# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C7X' 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 0.16400 2.60200 0.12600 1.000 C1 C -1.07300 3.17500 0.35000 1.000 C2 C -2.22500 2.51100 -0.03800 1.000 C3 C -2.14000 1.27200 -0.64900 1.000 C4 C -0.90500 0.69500 -0.87400 1.000 C5 C -3.39600 0.55200 -1.06800 1.000 C6 C -4.29400 0.37800 0.15100 1.000 N7 N -3.08600 -2.90700 -2.26900 1.000 N8 N 1.50300 0.77800 -0.71900 1.000 O9 O 7.57200 -0.92800 -0.92000 1.000 C10 C -5.53600 -0.42800 -0.25500 1.000 N11 N 4.08700 -0.19900 -1.28200 1.000 C12 C -3.60400 -1.84700 -1.56100 1.000 C13 C 2.50900 0.97400 0.15600 1.000 C14 C 3.86200 0.45900 -0.14600 1.000 C15 C 5.29000 -0.65700 -1.55000 1.000 C16 C 6.33300 -0.45500 -0.64300 1.000 C17 C 4.90300 0.66100 0.75900 1.000 C18 C -4.13100 1.40500 -2.10400 1.000 F19 F 8.40800 -1.53900 1.14400 1.000 C20 C 8.59100 -0.68400 0.05200 1.000 N21 N 6.11100 0.20000 0.48800 1.000 O22 O 2.30500 1.57400 1.19300 1.000 C23 C 0.25100 1.35900 -0.48700 1.000 F24 F -3.43300 3.07400 0.18200 1.000 N25 N -3.03000 -0.70900 -1.67700 1.000 S26 S -5.01600 -2.13800 -0.55300 1.000 C27 C -3.54300 -0.36100 1.22900 1.000 C28 C -2.43700 -1.12300 0.90300 1.000 C29 C -1.74600 -1.79700 1.89200 1.000 C30 C -2.16000 -1.70800 3.20800 1.000 C31 C -3.26600 -0.94500 3.53400 1.000 C32 C -3.95800 -0.27200 2.54500 1.000 H33 H 1.06200 3.12100 0.42500 1.000 H34 H -1.14100 4.14100 0.82700 1.000 H35 H -0.84000 -0.27200 -1.35100 1.000 H36 H -4.59900 1.35600 0.52200 1.000 H37 H -2.30800 -2.77900 -2.83400 1.000 H38 H -3.49900 -3.78200 -2.20200 1.000 H39 H 1.64700 0.23500 -1.51000 1.000 H40 H -6.27200 -0.40100 0.54900 1.000 H41 H -5.96700 -0.00900 -1.16400 1.000 H42 H 5.47200 -1.19100 -2.47100 1.000 H43 H 4.72300 1.19500 1.68000 1.000 H44 H -3.48800 1.56000 -2.97000 1.000 H45 H -5.04200 0.89300 -2.41500 1.000 H46 H -4.38800 2.36900 -1.66400 1.000 H47 H 9.56900 -0.86800 -0.39300 1.000 H48 H 8.53400 0.35100 0.38700 1.000 H49 H -2.11400 -1.19300 -0.12500 1.000 H50 H -0.88200 -2.39300 1.63700 1.000 H51 H -1.62000 -2.23500 3.98100 1.000 H52 H -3.58900 -0.87500 4.56200 1.000 H53 H -4.81900 0.32700 2.80000 1.000