# CIF generated by HEAS from Alexandria entry agm005178249 data_agm005178249 _cell_length_a 5.41841 _cell_length_b 7.89435 _cell_length_c 9.14442 _cell_angle_alpha 115.57221 _cell_angle_beta 107.23362 _cell_angle_gamma 90.00000 _cell_volume 333.26074 _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 0.21007 0.21007 0.42013 1.00000 Ba2 Ba 0.78993 0.78993 0.57987 1.00000 Pa1 Pa 0.50000 0.00000 0.00000 1.00000 Tl1 Tl 0.00000 0.50000 0.00000 1.00000 Se1 Se 0.63093 0.89300 0.26185 1.00000 Se2 Se 0.36907 0.10700 0.73815 1.00000 Se3 Se 0.36907 0.63115 0.73815 1.00000 Se4 Se 0.63093 0.36885 0.26185 1.00000 Se5 Se 0.00000 0.00000 0.00000 1.00000