# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C15' 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 1.14900 -7.55900 -4.57900 1.000 C1 C 2.07600 -6.44500 -5.04500 1.000 C2 C 3.45100 -6.94200 -5.46900 1.000 C3 C -3.31900 3.99700 -3.98900 1.000 C4 C -1.96200 3.31000 -3.99200 1.000 C5 C -1.84300 2.31000 -5.14200 1.000 C6 C -0.46600 1.64600 -5.16100 1.000 N7 N 4.32900 -5.77300 -5.93800 1.000 C8 C 4.42200 -4.75800 -4.78900 1.000 C9 C 5.74000 -6.31600 -6.20700 1.000 C10 C -0.35900 0.62100 -6.29200 1.000 C11 C 1.03300 -0.01400 -6.33400 1.000 C12 C 1.21900 -0.99700 -7.49400 1.000 C13 C 2.60300 -1.65100 -7.52100 1.000 C14 C 2.74100 -2.60000 -8.71400 1.000 C15 C 4.13800 -3.21600 -8.84400 1.000 C16 C 4.64300 -3.98800 -7.61900 1.000 C17 C 3.76400 -5.14300 -7.15400 1.000 S18 S -0.41800 -6.91800 -4.07500 1.000 O19 O -1.03100 -6.23700 -5.20000 1.000 O20 O -0.26400 -6.26900 -2.78600 1.000 O21 O -1.17000 -8.34900 -3.85400 1.000 H22 H 1.56600 -8.08900 -3.71800 1.000 H23 H 0.94500 -8.28000 -5.37500 1.000 H24 H 2.20700 -5.72200 -4.23000 1.000 H25 H 1.60600 -5.89400 -5.87000 1.000 H26 H 3.39500 -7.65500 -6.29800 1.000 H27 H 3.97400 -7.40600 -4.62800 1.000 H28 H -4.12700 3.26800 -3.87600 1.000 H29 H -3.48100 4.54800 -4.92100 1.000 H30 H -3.38300 4.70700 -3.15900 1.000 H31 H -1.81800 2.79600 -3.03500 1.000 H32 H -1.17500 4.06900 -4.07500 1.000 H33 H -2.62000 1.54200 -5.04200 1.000 H34 H -2.01700 2.82400 -6.09500 1.000 H35 H 0.30900 2.41300 -5.28500 1.000 H36 H -0.28200 1.15200 -4.20000 1.000 H37 H 3.81000 -3.89500 -5.05500 1.000 H38 H 4.04700 -5.24200 -3.88500 1.000 H39 H 5.47100 -4.47600 -4.67600 1.000 H40 H 5.69700 -6.92200 -7.11400 1.000 H41 H 6.40800 -5.46200 -6.33700 1.000 H42 H 6.03600 -6.91800 -5.34600 1.000 H43 H -1.12100 -0.15300 -6.14600 1.000 H44 H -0.56900 1.10900 -7.25100 1.000 H45 H 1.23800 -0.52300 -5.38400 1.000 H46 H 1.78500 0.77800 -6.43500 1.000 H47 H 1.06300 -0.45000 -8.43200 1.000 H48 H 0.44400 -1.77200 -7.44700 1.000 H49 H 2.76500 -2.20700 -6.59200 1.000 H50 H 3.37600 -0.87500 -7.57800 1.000 H51 H 1.98500 -3.39100 -8.65000 1.000 H52 H 2.52900 -2.04800 -9.63800 1.000 H53 H 4.14600 -3.87800 -9.71900 1.000 H54 H 4.85700 -2.41800 -9.06600 1.000 H55 H 5.64600 -4.37100 -7.84800 1.000 H56 H 4.77500 -3.29200 -6.78200 1.000 H57 H 2.76700 -4.78300 -6.88400 1.000 H58 H 3.66400 -5.92800 -7.90800 1.000 H59 H -1.37900 -8.84800 -4.67800 1.000