# CIF generated by HEAS from Alexandria entry agm005696579 data_agm005696579 _cell_length_a 5.08031 _cell_length_b 8.14472 _cell_length_c 10.99054 _cell_angle_alpha 111.74856 _cell_angle_beta 103.36312 _cell_angle_gamma 90.00000 _cell_volume 409.10631 _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 0.50000 0.25000 0.00000 1.00000 Tl2 Tl 0.50000 0.75000 0.00000 1.00000 Tl3 Tl 0.18502 0.43502 0.37005 1.00000 Tl4 Tl 0.81498 0.06498 0.62995 1.00000 Tl5 Tl 0.81498 0.56498 0.62995 1.00000 Tl6 Tl 0.18502 0.93502 0.37005 1.00000 Cu1 Cu 0.00000 0.50000 0.00000 1.00000 Cu2 Cu 0.00000 0.00000 0.00000 1.00000 S1 S 0.28043 0.59766 0.19532 1.00000 S2 S 0.08511 0.90234 0.80468 1.00000 S3 S 0.91489 0.09766 0.19532 1.00000 S4 S 0.71957 0.40234 0.80468 1.00000