# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '5U4' 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 4.91000 2.07000 -0.32300 1.000 C1 C 4.26300 1.71700 -1.49300 1.000 C2 C 3.04900 1.06100 -1.44100 1.000 C3 C 2.47800 0.75600 -0.21300 1.000 C4 C -1.12200 0.23200 -0.07900 1.000 C5 C -3.73000 2.81000 -0.06100 1.000 C6 C -5.93000 1.61100 0.04600 1.000 C7 C -1.19300 -1.23000 -0.04500 1.000 C8 C -0.36400 -3.36500 -0.02700 1.000 C9 C 1.23400 -1.25500 -0.12800 1.000 C10 C 2.51400 0.78200 2.29600 1.000 C11 C 3.13000 1.11200 0.96000 1.000 C12 C 4.34400 1.76800 0.90200 1.000 N13 N 1.24700 0.09100 -0.15700 1.000 C14 C 0.09900 0.82800 -0.13300 1.000 C15 C -2.36100 1.04900 -0.06000 1.000 C16 C -2.42700 2.45600 -0.09400 1.000 N17 N -4.46800 1.68100 -0.00400 1.000 N18 N -3.59200 0.58700 0.00000 1.000 N19 N -2.20400 -2.13000 0.01000 1.000 N20 N -1.67200 -3.42400 0.02000 1.000 N21 N 0.51200 -4.45100 -0.03400 1.000 C22 C 0.00800 -1.95500 -0.07100 1.000 O23 O 2.28500 -1.87200 -0.15200 1.000 H24 H 5.86200 2.57900 -0.36600 1.000 H25 H 4.70700 1.95500 -2.44800 1.000 H26 H 2.54400 0.78600 -2.35600 1.000 H27 H -4.11400 3.81900 -0.07500 1.000 H28 H -6.26000 1.62400 1.08500 1.000 H29 H -6.35300 2.46700 -0.48000 1.000 H30 H -6.26600 0.69000 -0.43000 1.000 H31 H 2.85500 -0.20100 2.62000 1.000 H32 H 2.81500 1.53100 3.02900 1.000 H33 H 1.42800 0.77900 2.20400 1.000 H34 H 4.85400 2.04100 1.81400 1.000 H35 H 0.16100 1.90600 -0.15800 1.000 H36 H -1.58500 3.13100 -0.13800 1.000 H37 H -3.14900 -1.91100 0.03800 1.000 H38 H 1.47000 -4.30200 -0.07100 1.000 H39 H 0.16300 -5.35600 -0.00200 1.000