# CIF generated by HEAS from Alexandria entry agm005286965 data_agm005286965 _cell_length_a 9.05163 _cell_length_b 9.05163 _cell_length_c 8.99538 _cell_angle_alpha 75.45099 _cell_angle_beta 75.45099 _cell_angle_gamma 21.75877 _cell_volume 264.11927 _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 0.20768 0.20768 0.15019 1.00000 Ti2 Ti 0.83578 0.83578 0.49430 1.00000 Ti3 Ti 0.16422 0.16422 0.50570 1.00000 Ti4 Ti 0.79232 0.79232 0.84981 1.00000 Ti5 Ti 0.50000 0.50000 0.50000 1.00000 Tl1 Tl 0.00000 0.00000 0.00000 1.00000 S1 S 0.07675 0.07675 0.33569 1.00000 S2 S 0.33856 0.33856 0.99472 1.00000 S3 S 0.41163 0.41163 0.33034 1.00000 S4 S 0.74402 0.74402 0.32797 1.00000 S5 S 0.25598 0.25598 0.67203 1.00000 S6 S 0.58837 0.58837 0.66966 1.00000 S7 S 0.66144 0.66144 0.00528 1.00000 S8 S 0.92325 0.92325 0.66431 1.00000