# CIF generated by HEAS from Alexandria entry agm006114540 data_agm006114540 _cell_length_a 3.41696 _cell_length_b 8.86879 _cell_length_c 8.99892 _cell_angle_alpha 105.02581 _cell_angle_beta 100.94425 _cell_angle_gamma 90.00000 _cell_volume 258.24271 _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 Na1 Na 0.49830 0.49809 0.99660 1.00000 Ti1 Ti 0.29185 0.64926 0.58370 1.00000 Ti2 Ti 0.70834 0.35125 0.41667 1.00000 Ti3 Ti 0.33930 0.01088 0.67860 1.00000 Ti4 Ti 0.66090 0.98936 0.32181 1.00000 Ti5 Ti 0.00020 0.99998 0.00040 1.00000 S1 S 0.24274 0.16935 0.48547 1.00000 S2 S 0.75751 0.83101 0.51502 1.00000 S3 S 0.15909 0.49474 0.31817 1.00000 S4 S 0.84119 0.50568 0.68238 1.00000 S5 S 0.08476 0.81868 0.16952 1.00000 S6 S 0.91558 0.18151 0.83116 1.00000 S7 S 0.42317 0.83547 0.84635 1.00000 S8 S 0.57708 0.16475 0.15416 1.00000