# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CRO' 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 -0.88700 -2.45700 -1.67100 1.000 C1 C -1.79600 -1.61300 -0.88300 1.000 C2 C -2.05100 -2.26800 0.47600 1.000 C3 C -2.56900 -3.69300 0.26700 1.000 O4 O -0.83200 -2.30900 1.22100 1.000 C5 C -1.17100 -0.25700 -0.67800 1.000 N6 N 0.10000 -0.05400 -0.52300 1.000 N7 N -1.87100 0.91600 -0.63700 1.000 C8 C -0.99600 1.92700 -0.43900 1.000 O9 O -1.24800 3.11500 -0.34700 1.000 C10 C 0.32700 1.28500 -0.36200 1.000 C11 C -3.32200 1.05400 -0.78300 1.000 C12 C -3.97400 0.96000 0.57200 1.000 O13 O -3.29700 0.79400 1.55900 1.000 C14 C 1.54300 1.90400 -0.16900 1.000 C15 C 2.75700 1.10100 -0.00800 1.000 C16 C 2.70900 -0.29000 -0.18000 1.000 C17 C 3.97300 1.72100 0.31300 1.000 C18 C 3.85000 -1.03500 -0.03300 1.000 C19 C 5.10700 0.96400 0.46300 1.000 C20 C 5.05400 -0.41500 0.28500 1.000 O21 O 6.18000 -1.15800 0.42900 1.000 O22 O -5.30800 1.06000 0.68200 1.000 H23 H -0.00400 -2.57600 -1.19800 1.000 H24 H -1.31100 -3.34900 -1.87700 1.000 H25 H -2.74100 -1.50100 -1.41500 1.000 H26 H -2.79300 -1.68900 1.02600 1.000 H27 H -1.82700 -4.27200 -0.28300 1.000 H28 H -2.75000 -4.15900 1.23500 1.000 H29 H -3.49900 -3.66100 -0.30100 1.000 H30 H -0.12500 -2.81000 0.79100 1.000 H31 H -3.55100 2.02100 -1.23100 1.000 H32 H -3.70000 0.25800 -1.42500 1.000 H33 H -5.68100 0.99400 1.57200 1.000 H34 H 1.60000 2.98200 -0.13800 1.000 H35 H 1.77500 -0.77200 -0.42700 1.000 H36 H 4.01700 2.79200 0.44200 1.000 H37 H 3.81600 -2.10600 -0.17000 1.000 H38 H 6.04400 1.44000 0.71000 1.000 H39 H 6.68200 -1.27400 -0.38900 1.000