# CIF generated by HEAS from Alexandria entry agm004045950 data_agm004045950 _cell_length_a 4.57920 _cell_length_b 5.46467 _cell_length_c 6.23577 _cell_angle_alpha 63.94021 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 140.17876 _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 Be1 Be 0.00000 0.65758 0.56144 1.00000 Hg1 Hg 0.50000 0.59044 0.69311 1.00000 Ba1 Ba 0.00000 0.97365 0.92776 1.00000 Ba2 Ba 0.50000 0.27832 0.31770 1.00000