# CIF generated by HEAS from Alexandria entry agm005690508 data_agm005690508 _cell_length_a 6.17801 _cell_length_b 7.77474 _cell_length_c 7.42105 _cell_angle_alpha 50.15884 _cell_angle_beta 61.60925 _cell_angle_gamma 62.02155 _cell_volume 233.52283 _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 0.00000 0.00000 1.00000 S1 S 0.93488 0.28937 0.54146 1.00000 S2 S 0.24621 0.26772 0.56958 1.00000 S3 S 0.06512 0.71063 0.45854 1.00000 S4 S 0.55270 0.13273 0.94186 1.00000 S5 S 0.75379 0.73228 0.43042 1.00000 S6 S 0.44730 0.86727 0.05814 1.00000 Cl1 Cl 0.15255 0.70710 0.93941 1.00000 Cl2 Cl 0.84745 0.29290 0.06059 1.00000