# CIF generated by HEAS from Alexandria entry agm003221925 data_agm003221925 _cell_length_a 8.68972 _cell_length_b 8.68972 _cell_length_c 6.39880 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 60.00000 _cell_volume 418.44707 _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 0.66732 0.33268 0.25000 1.00000 Sc4 Sc 0.00000 0.66732 0.25000 1.00000 Sc5 Sc 0.33268 0.00000 0.25000 1.00000 Sc6 Sc 0.33268 0.66732 0.75000 1.00000 Sc7 Sc 0.00000 0.33268 0.75000 1.00000 Sc8 Sc 0.66732 0.00000 0.75000 1.00000 Zr1 Zr 0.33784 0.66216 0.25000 1.00000 Zr2 Zr 0.00000 0.33784 0.25000 1.00000 Zr3 Zr 0.66216 0.00000 0.25000 1.00000 Zr4 Zr 0.66216 0.33784 0.75000 1.00000 Zr5 Zr 0.00000 0.66216 0.75000 1.00000 Zr6 Zr 0.33784 0.00000 0.75000 1.00000 Zr7 Zr 0.33333 0.33333 0.00000 1.00000 Zr8 Zr 0.66667 0.66667 0.50000 1.00000 Zr9 Zr 0.66667 0.66667 0.00000 1.00000 Zr10 Zr 0.33333 0.33333 0.50000 1.00000