# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CH7' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 2.07800 1.77600 -0.03400 1.000 C1 C 2.03700 0.67100 0.62000 1.000 C2 C 2.92700 0.25900 1.76000 1.000 C3 C 3.75700 1.41500 2.28300 1.000 C4 C 4.23800 2.26100 1.11900 1.000 C5 C 3.03600 2.80800 0.36300 1.000 C6 C 1.03200 -0.33100 0.17100 1.000 N7 N 1.29900 -1.20100 -0.75200 1.000 O8 O 3.62600 -5.01100 -5.32800 1.000 C9 C 0.96000 -2.94100 -3.91700 1.000 C10 C 1.88700 -3.45600 -4.82300 1.000 C11 C 2.72100 -4.50800 -4.44500 1.000 C12 C 2.62800 -5.04500 -3.16100 1.000 C13 C 1.70000 -4.53000 -2.25500 1.000 C14 C 0.85300 -3.47100 -2.62000 1.000 C15 C -0.10100 -2.94100 -1.68900 1.000 C16 C 0.13100 -1.91900 -0.86300 1.000 C17 C -0.88600 -1.39800 0.09000 1.000 O18 O -2.02000 -1.81100 0.24100 1.000 N19 N -0.21400 -0.37600 0.71100 1.000 C20 C -0.73600 0.49400 1.74900 1.000 C21 C -1.35700 1.69300 1.10200 1.000 O22 O -1.90100 1.72800 0.00800 1.000 O23 O -1.23400 2.77400 1.91500 1.000 H24 H 2.31900 -0.16800 2.56400 1.000 H25 H 3.58600 -0.53400 1.38600 1.000 H26 H 3.15300 2.02900 2.96200 1.000 H27 H 4.60700 1.03600 2.86200 1.000 H28 H 4.85700 3.08800 1.48100 1.000 H29 H 4.86100 1.65600 0.44800 1.000 H30 H 2.51400 3.55600 0.97200 1.000 H31 H 3.38800 3.32200 -0.53800 1.000 H32 H 3.36900 -4.78500 -6.23700 1.000 H33 H 0.31600 -2.12100 -4.22700 1.000 H34 H 1.95500 -3.03400 -5.82200 1.000 H35 H 3.27500 -5.86500 -2.86000 1.000 H36 H 1.63900 -4.95900 -1.25800 1.000 H37 H -1.09500 -3.38800 -1.67300 1.000 H38 H 0.08800 0.81000 2.39500 1.000 H39 H -1.48900 -0.04900 2.32600 1.000 H40 H -1.63300 3.57800 1.51800 1.000