# CIF generated by HEAS from Alexandria entry agm005772427 data_agm005772427 _cell_length_a 2.91726 _cell_length_b 2.91726 _cell_length_c 8.62677 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 73.41728 _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 Ti1 Ti 0.50000 0.50000 0.50000 1.00000 Al1 Al 0.50000 0.50000 0.83219 1.00000 Al2 Al 0.50000 0.50000 0.16781 1.00000 Fe1 Fe 0.00000 0.00000 0.00000 1.00000 Fe2 Fe 0.00000 0.00000 0.66930 1.00000 Fe3 Fe 0.00000 0.00000 0.33070 1.00000