# CIF generated by HEAS from Alexandria entry agm003735530 data_agm003735530 _cell_length_a 7.03152 _cell_length_b 8.35734 _cell_length_c 11.41716 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 126.90095 _cell_volume 536.52379 _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 0.98054 0.63034 0.75000 1.00000 Ba2 Ba 0.01946 0.36966 0.25000 1.00000 Cu1 Cu 0.97901 0.11132 0.75000 1.00000 Cu2 Cu 0.02099 0.88868 0.25000 1.00000 I1 I 0.58368 0.76385 0.75000 1.00000 I2 I 0.41632 0.23615 0.25000 1.00000 I3 I 0.37562 0.16312 0.75000 1.00000 I4 I 0.62438 0.83688 0.25000 1.00000 I5 I 0.02331 0.70906 0.06185 1.00000 I6 I 0.97669 0.29094 0.56185 1.00000 I7 I 0.02331 0.70906 0.43815 1.00000 I8 I 0.97669 0.29094 0.93815 1.00000