# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JH2' 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 -5.34300 0.76000 0.00400 1.000 O1 O -5.87100 1.60900 0.90900 1.000 C2 C -3.89200 0.52800 -0.02600 1.000 O3 O -6.06800 0.18300 -0.78200 1.000 C4 C -3.38500 -0.41200 -0.81900 1.000 O5 O 5.22000 -0.51100 -1.07900 1.000 C6 C -1.89200 -0.53600 -0.98200 1.000 C7 C -1.35800 -1.58600 -0.00600 1.000 C8 C 0.13500 -1.71000 -0.16900 1.000 C9 C 0.92700 -1.46800 0.84600 1.000 C10 C 2.40700 -1.72100 0.72400 1.000 C11 C 3.11600 -0.42300 0.33100 1.000 C12 C 4.61900 -0.68000 0.20700 1.000 C13 C 5.52100 0.51100 -0.12600 1.000 C14 C 4.85800 1.87700 -0.31200 1.000 C15 C 5.91800 2.91000 -0.70000 1.000 C16 C -4.30400 -1.35400 -1.55400 1.000 C17 C 0.35700 -0.93600 2.13600 1.000 C18 C 6.92600 0.53100 0.47700 1.000 C19 C -7.31200 1.78900 0.88100 1.000 H20 H -3.23800 1.12200 0.59500 1.000 H21 H -1.66200 -0.84000 -2.00300 1.000 H22 H -1.42300 0.42500 -0.77400 1.000 H23 H -1.58800 -1.28300 1.01600 1.000 H24 H -1.82700 -2.54800 -0.21400 1.000 H25 H 0.55200 -1.99900 -1.12200 1.000 H26 H 2.79600 -2.07200 1.68000 1.000 H27 H 2.58500 -2.47700 -0.04000 1.000 H28 H 2.72700 -0.07200 -0.62500 1.000 H29 H 2.93800 0.33400 1.09500 1.000 H30 H 5.02100 -1.45600 0.85700 1.000 H31 H 4.10800 1.81300 -1.10000 1.000 H32 H 4.38000 2.17900 0.62000 1.000 H33 H 5.44600 3.88300 -0.83200 1.000 H34 H 6.66800 2.97400 0.08900 1.000 H35 H 6.39600 2.60800 -1.63200 1.000 H36 H -4.64100 -0.88500 -2.47900 1.000 H37 H -3.77000 -2.27500 -1.78800 1.000 H38 H -5.16600 -1.58300 -0.92800 1.000 H39 H 0.00400 -1.76600 2.74800 1.000 H40 H 1.13000 -0.38900 2.67700 1.000 H41 H -0.47500 -0.26600 1.91700 1.000 H42 H 7.46400 1.40900 0.11800 1.000 H43 H 6.85500 0.56800 1.56400 1.000 H44 H 7.46300 -0.37000 0.17900 1.000 H45 H -7.60500 2.49600 1.65700 1.000 H46 H -7.61100 2.17600 -0.09400 1.000 H47 H -7.80100 0.83200 1.05700 1.000