from Alexandria entry agm020077869 data_agm020077869 _cell_length_a 5.46073 _cell_length_b 5.46073 _cell_length_c 4.14505 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 140.96852 _cell_volume 77.83908 _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 Zr1 Zr 0.86008 0.13992 0.00000 1.00000 Pa1 Pa 0.13791 0.86209 0.50000 1.00000 Ni1 Ni 0.40886 0.59114 0.50000 1.00000 Ir1 Ir 0.59314 0.40686 0.00000 1.00000