# CIF generated by HEAS from Alexandria entry agm001192584 data_agm001192584 _cell_length_a 4.15736 _cell_length_b 4.18856 _cell_length_c 6.63540 _cell_angle_alpha 108.39836 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 109.63836 _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 Ti1 Ti 0.50000 0.82912 0.65824 1.00000 Ti2 Ti 0.00000 0.67207 0.34415 1.00000 Ti3 Ti 0.50000 0.50000 0.00000 1.00000 Ti4 Ti 0.00000 0.32793 0.65585 1.00000 Ti5 Ti 0.50000 0.17088 0.34176 1.00000