# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9Z1' 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 0.40200 0.75800 2.68200 1.000 C1 C 0.41500 3.19300 1.53900 1.000 C2 C 2.88700 1.02200 2.68800 1.000 C3 C 0.19000 -2.30400 -2.72700 1.000 C4 C 2.27900 0.15600 -1.61100 1.000 C5 C 0.47100 0.05100 -0.19600 1.000 C6 C -0.23900 -2.06400 0.89500 1.000 C7 C 3.04700 0.38700 -2.75200 1.000 C8 C 1.17800 -2.28700 1.26400 1.000 C9 C 2.06100 -1.30500 1.16700 1.000 C10 C -1.76400 -0.25700 0.14700 1.000 C11 C -2.97800 -0.85200 0.24200 1.000 C12 C -4.18800 -0.11700 -0.14900 1.000 C13 C -5.46000 -0.61700 -0.18600 1.000 C14 C -5.48400 1.48800 -0.81000 1.000 C15 C 4.31200 0.92300 -2.56500 1.000 C16 C -1.51000 1.15500 -0.17000 1.000 C17 C 4.80200 1.22000 -1.31000 1.000 C18 C 4.04700 0.99300 -0.16400 1.000 C19 C 2.79000 0.45800 -0.34200 1.000 C20 C 1.73500 0.08500 0.67900 1.000 C21 C 1.62500 1.09200 1.82600 1.000 C22 C 1.47900 2.48200 1.26100 1.000 N23 N 0.98800 -0.35800 -1.51800 1.000 N24 N -0.52400 -0.87400 0.33200 1.000 N25 N -6.26800 0.39800 -0.60200 1.000 N26 N -4.24800 1.18300 -0.53600 1.000 N27 N -0.18000 1.35400 -0.29900 1.000 O28 O 0.99300 -1.81500 -1.65000 1.000 O29 O -1.09500 -2.90600 1.08800 1.000 O30 O 1.57500 -3.51000 1.70600 1.000 O31 O -2.36500 2.01200 -0.29800 1.000 H32 H 0.37100 1.42300 3.54600 1.000 H33 H -0.50300 0.89000 2.08900 1.000 H34 H 0.46700 -0.27600 3.02100 1.000 H35 H -0.35800 2.78400 2.17300 1.000 H36 H 0.31100 4.18900 1.13500 1.000 H37 H 3.18200 -0.02000 2.81700 1.000 H38 H 3.69200 1.57000 2.20000 1.000 H39 H 2.68500 1.46500 3.66400 1.000 H40 H 0.24700 -3.39200 -2.75800 1.000 H41 H -0.84500 -1.99800 -2.57600 1.000 H42 H 0.55600 -1.89400 -3.66800 1.000 H43 H 2.67300 0.15800 -3.73900 1.000 H44 H 3.08000 -1.51200 1.45800 1.000 H45 H -3.05600 -1.86500 0.60600 1.000 H46 H -5.76500 -1.62200 0.06700 1.000 H47 H -5.83100 2.45400 -1.14600 1.000 H48 H 4.93300 1.11400 -3.42800 1.000 H49 H 5.79300 1.63800 -1.21500 1.000 H50 H 4.42800 1.22400 0.81900 1.000 H51 H 2.25200 2.89100 0.62700 1.000 H52 H -7.22800 0.35100 -0.72700 1.000 H53 H 0.26200 2.20700 -0.43500 1.000 H54 H 0.86400 -4.16400 1.74400 1.000