# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JHJ' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C 0.81700 0.71900 0.09000 1.000 N1 N 2.05600 1.18400 0.34400 1.000 C2 C 3.16500 0.36100 0.14400 1.000 C3 C 5.46500 0.04900 -0.42800 1.000 C4 C 4.19400 -1.79700 0.12300 1.000 C5 C -5.52200 -1.97800 -0.03400 1.000 C6 C -4.09800 -0.07600 -0.12100 1.000 C7 C -3.06000 -0.90600 0.27500 1.000 C8 C -1.78800 -0.39300 0.44000 1.000 C9 C -1.54900 0.95500 0.20900 1.000 C10 C -2.58900 1.78600 -0.18800 1.000 C11 C -3.85900 1.27100 -0.35200 1.000 C12 C 4.39300 0.89600 -0.24100 1.000 C13 C 3.07500 -1.01800 0.33100 1.000 N14 N -0.26000 1.47700 0.37700 1.000 N15 N 5.33800 -1.25200 -0.24700 1.000 O16 O -5.34800 -0.58300 -0.28900 1.000 O17 O 0.67000 -0.38400 -0.40100 1.000 H18 H 2.17700 2.09100 0.66600 1.000 H19 H 6.42000 0.45500 -0.72700 1.000 H20 H 4.13300 -2.86600 0.26100 1.000 H21 H -6.56300 -2.25200 -0.20400 1.000 H22 H -4.88000 -2.55300 -0.70200 1.000 H23 H -5.25400 -2.19400 1.00100 1.000 H24 H -3.24600 -1.95500 0.45500 1.000 H25 H -0.98100 -1.03900 0.74900 1.000 H26 H -2.40300 2.83500 -0.36800 1.000 H27 H -4.66700 1.91700 -0.66500 1.000 H28 H 4.50300 1.96000 -0.39200 1.000 H29 H 2.14200 -1.47000 0.63300 1.000 H30 H -0.14200 2.38500 0.69800 1.000