# CIF generated by HEAS from Alexandria entry agm005113993 data_agm005113993 _cell_length_a 4.41575 _cell_length_b 4.41575 _cell_length_c 8.00089 _cell_angle_alpha 73.98114 _cell_angle_beta 73.98114 _cell_angle_gamma 60.00000 _cell_volume 128.06471 _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 Ac1 Ac 0.66648 0.66648 0.00056 1.00000 Tl1 Tl 0.49404 0.49404 0.51787 1.00000 S1 S 0.07261 0.07261 0.78217 1.00000 S2 S 0.26687 0.26687 0.19939 1.00000