# CIF generated by HEAS from Alexandria entry agm005486160 data_agm005486160 _cell_length_a 3.11959 _cell_length_b 3.11959 _cell_length_c 9.03118 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 76.11519 _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 0.33333 0.66667 0.12005 1.00000 Ti2 Ti 0.66667 0.33333 0.87995 1.00000 H1 H 0.66667 0.33333 0.35889 1.00000 H2 H 0.33333 0.66667 0.64111 1.00000 O1 O 0.66667 0.33333 0.24935 1.00000 O2 O 0.33333 0.66667 0.75065 1.00000 O3 O 0.00000 0.00000 0.00000 1.00000