# CIF generated by HEAS from Alexandria entry agm005406813 data_agm005406813 _cell_length_a 5.80272 _cell_length_b 3.84348 _cell_length_c 6.81781 _cell_angle_alpha 90.00000 _cell_angle_beta 105.92363 _cell_angle_gamma 90.00000 _cell_volume 146.22057 _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 Cu1 Cu 0.56211 0.00000 0.04613 1.00000 Cu2 Cu 0.56211 0.50000 0.54613 1.00000 S1 S 0.49788 0.00000 0.36080 1.00000 S2 S 0.49788 0.50000 0.86080 1.00000 I1 I 0.01187 0.00000 0.31127 1.00000 I2 I 0.01187 0.50000 0.81127 1.00000