# CIF generated by HEAS from Alexandria entry agm005255259 data_agm005255259 _cell_length_a 6.44990 _cell_length_b 6.44990 _cell_length_c 7.65972 _cell_angle_alpha 80.21160 _cell_angle_beta 80.21160 _cell_angle_gamma 120.73947 _cell_volume 257.18027 _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 Nb1 Nb 0.12967 0.87033 0.00000 1.00000 Nb2 Nb 0.87033 0.12967 0.00000 1.00000 S1 S 0.85752 0.85752 0.28343 1.00000 S2 S 0.14248 0.14248 0.71657 1.00000 S3 S 0.33711 0.33711 0.87575 1.00000 S4 S 0.66289 0.66289 0.12425 1.00000 Cl1 Cl 0.43149 0.01710 0.20143 1.00000 Cl2 Cl 0.98290 0.56851 0.79857 1.00000 Cl3 Cl 0.56851 0.98290 0.79857 1.00000 Cl4 Cl 0.01710 0.43149 0.20143 1.00000