# CIF generated by HEAS from Alexandria entry agm005759946 data_agm005759946 _cell_length_a 3.86795 _cell_length_b 4.23832 _cell_length_c 17.27604 _cell_angle_alpha 89.99983 _cell_angle_beta 44.89781 _cell_angle_gamma 90.00012 _cell_volume 199.90684 _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 Tl1 Tl 0.58986 0.25000 0.39047 1.00000 Tl2 Tl 0.41014 0.75000 0.60953 1.00000 H1 H 0.65963 0.97621 0.14456 1.00000 H2 H 0.34037 0.02379 0.85544 1.00000 H3 H 0.65963 0.52379 0.14456 1.00000 H4 H 0.34037 0.47621 0.85544 1.00000 H5 H 0.73923 0.25000 0.50472 1.00000 H6 H 0.26077 0.75000 0.49528 1.00000 S1 S 0.01142 0.25000 0.88958 1.00000 S2 S 0.98858 0.75000 0.11042 1.00000