# CIF generated by HEAS from Alexandria entry agm006190819 data_agm006190819 _cell_length_a 4.57292 _cell_length_b 4.57292 _cell_length_c 6.17681 _cell_angle_alpha 89.99998 _cell_angle_beta 90.00002 _cell_angle_gamma 120.00002 _cell_volume 111.86186 _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 0.81586 1.00000 Ti2 Ti 0.66667 0.33333 0.18414 1.00000 Nb1 Nb 0.33333 0.66667 0.35510 1.00000 Nb2 Nb 0.00000 1.00000 0.00000 1.00000 Nb3 Nb 0.66667 0.33333 0.64490 1.00000 H1 H 0.83921 0.67842 0.38359 1.00000 H2 H 0.83921 0.16079 0.38360 1.00000 H3 H 0.50000 0.00000 0.00000 1.00000 H4 H 0.16079 0.83921 0.61641 1.00000 H5 H 0.67842 0.83921 0.61641 1.00000 H6 H 0.32158 0.16079 0.38359 1.00000 H7 H 0.16079 0.32158 0.61641 1.00000 H8 H 0.00000 0.50000 0.00000 1.00000 H9 H 0.50000 0.50000 0.00000 1.00000