# CIF generated by HEAS from Alexandria entry agm004836637 data_agm004836637 _cell_length_a 4.69392 _cell_length_b 8.26509 _cell_length_c 9.71927 _cell_angle_alpha 105.90091 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 362.63838 _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 0.25120 0.23524 1.00000 Ba2 Ba 0.50000 0.74880 0.76476 1.00000 Ba3 Ba 0.00000 0.26248 0.77061 1.00000 Ba4 Ba 0.00000 0.73752 0.22939 1.00000 Tl1 Tl 0.00000 0.00000 0.00000 1.00000 Ga1 Ga 0.50000 0.50000 0.00000 1.00000 I1 I 0.50000 0.00000 0.50000 1.00000 I2 I 0.00000 0.50000 0.50000 1.00000