# CIF generated by HEAS from Alexandria entry agm005697409 data_agm005697409 _cell_length_a 3.56638 _cell_length_b 7.49453 _cell_length_c 7.62131 _cell_angle_alpha 120.88814 _cell_angle_beta 90.00000 _cell_angle_gamma 103.76454 _cell_volume 167.96073 _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 Ti1 Ti 0.89007 0.78014 0.47756 1.00000 I1 I 0.54136 0.08271 0.77563 1.00000 I2 I 0.39730 0.79461 0.19995 1.00000 Br1 Br 0.25244 0.50488 0.45999 1.00000