# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C3Z' 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 0.50400 1.91900 1.44900 1.000 C1 C 1.19500 0.76800 1.25200 1.000 C2 C 0.71500 -0.24500 0.39200 1.000 C3 C 2.12300 -3.62400 0.10200 1.000 C4 C 3.67400 -0.46700 -0.39500 1.000 C5 C 3.21300 0.61900 -1.12700 1.000 C6 C 4.04900 1.69000 -1.37200 1.000 C7 C 5.34500 1.68100 -0.89000 1.000 C8 C 5.80800 0.60100 -0.16100 1.000 C9 C 4.97600 -0.47200 0.08800 1.000 C10 C -2.43800 1.53800 -0.61400 1.000 C11 C -3.33400 0.81000 -1.58300 1.000 C12 C -5.47000 0.31800 -0.37600 1.000 C13 C -6.30400 -0.54200 0.31600 1.000 C14 C -0.47900 -0.10300 -0.28300 1.000 C15 C 1.50800 -1.48000 0.21100 1.000 C16 C 1.05800 -2.76200 0.36500 1.000 N17 N 3.17700 -2.90700 -0.19900 1.000 N18 N 2.82600 -1.55200 -0.14000 1.000 O19 O 2.37700 0.58500 1.89600 1.000 C20 C -0.72600 2.12400 0.78600 1.000 C21 C -1.23500 1.07400 -0.11200 1.000 N22 N -2.66200 2.75000 -0.09000 1.000 N23 N -1.61400 3.10200 0.76800 1.000 C24 C -4.24000 -0.12500 -0.82400 1.000 C25 C -5.90400 -1.84100 0.56400 1.000 C26 C -4.67100 -2.28200 0.12000 1.000 C27 C -3.84000 -1.42500 -0.57600 1.000 H28 H 0.89100 2.67600 2.11500 1.000 H29 H 2.08500 -4.70200 0.14300 1.000 H30 H 2.20100 0.62600 -1.50500 1.000 H31 H 3.69200 2.53500 -1.94200 1.000 H32 H 5.99800 2.52000 -1.08400 1.000 H33 H 6.82000 0.59700 0.21500 1.000 H34 H 5.33700 -1.31600 0.65800 1.000 H35 H -3.93600 1.53300 -2.13400 1.000 H36 H -2.72400 0.23800 -2.28200 1.000 H37 H -5.78300 1.33300 -0.57000 1.000 H38 H -7.26700 -0.19800 0.66200 1.000 H39 H -0.83200 -0.88700 -0.93700 1.000 H40 H 0.05600 -3.05500 0.64100 1.000 H41 H 2.28600 0.23000 2.79200 1.000 H42 H -3.43800 3.30300 -0.27600 1.000 H43 H -6.55500 -2.51300 1.10500 1.000 H44 H -4.35900 -3.29700 0.31500 1.000 H45 H -2.87700 -1.76900 -0.92300 1.000