# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JEY' 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 -0.66500 0.80300 1.01800 1.000 C1 C -1.14600 1.71000 -0.11600 1.000 C2 C -2.49100 3.72400 -0.38100 1.000 O3 O -2.29900 3.66000 -1.57600 1.000 C4 C -3.32600 4.84100 0.19000 1.000 O5 O 4.90400 1.27100 0.37300 1.000 N6 N -1.95800 2.79600 0.43800 1.000 C7 C 3.92700 0.35000 0.15600 1.000 C8 C 2.61700 0.65000 0.46900 1.000 C9 C 1.61700 -0.30000 0.23900 1.000 C10 C 6.23700 0.89800 0.02100 1.000 C11 C -2.24300 -2.61900 -1.03900 1.000 C12 C -3.55700 -3.03700 -1.00100 1.000 C13 C -4.32500 -2.81200 0.12800 1.000 C14 C -3.78100 -2.17000 1.22500 1.000 C15 C -2.46700 -1.74800 1.20000 1.000 C16 C -1.68800 -1.97000 0.06400 1.000 N17 N 0.78100 -2.27600 -0.42400 1.000 C18 C 0.17000 -0.31500 0.44800 1.000 C19 C -0.27800 -1.52600 0.03200 1.000 C20 C 1.95000 -1.55300 -0.31000 1.000 C21 C 3.27600 -1.83400 -0.61900 1.000 C22 C 4.25300 -0.89100 -0.38700 1.000 H23 H -0.06500 1.38300 1.71900 1.000 H24 H -1.52700 0.38300 1.53800 1.000 H25 H -0.28400 2.12900 -0.63600 1.000 H26 H -1.74600 1.12900 -0.81700 1.000 H27 H -3.38700 4.73400 1.27300 1.000 H28 H -2.86800 5.79900 -0.05500 1.000 H29 H -4.32900 4.79900 -0.23600 1.000 H30 H -2.11100 2.84800 1.39500 1.000 H31 H 2.36600 1.61200 0.89100 1.000 H32 H 6.91600 1.72200 0.24500 1.000 H33 H 6.53200 0.01900 0.59400 1.000 H34 H 6.28200 0.67000 -1.04400 1.000 H35 H -1.64300 -2.79900 -1.92000 1.000 H36 H -3.98800 -3.53900 -1.85500 1.000 H37 H -5.35400 -3.14000 0.15200 1.000 H38 H -4.38500 -1.99700 2.10300 1.000 H39 H -2.04300 -1.24600 2.05700 1.000 H40 H 0.71500 -3.17800 -0.77400 1.000 H41 H 3.54100 -2.79200 -1.04000 1.000 H42 H 5.28100 -1.11400 -0.63200 1.000