# CIF generated by HEAS from Alexandria entry agm003201554 data_agm003201554 _cell_length_a 3.37921 _cell_length_b 3.96096 _cell_length_c 9.16487 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 122.67078 _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 0.50000 0.91849 1.00000 Ti2 Ti 0.50000 0.00000 0.08151 1.00000 Br1 Br 0.50000 0.50000 0.70014 1.00000 Br2 Br 0.00000 0.00000 0.29986 1.00000 N1 N 0.00000 0.00000 0.96197 1.00000 N2 N 0.50000 0.50000 0.03803 1.00000