# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '99M' 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 5.65500 1.45200 0.07300 1.000 C1 C 5.21100 2.73100 0.34200 1.000 C2 C 2.97600 1.91400 0.24800 1.000 C3 C -0.91600 0.41600 -0.10500 1.000 C4 C -3.16700 1.24300 0.12100 1.000 C5 C -5.01200 -0.12300 0.81500 1.000 C6 C -9.08200 -0.88700 1.11500 1.000 O7 O 1.91300 -3.72400 -0.76600 1.000 C8 C 1.92800 -2.52400 -0.56500 1.000 N9 N 3.02200 -1.74800 -0.42400 1.000 C10 C 4.40800 -2.21900 -0.48900 1.000 C11 C 4.89000 -2.55200 0.90000 1.000 C12 C 5.37700 -3.74000 1.15600 1.000 N13 N 2.62800 -0.42300 -0.20800 1.000 C14 C 3.49300 0.65100 -0.02000 1.000 N15 N 4.80100 0.46100 -0.09800 1.000 C16 C 7.13500 1.18500 -0.03200 1.000 C17 C 7.36200 -0.26600 -0.46300 1.000 O18 O 7.71000 2.06500 -1.00100 1.000 C19 C 7.79400 1.42300 1.32800 1.000 C20 C 3.84700 2.97300 0.43200 1.000 C21 C 1.25300 -0.34500 -0.20900 1.000 N22 N 0.38900 0.64700 -0.05300 1.000 N23 N -1.78700 1.47500 0.05600 1.000 C24 C -3.65100 0.10500 0.75200 1.000 C25 C -5.89500 0.78600 0.24800 1.000 N26 N -7.27400 0.55500 0.31300 1.000 C27 C -7.56500 -0.70400 1.01400 1.000 O28 O -9.64900 -0.85500 -0.19700 1.000 C29 C -9.38500 0.35700 -0.90900 1.000 C30 C -7.87200 0.55300 -1.03000 1.000 C31 C -5.41100 1.92700 -0.37800 1.000 C32 C -4.05100 2.15500 -0.44200 1.000 N33 N -1.41500 -0.79700 -0.31200 1.000 C34 C -0.62100 -1.84200 -0.47800 1.000 C35 C 0.75700 -1.64800 -0.43100 1.000 H36 H 5.91800 3.53600 0.48100 1.000 H37 H 1.90800 2.06600 0.31100 1.000 H38 H -5.38900 -1.00800 1.30600 1.000 H39 H -9.30200 -1.84600 1.58400 1.000 H40 H -9.50600 -0.08200 1.71500 1.000 H41 H 4.46000 -3.10900 -1.11500 1.000 H42 H 5.03700 -1.43800 -0.91400 1.000 H43 H 4.83400 -1.81100 1.68300 1.000 H44 H 5.43400 -4.48200 0.37300 1.000 H45 H 5.72300 -3.97900 2.15100 1.000 H46 H 6.89200 -0.43500 -1.43200 1.000 H47 H 8.43200 -0.45900 -0.53900 1.000 H48 H 6.92300 -0.93700 0.27600 1.000 H49 H 7.33900 1.96900 -1.88800 1.000 H50 H 7.35600 0.75200 2.06600 1.000 H51 H 8.86400 1.22900 1.25100 1.000 H52 H 7.63300 2.45600 1.63400 1.000 H53 H 3.47400 3.96400 0.64200 1.000 H54 H -1.44300 2.37900 0.12500 1.000 H55 H -2.96400 -0.60200 1.19300 1.000 H56 H -7.13500 -0.67000 2.01600 1.000 H57 H -7.13400 -1.53700 0.46000 1.000 H58 H -9.82500 0.29800 -1.90500 1.000 H59 H -9.81900 1.19900 -0.36800 1.000 H60 H -7.66600 1.50400 -1.52200 1.000 H61 H -7.44500 -0.26100 -1.61700 1.000 H62 H -6.09800 2.63400 -0.81900 1.000 H63 H -3.67400 3.04200 -0.92800 1.000 H64 H -1.03300 -2.82600 -0.64600 1.000