# CIF generated by HEAS from Alexandria entry agm003661340 data_agm003661340 _cell_length_a 5.98657 _cell_length_b 5.98657 _cell_length_c 5.98657 _cell_angle_alpha 114.49086 _cell_angle_beta 107.02123 _cell_angle_gamma 107.02123 _cell_volume 164.20329 _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 0.00000 0.00000 0.00000 1.00000 Cu1 Cu 0.00000 0.78907 0.36366 1.00000 Cu2 Cu 0.00000 0.36366 0.78907 1.00000 Cu3 Cu 0.57459 0.21093 0.21093 1.00000 Cu4 Cu 0.50000 0.00000 0.50000 1.00000 Cu5 Cu 0.42541 0.63634 0.63634 1.00000 Cu6 Cu 0.50000 0.50000 0.00000 1.00000 O1 O 1.00000 0.12679 0.47767 1.00000 O2 O 0.64912 0.52233 0.52233 1.00000 O3 O 1.00000 0.47767 0.12679 1.00000 O4 O 0.35088 0.87321 0.87321 1.00000