# CIF generated by HEAS from Alexandria entry agm004049385 data_agm004049385 _cell_length_a 6.21417 _cell_length_b 6.21428 _cell_length_c 3.77487 _cell_angle_alpha 72.31668 _cell_angle_beta 72.31997 _cell_angle_gamma 35.36335 _cell_volume 79.96566 _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 Ba1 Ba 0.00005 0.00005 0.99995 1.00000 Hg1 Hg 0.71572 0.71572 0.28428 1.00000 Ru1 Ru 0.28423 0.28423 0.71577 1.00000