# CIF generated by HEAS from Alexandria entry agm005504362 data_agm005504362 _cell_length_a 8.21621 _cell_length_b 8.21621 _cell_length_c 2.81649 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 164.65752 _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 0.33333 0.66667 0.00000 1.00000 Ba2 Ba 0.66667 0.33333 0.00000 1.00000 Ba3 Ba 0.00000 0.00000 0.50000 1.00000 C1 C 0.30087 0.00000 0.00000 1.00000 C2 C 0.00000 0.30087 0.00000 1.00000 C3 C 0.69913 0.69913 0.00000 1.00000 C4 C 0.36085 0.00000 0.50000 1.00000 C5 C 0.00000 0.36085 0.50000 1.00000 C6 C 0.63915 0.63915 0.50000 1.00000