# CIF generated by HEAS from Alexandria entry agm005652804 data_agm005652804 _cell_length_a 3.40639 _cell_length_b 3.40639 _cell_length_c 26.09616 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 262.23796 _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 0.00000 0.00000 0.27064 1.00000 Ti2 Ti 0.00000 0.00000 0.72936 1.00000 Ti3 Ti 0.66667 0.33333 0.00000 1.00000 Br1 Br 0.66667 0.33333 0.33615 1.00000 Br2 Br 0.66667 0.33333 0.79484 1.00000 Br3 Br 0.66667 0.33333 0.20516 1.00000 Br4 Br 0.66667 0.33333 0.66385 1.00000 Cl1 Cl 0.00000 0.00000 0.94058 1.00000 Cl2 Cl 0.00000 0.00000 0.05942 1.00000