# CIF generated by HEAS from Alexandria entry agm064791663 data_agm064791663 _cell_length_a 10.06293 _cell_length_b 10.06293 _cell_length_c 10.06293 _cell_angle_alpha 60.00000 _cell_angle_beta 60.00000 _cell_angle_gamma 60.00000 _cell_volume 720.54042 _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 Ba1 Ba 0.50000 0.50000 0.50000 1.00000 Tl1 Tl 0.00000 0.50000 0.00000 1.00000 Tl2 Tl 0.00000 0.00000 0.50000 1.00000 Tl3 Tl 0.00000 0.50000 0.50000 1.00000 Tl4 Tl 0.50000 0.00000 0.50000 1.00000 Tl5 Tl 0.50000 0.50000 0.00000 1.00000 Tl6 Tl 0.50000 0.00000 0.00000 1.00000 I1 I 0.25000 0.25000 0.25000 1.00000 I2 I 0.75000 0.75000 0.75000 1.00000 I3 I 0.25664 0.74336 0.25664 1.00000 I4 I 0.74336 0.25664 0.74336 1.00000 I5 I 0.25664 0.25664 0.74336 1.00000 I6 I 0.74336 0.74336 0.25664 1.00000 I7 I 0.25664 0.74336 0.74336 1.00000 I8 I 0.74336 0.25664 0.25664 1.00000