# CIF generated by HEAS from Alexandria entry agm005124394 data_agm005124394 _cell_length_a 4.04352 _cell_length_b 4.04352 _cell_length_c 8.57070 _cell_angle_alpha 76.35578 _cell_angle_beta 76.35578 _cell_angle_gamma 60.00000 _cell_volume 116.76895 _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 Th1 Th 0.05692 0.05692 0.82925 1.00000 Th2 Th 0.27678 0.27678 0.16965 1.00000 Fe1 Fe 0.66782 0.66782 0.99653 1.00000 I1 I 0.49847 0.49847 0.50458 1.00000