# CIF generated by HEAS from Alexandria entry agm006019983 data_agm006019983 _cell_length_a 8.75699 _cell_length_b 8.75703 _cell_length_c 8.75705 _cell_angle_alpha 109.47139 _cell_angle_beta 109.47113 _cell_angle_gamma 109.47117 _cell_volume 516.94886 _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 0.00000 0.50000 0.00000 1.00000 Tl2 Tl 0.00000 0.00000 0.50000 1.00000 Tl3 Tl 0.50000 0.00000 0.00000 1.00000 Tl4 Tl 0.50000 0.50000 0.50000 1.00000 S1 S 0.72626 0.13049 0.59576 1.00000 S2 S 0.86951 0.40424 0.27374 1.00000 S3 S 0.40424 0.53473 0.13049 1.00000 S4 S 0.13049 0.40424 0.53473 1.00000 S5 S 0.59576 0.46527 0.86951 1.00000 S6 S 0.13049 0.59576 0.72626 1.00000 S7 S 0.59576 0.72626 0.13049 1.00000 S8 S 0.40424 0.27374 0.86951 1.00000 S9 S 0.86951 0.59576 0.46527 1.00000 S10 S 0.53473 0.13049 0.40424 1.00000 S11 S 0.46527 0.86951 0.59576 1.00000 S12 S 0.27374 0.86951 0.40424 1.00000 Br1 Br 0.00000 0.00000 0.00000 1.00000