# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C7K' 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 -5.66400 -1.13700 0.00100 1.000 C1 C -7.01900 -0.53100 0.00100 1.000 C2 C -4.51000 -0.24600 0.00000 1.000 N3 N -7.80300 -1.58200 0.00100 1.000 C4 C -4.72500 1.10300 -0.00000 1.000 C5 C -6.01400 1.64100 0.00100 1.000 C6 C -2.06800 0.15100 -0.00000 1.000 C7 C -0.77300 -0.66300 0.00000 1.000 C8 C 0.42700 0.28700 -0.00000 1.000 C9 C 4.21700 -0.39200 0.00000 1.000 C10 C 5.41600 0.55800 -0.00000 1.000 C11 C 6.71200 -0.25600 0.00000 1.000 C12 C 7.91100 0.69400 -0.00000 1.000 C13 C 10.40600 0.83000 -0.00000 1.000 N14 N -5.91700 -2.41900 -0.00400 1.000 C15 C -7.13000 0.87100 0.00000 1.000 N16 N -3.21700 -0.75800 0.00100 1.000 O17 O -7.12000 -2.58600 0.00100 1.000 N18 N -8.46700 1.50700 -0.00000 1.000 O19 O -8.56400 2.72100 -0.00100 1.000 O20 O -9.47000 0.81700 0.00000 1.000 C21 C 1.72200 -0.52700 0.00000 1.000 C22 C 2.92100 0.42300 -0.00000 1.000 C23 C 9.20600 -0.12000 0.00000 1.000 C24 C 11.68200 0.02800 0.00000 1.000 O25 O 11.63600 -1.18000 0.00100 1.000 O26 O 12.86800 0.65500 -0.00000 1.000 H27 H -3.87600 1.77100 -0.00100 1.000 H28 H -6.12600 2.71500 0.00100 1.000 H29 H -2.10200 0.78000 0.89000 1.000 H30 H -2.10200 0.77900 -0.89000 1.000 H31 H -0.73900 -1.29100 0.89100 1.000 H32 H -0.73900 -1.29200 -0.88900 1.000 H33 H 0.39300 0.91500 -0.89100 1.000 H34 H 0.39300 0.91600 0.89000 1.000 H35 H 4.25100 -1.02000 -0.88900 1.000 H36 H 4.25100 -1.02000 0.89100 1.000 H37 H 5.38200 1.18600 -0.89100 1.000 H38 H 6.74600 -0.88400 0.89100 1.000 H39 H 7.87700 1.32200 -0.89100 1.000 H40 H 7.87700 1.32300 0.88900 1.000 H41 H 10.37200 1.45700 -0.89100 1.000 H42 H 10.37200 1.45900 0.88900 1.000 H43 H -3.07500 -1.71800 0.00100 1.000 H44 H 1.75600 -1.15500 0.89100 1.000 H45 H 1.75600 -1.15600 -0.88900 1.000 H46 H 2.88700 1.05100 0.88900 1.000 H47 H 2.88700 1.05000 -0.89100 1.000 H48 H 9.24100 -0.74800 0.89100 1.000 H49 H 9.24100 -0.74900 -0.89000 1.000 H50 H 13.65900 0.09800 -0.00000 1.000 H51 H 5.38200 1.18700 0.88900 1.000 H52 H 6.74600 -0.88500 -0.88900 1.000