# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CQ1' 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 -7.57300 0.22300 0.48700 1.000 N1 N -6.60100 -0.33800 0.42500 1.000 N2 N -5.62900 -0.89900 0.36300 1.000 C3 C -4.50200 -0.24400 0.15900 1.000 C4 C -3.22500 -0.96200 0.07500 1.000 C5 C -2.08500 -0.26300 -0.13500 1.000 C6 C -4.50100 1.21400 0.00500 1.000 C7 C -3.32800 1.85800 -0.20300 1.000 C8 C -2.11600 1.14000 -0.27200 1.000 C9 C -0.91100 1.83900 -0.49000 1.000 C10 C 0.30400 1.17800 -0.38200 1.000 N11 N 0.50800 -0.09200 0.03900 1.000 C12 C 1.64300 1.71400 -0.70900 1.000 O13 O 1.91300 2.82500 -1.12400 1.000 N14 N 2.50100 0.70300 -0.44700 1.000 C15 C 3.95600 0.74700 -0.61400 1.000 C16 C 4.59400 1.22700 0.66400 1.000 O17 O 5.92900 1.34600 0.74400 1.000 C18 C 1.78000 -0.36200 0.00600 1.000 C19 C 2.37800 -1.68600 0.40600 1.000 N20 N 1.61900 -2.24600 1.53200 1.000 C21 C 2.32000 -2.65100 -0.78000 1.000 C22 C 2.81200 -4.03100 -0.33900 1.000 O23 O 0.97300 -2.75200 -1.24500 1.000 H24 H -3.19500 -2.03700 0.18000 1.000 H25 H -1.14100 -0.78500 -0.19700 1.000 H26 H -5.42600 1.76900 0.05800 1.000 H27 H -3.32000 2.93200 -0.31600 1.000 H28 H -0.93400 2.89000 -0.74100 1.000 H29 H 4.32400 -0.25100 -0.85100 1.000 H30 H 4.20800 1.43000 -1.42500 1.000 O31 O 3.90500 1.50400 1.61700 1.000 H32 H 6.29200 1.65800 1.58400 1.000 H33 H 3.41700 -1.54000 0.70500 1.000 H34 H 0.65300 -2.39100 1.28000 1.000 H35 H 2.03900 -3.10200 1.86000 1.000 H36 H 2.95500 -2.27800 -1.58300 1.000 H37 H 2.17700 -4.40400 0.46500 1.000 H38 H 2.77000 -4.71900 -1.18300 1.000 H39 H 3.84000 -3.95400 0.01700 1.000 H40 H 0.86000 -3.34900 -1.99800 1.000