# CIF generated by HEAS from Alexandria entry agm005487162 data_agm005487162 _cell_length_a 6.22474 _cell_length_b 6.22474 _cell_length_c 6.22474 _cell_angle_alpha 100.30485 _cell_angle_beta 100.30485 _cell_angle_gamma 129.95822 _cell_volume 167.52742 _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 0.50000 0.50000 0.00000 1.00000 Fe1 Fe 0.25000 0.75000 0.50000 1.00000 Fe2 Fe 0.75000 0.25000 0.50000 1.00000 Se1 Se 0.29987 0.11708 0.41695 1.00000 Se2 Se 0.70013 0.88292 0.58305 1.00000 Se3 Se 0.88292 0.29987 0.18279 1.00000 Se4 Se 0.11708 0.70013 0.81721 1.00000