# CIF generated by HEAS from Alexandria entry agm005996775 data_agm005996775 _cell_length_a 8.88845 _cell_length_b 8.88845 _cell_length_c 9.82013 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 114.18705 _cell_volume 707.72686 _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 0.00000 0.50000 0.25448 1.00000 Ba2 Ba 0.50000 0.50000 0.00000 1.00000 Ba3 Ba 0.50000 0.00000 0.74552 1.00000 Sn1 Sn 0.50000 0.50000 0.50000 1.00000 I1 I 0.71568 0.28432 0.50000 1.00000 I2 I 0.73253 0.26747 0.00000 1.00000 I3 I 0.72022 0.75257 0.73347 1.00000 I4 I 0.75257 0.72022 0.26653 1.00000 I5 I 0.24743 0.27978 0.26653 1.00000 I6 I 0.27978 0.24743 0.73347 1.00000 I7 I 0.26747 0.73253 0.00000 1.00000 I8 I 0.28432 0.71568 0.50000 1.00000