# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '97N' 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 11.05100 -3.16800 -0.33800 1.000 O1 O -4.91800 1.29000 0.65500 1.000 C2 C 9.62200 -2.86000 0.11500 1.000 O3 O -5.87600 -0.47400 -0.26900 1.000 C4 C 9.34400 -1.36500 -0.05900 1.000 O5 O -8.04200 -2.24000 0.45400 1.000 C6 C 7.91600 -1.05600 0.39400 1.000 O7 O -10.65400 -1.27300 -0.25200 1.000 C8 C 7.63800 0.43800 0.22100 1.000 C9 C 6.20900 0.74700 0.67300 1.000 C10 C 5.93600 2.21900 0.50200 1.000 C11 C 4.87800 2.61600 -0.16100 1.000 C12 C 3.84700 1.61100 -0.60700 1.000 C13 C 2.46600 2.04400 -0.11100 1.000 C14 C 1.41900 1.02400 -0.56400 1.000 C15 C 0.03800 1.45600 -0.06800 1.000 C16 C -1.00900 0.43600 -0.52000 1.000 C17 C -2.39000 0.86800 -0.02500 1.000 C18 C -3.43700 -0.15200 -0.47700 1.000 C19 C -4.79800 0.27400 0.01100 1.000 C20 C -7.15400 -0.00300 0.23300 1.000 C21 C -8.25700 -0.97900 -0.18300 1.000 C22 C -9.61800 -0.42000 0.23800 1.000 H23 H 11.75500 -2.59500 0.26500 1.000 H24 H 11.24900 -4.23300 -0.21400 1.000 H25 H 11.16600 -2.89700 -1.38700 1.000 H26 H 8.91800 -3.43200 -0.48800 1.000 H27 H 9.50700 -3.13100 1.16400 1.000 H28 H 10.04900 -0.79200 0.54500 1.000 H29 H 9.46000 -1.09300 -1.10800 1.000 H30 H -8.04700 -2.19800 1.42000 1.000 H31 H 7.21200 -1.62900 -0.20900 1.000 H32 H 7.80000 -1.32800 1.44300 1.000 H33 H -11.54700 -0.97900 -0.02300 1.000 H34 H 8.34200 1.01100 0.82400 1.000 H35 H 7.75300 0.71000 -0.82900 1.000 H36 H 5.50500 0.17400 0.07000 1.000 H37 H 6.09400 0.47600 1.72200 1.000 H38 H 6.61100 2.94700 0.92700 1.000 H39 H 4.74500 3.66300 -0.38900 1.000 H40 H 3.84100 1.55500 -1.69500 1.000 H41 H 4.09100 0.63300 -0.19400 1.000 H42 H 2.47100 2.10000 0.97700 1.000 H43 H 2.22100 3.02300 -0.52400 1.000 H44 H 1.41300 0.96700 -1.65200 1.000 H45 H 1.66300 0.04500 -0.15000 1.000 H46 H 0.04300 1.51300 1.02000 1.000 H47 H -0.20600 2.43500 -0.48100 1.000 H48 H -1.01500 0.38000 -1.60900 1.000 H49 H -0.76500 -0.54300 -0.10700 1.000 H50 H -2.38500 0.92500 1.06400 1.000 H51 H -2.63500 1.84700 -0.43800 1.000 H52 H -3.44300 -0.20800 -1.56600 1.000 H53 H -3.19300 -1.13000 -0.06400 1.000 H54 H -7.11600 0.06000 1.32000 1.000 H55 H -7.36600 0.98300 -0.18100 1.000 H56 H -8.23600 -1.11000 -1.26500 1.000 H57 H -9.74300 0.58000 -0.17700 1.000 H58 H -9.67000 -0.37200 1.32500 1.000