# CIF generated by HEAS from Alexandria entry agm005734331 data_agm005734331 _cell_length_a 5.25581 _cell_length_b 7.61029 _cell_length_c 7.61037 _cell_angle_alpha 135.03612 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 215.10852 _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 H1 H 0.50000 0.09108 0.09108 1.00000 H2 H 1.00000 0.90892 0.90892 1.00000 S1 S 0.91337 0.01790 0.79037 1.00000 S2 S 0.58663 0.20963 0.98210 1.00000 S3 S 0.08663 0.79037 0.01790 1.00000 S4 S 0.41337 0.98209 0.20963 1.00000 Br1 Br 0.25000 0.38660 0.61340 1.00000 Br2 Br 0.75000 0.61340 0.38660 1.00000