# CIF generated by HEAS from Alexandria entry agm005641685 data_agm005641685 _cell_length_a 3.02201 _cell_length_b 4.27803 _cell_length_c 5.24495 _cell_angle_alpha 114.06821 _cell_angle_beta 106.70034 _cell_angle_gamma 89.99998 _cell_volume 58.76638 _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 0.50000 0.50000 0.00000 1.00000 Ti2 Ti 0.16416 0.16460 0.32920 1.00000 Ti3 Ti 0.83584 0.83540 0.67080 1.00000 C1 C 0.50000 0.00000 0.00000 1.00000 N1 N 0.16566 0.66601 0.33202 1.00000 N2 N 0.83434 0.33399 0.66798 1.00000