# CIF generated by HEAS from Alexandria entry agm005697171 data_agm005697171 _cell_length_a 4.85809 _cell_length_b 5.08894 _cell_length_c 5.08894 _cell_angle_alpha 64.09667 _cell_angle_beta 61.48957 _cell_angle_gamma 61.48958 _cell_volume 93.52035 _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 Sc1 Sc 0.87891 0.37109 0.37109 1.00000 Sc2 Sc 0.12109 0.62891 0.62891 1.00000 Fe1 Fe 0.00000 0.00000 0.00000 1.00000 Fe2 Fe 0.50000 0.00000 0.00000 1.00000 Ir1 Ir 0.50000 0.50000 0.00000 1.00000 Ir2 Ir 0.50000 0.00000 0.50000 1.00000