# CIF generated by HEAS from Alexandria entry agm005014534 data_agm005014534 _cell_length_a 4.90217 _cell_length_b 7.67580 _cell_length_c 5.98812 _cell_angle_alpha 99.88115 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 221.97898 _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 0.75000 0.27053 0.69250 1.00000 Ba2 Ba 0.25000 0.72947 0.30750 1.00000 C1 C 0.25000 0.02437 0.81103 1.00000 C2 C 0.75000 0.97563 0.18897 1.00000 N1 N 0.75000 0.01776 0.99606 1.00000 N2 N 0.25000 0.98224 0.00394 1.00000 N3 N 0.25000 0.07148 0.62629 1.00000 N4 N 0.75000 0.92852 0.37371 1.00000 Cl1 Cl 0.75000 0.45708 0.23945 1.00000 Cl2 Cl 0.25000 0.54292 0.76055 1.00000