# CIF generated by HEAS from Alexandria entry agm003633751 data_agm003633751 _cell_length_a 3.06747 _cell_length_b 4.88916 _cell_length_c 11.69896 _cell_angle_alpha 90.01837 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 175.45341 _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 0.42200 0.74964 0.17294 1.00000 Zr2 Zr 0.42266 0.75044 0.70845 1.00000 Zr3 Zr 0.92266 0.24956 0.29155 1.00000 Zr4 Zr 0.92200 0.25036 0.82706 1.00000 Sc1 Sc 0.92399 0.25005 0.56658 1.00000 Sc2 Sc 0.42399 0.74995 0.43342 1.00000 Ti1 Ti 0.42149 0.24993 0.04834 1.00000 Ti2 Ti 0.92149 0.75007 0.95166 1.00000