# CIF generated by HEAS from Alexandria entry agm005437952 data_agm005437952 _cell_length_a 4.74870 _cell_length_b 4.74870 _cell_length_c 5.84318 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 114.11126 _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 0.00000 0.00000 0.00000 1.00000 Sc2 Sc 0.00000 0.00000 0.50000 1.00000 Sc3 Sc 0.33333 0.66667 0.75000 1.00000 Sc4 Sc 0.66667 0.33333 0.25000 1.00000 Ir1 Ir 0.33333 0.66667 0.25000 1.00000 Ir2 Ir 0.66667 0.33333 0.75000 1.00000