# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '047' 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 8.01000 -5.20000 -0.61400 1.000 C1 C 8.93700 -4.32900 -1.14100 1.000 C2 C 8.23700 -3.40800 -1.92400 1.000 C3 C 6.87800 -3.76900 -1.83600 1.000 C4 C 6.75200 -4.86300 -1.03500 1.000 C5 C 5.73900 -3.06500 -2.51500 1.000 N6 N 5.46800 -3.61800 -3.84900 1.000 C7 C 4.42300 -2.91900 -4.51700 1.000 C8 C 4.19400 -3.53000 -5.89900 1.000 C9 C 5.46600 -3.43200 -6.75200 1.000 C10 C 5.24600 -3.98800 -8.15700 1.000 C11 C 4.06300 -3.31800 -8.84900 1.000 C12 C 2.79500 -3.41000 -8.00700 1.000 C13 C 3.01000 -2.85200 -6.60200 1.000 C14 C 8.95700 -2.39400 -2.58500 1.000 C15 C 10.34800 -2.33900 -2.44000 1.000 C16 C 11.02000 -3.27100 -1.65300 1.000 C17 C 10.32700 -4.28600 -0.98700 1.000 C18 C 8.29100 -6.27900 0.22900 1.000 C19 C 7.34400 -6.68100 1.16100 1.000 C20 C 7.62400 -7.75700 2.00300 1.000 C21 C 8.84700 -8.42000 1.90400 1.000 C22 C 9.79100 -8.00700 0.96400 1.000 C23 C 9.51100 -6.93000 0.12200 1.000 C24 C 9.14500 -9.57200 2.80300 1.000 H25 H 5.88500 -5.43300 -0.72600 1.000 H26 H 4.82200 -3.15200 -1.92200 1.000 H27 H 5.95100 -1.99700 -2.63300 1.000 H28 H 5.22900 -4.61400 -3.73200 1.000 H29 H 3.50900 -3.00500 -3.94400 1.000 H30 H 4.70300 -1.88100 -4.63400 1.000 H31 H 3.95200 -4.59100 -5.75500 1.000 H32 H 6.28200 -3.98100 -6.26800 1.000 H33 H 5.78500 -2.38400 -6.82300 1.000 H34 H 5.07000 -5.07000 -8.09800 1.000 H35 H 6.15200 -3.84600 -8.75600 1.000 H36 H 4.30000 -2.26400 -9.03900 1.000 H37 H 3.89300 -3.78700 -9.82500 1.000 H38 H 1.98500 -2.86100 -8.50000 1.000 H39 H 2.47700 -4.45700 -7.93800 1.000 H40 H 3.18600 -1.77000 -6.66500 1.000 H41 H 2.09700 -2.99200 -6.01100 1.000 H42 H 8.44700 -1.65900 -3.20200 1.000 H43 H 10.90900 -1.55800 -2.94800 1.000 H44 H 12.10100 -3.20900 -1.55400 1.000 H45 H 10.85900 -5.00800 -0.37500 1.000 H46 H 6.38600 -6.17400 1.24700 1.000 H47 H 6.88300 -8.07200 2.73200 1.000 H48 H 10.74600 -8.51800 0.87900 1.000 H49 H 10.25500 -6.61900 -0.60700 1.000 H50 H 10.22000 -9.62300 3.01600 1.000 H51 H 8.60600 -9.48400 3.75600 1.000 H52 H 8.83500 -10.52300 2.35000 1.000