# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0EC' 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 -1.59600 -0.11700 0.25700 1.000 N1 N -0.67000 0.82200 0.26700 1.000 C2 C 0.62800 0.49800 0.15700 1.000 C3 C 0.98200 -0.86800 0.03100 1.000 C4 C -0.05600 -1.83100 0.02700 1.000 N5 N 0.22900 -3.17600 -0.09200 1.000 N6 N -1.30700 -1.41000 0.14700 1.000 C7 C 1.63500 1.47200 0.16400 1.000 C8 C 2.95200 1.08700 0.04900 1.000 O9 O 3.93100 2.03000 0.05600 1.000 C10 C 3.29400 -0.26600 -0.07400 1.000 O11 O 4.60300 -0.62200 -0.18600 1.000 C12 C 2.32900 -1.23200 -0.08600 1.000 N13 N -2.92300 0.25900 0.37200 1.000 C14 C -3.80700 -0.91500 0.34300 1.000 C15 C -5.25500 -0.46500 0.55200 1.000 N16 N -5.62300 0.49500 -0.49700 1.000 C17 C -4.74000 1.66800 -0.46800 1.000 C18 C -3.29200 1.21900 -0.67700 1.000 C19 C 3.51800 3.39200 0.18500 1.000 C20 C 4.88800 -2.01700 -0.30900 1.000 H21 H 1.37900 2.51700 0.25900 1.000 H22 H 2.60300 -2.27200 -0.18100 1.000 H23 H -5.61400 0.05800 -1.40700 1.000 H24 H -3.71700 -1.41400 -0.62300 1.000 H25 H -3.52100 -1.60600 1.13600 1.000 H26 H -5.91500 -1.33100 0.50200 1.000 H27 H -5.35000 0.00900 1.52900 1.000 H28 H 1.15000 -3.47100 -0.17500 1.000 H29 H -5.02400 2.35900 -1.26200 1.000 H30 H -0.49100 -3.82600 -0.09400 1.000 H31 H -4.82900 2.16700 0.49800 1.000 H32 H -2.63100 2.08400 -0.62600 1.000 H33 H -3.19600 0.74400 -1.65400 1.000 H34 H 2.98000 3.52100 1.12500 1.000 H35 H 4.39500 4.04000 0.17700 1.000 H36 H 2.86500 3.65400 -0.64600 1.000 H37 H 5.96500 -2.16200 -0.39000 1.000 H38 H 4.51500 -2.54200 0.57000 1.000 H39 H 4.40000 -2.41000 -1.20100 1.000