# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0O1' 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 -0.67500 4.01500 0.60500 1.000 N1 N -0.86300 3.02100 -0.46000 1.000 C2 C -1.32400 1.74000 0.09100 1.000 C3 C -1.50700 0.73200 -1.04600 1.000 C4 C -1.98000 -0.58200 -0.48100 1.000 C5 C -3.34300 -0.83700 -0.34900 1.000 N6 N -4.27000 0.08100 -0.72300 1.000 C7 C -5.55100 -0.15200 -0.60200 1.000 N8 N -6.05300 -1.31800 -0.09900 1.000 C9 C -5.22400 -2.30700 0.30600 1.000 C10 C -3.77800 -2.07600 0.18300 1.000 C11 C -2.85200 -3.03800 0.57500 1.000 C12 C -1.49300 -2.77500 0.43900 1.000 C13 C -1.06200 -1.54300 -0.09700 1.000 N14 N 0.32100 -1.59000 -0.10000 1.000 C15 C 0.68900 -2.80300 0.41400 1.000 N16 N -0.37500 -3.49800 0.72500 1.000 N17 N 1.98900 -3.23200 0.57600 1.000 C18 C 3.10100 -2.36200 0.18400 1.000 O19 O -5.66000 -3.35100 0.75700 1.000 C20 C -0.19600 5.33300 -0.00600 1.000 N21 N -6.43400 0.82200 -0.99900 1.000 C22 C 4.42700 -3.07200 0.46700 1.000 C23 C 5.57100 -2.17800 0.06400 1.000 C24 C 7.16400 -0.47600 0.60900 1.000 C25 C 6.11500 -1.29600 0.97900 1.000 C26 C 7.67100 -0.53800 -0.67500 1.000 C27 C 6.08100 -2.24400 -1.22000 1.000 C28 C 7.13100 -1.42400 -1.58900 1.000 C29 C -0.11600 6.42000 1.08100 1.000 C30 C 1.23000 5.16700 -0.57000 1.000 C31 C 1.35700 6.87600 1.14000 1.000 C32 C 1.92200 6.51700 -0.25700 1.000 H33 H -1.62200 4.17700 1.12200 1.000 H34 H 0.06800 3.65200 1.31400 1.000 H35 H -1.50000 3.36200 -1.16500 1.000 H36 H -0.58500 1.36100 0.79600 1.000 H37 H -2.27400 1.88600 0.60400 1.000 H38 H -2.24600 1.11100 -1.75200 1.000 H39 H -0.55700 0.58600 -1.55900 1.000 H40 H -7.01400 -1.43800 -0.03100 1.000 H41 H -3.18700 -3.98100 0.98000 1.000 H42 H 0.91900 -0.89200 -0.40900 1.000 H43 H 2.16700 -4.10900 0.95000 1.000 H44 H 3.02900 -2.13700 -0.87900 1.000 H45 H 3.05700 -1.43600 0.75600 1.000 H46 H -0.87700 5.64700 -0.79700 1.000 H47 H -6.10200 1.66000 -1.35900 1.000 H48 H -7.38900 0.67300 -0.91900 1.000 H49 H 4.49900 -3.29800 1.53100 1.000 H50 H 4.47100 -3.99900 -0.10500 1.000 H51 H 7.58900 0.21300 1.32400 1.000 H52 H 5.71900 -1.24800 1.98300 1.000 H53 H 8.49100 0.10200 -0.96400 1.000 H54 H 5.65900 -2.93600 -1.93300 1.000 H55 H 7.52700 -1.47300 -2.59300 1.000 H56 H -0.75600 7.26100 0.81700 1.000 H57 H -0.41900 6.00800 2.04300 1.000 H58 H 1.74600 4.34900 -0.06700 1.000 H59 H 1.19700 4.99300 -1.64500 1.000 H60 H 1.41700 7.95000 1.31100 1.000 H61 H 1.89300 6.33500 1.92000 1.000 H62 H 3.00400 6.39600 -0.21700 1.000 H63 H 1.64300 7.27300 -0.99200 1.000