# CIF generated by HEAS from Alexandria entry agm005997261 data_agm005997261 _cell_length_a 8.56731 _cell_length_b 8.56731 _cell_length_c 8.56731 _cell_angle_alpha 68.75478 _cell_angle_beta 68.75478 _cell_angle_gamma 68.75479 _cell_volume 526.58539 _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 0.06019 0.48509 0.69776 1.00000 Ba2 Ba 0.30224 0.93981 0.51491 1.00000 Ba3 Ba 0.51491 0.30224 0.93981 1.00000 Ba4 Ba 0.48509 0.69776 0.06019 1.00000 Ba5 Ba 0.69776 0.06019 0.48509 1.00000 Ba6 Ba 0.93981 0.51491 0.30224 1.00000 Pa1 Pa 0.00000 0.00000 0.00000 1.00000 Se1 Se 0.16841 0.67544 0.90504 1.00000 Se2 Se 0.09496 0.83159 0.32455 1.00000 Se3 Se 0.32455 0.09496 0.83159 1.00000 Se4 Se 0.65941 0.65941 0.65941 1.00000 Se5 Se 0.34059 0.34059 0.34059 1.00000 Se6 Se 0.67545 0.90504 0.16841 1.00000 Se7 Se 0.90504 0.16841 0.67544 1.00000 Se8 Se 0.83159 0.32456 0.09496 1.00000