# CIF generated by HEAS from Alexandria entry agm006239477 data_agm006239477 _cell_length_a 4.87895 _cell_length_b 4.87895 _cell_length_c 4.87895 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 116.13936 _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 I1 I 0.00000 0.00000 0.00000 1.00000 C1 C 0.23694 0.00000 0.50000 1.00000 C2 C 0.76306 0.00000 0.50000 1.00000 C3 C 0.00000 0.50000 0.23694 1.00000 C4 C 0.00000 0.50000 0.76306 1.00000 C5 C 0.50000 0.23694 0.00000 1.00000 C6 C 0.50000 0.76306 0.00000 1.00000 B1 B 0.25880 0.50000 0.00000 1.00000 B2 B 0.74120 0.50000 0.00000 1.00000 B3 B 0.50000 0.00000 0.25880 1.00000 B4 B 0.50000 0.00000 0.74120 1.00000 B5 B 0.00000 0.25880 0.50000 1.00000 B6 B 0.00000 0.74120 0.50000 1.00000 Cl1 Cl 0.50000 0.50000 0.50000 1.00000