# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'DRJ' 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 2.86200 -0.02100 -0.79200 1.000 C1 C 3.09600 -0.42400 -2.24300 1.000 C2 C 1.81100 -0.75300 -3.02300 1.000 C3 C 2.15500 -1.15200 -4.45600 1.000 O4 O 2.92200 -0.23700 -5.10100 1.000 O5 O 1.78300 -2.18900 -4.99200 1.000 C6 C 0.94600 -1.81900 -2.35100 1.000 O7 O 1.04200 0.44400 -3.12500 1.000 C8 C -0.12300 0.37300 -3.82500 1.000 C9 C -1.31100 0.04400 -3.17200 1.000 C10 C -2.50500 -0.02700 -3.89000 1.000 C11 C -0.13000 0.63200 -5.19600 1.000 C12 C -1.32400 0.56100 -5.91400 1.000 C13 C -2.49600 0.23300 -5.25100 1.000 C14 C -3.78800 0.15700 -6.02700 1.000 C15 C -4.06300 -1.23500 -6.59200 1.000 N16 N -4.18500 -2.24600 -5.55100 1.000 C17 C -3.02300 -3.07800 -5.26300 1.000 C18 C -3.15700 -4.43600 -5.95300 1.000 C19 C -1.94100 -5.32000 -5.66900 1.000 C20 C -2.03400 -6.70900 -6.30700 1.000 C21 C -0.78700 -7.56700 -6.08600 1.000 C22 C -0.94000 -8.94400 -6.73300 1.000 C23 C 0.28400 -9.81300 -6.48800 1.000 C24 C -5.37400 -2.40600 -4.84100 1.000 O25 O -5.33000 -3.38100 -3.91500 1.000 C26 C -6.58700 -3.32600 -3.38500 1.000 C27 C -7.11300 -4.11800 -2.37100 1.000 C28 C -8.43900 -3.84700 -2.01800 1.000 C29 C -9.17400 -2.83900 -2.65400 1.000 C30 C -8.60800 -2.06000 -3.67400 1.000 C31 C -7.28000 -2.31900 -4.04000 1.000 N32 N -6.46700 -1.73700 -4.98300 1.000 H33 H 3.81500 0.24000 -0.31900 1.000 H34 H 2.20300 0.84900 -0.71800 1.000 H35 H 2.42200 -0.84100 -0.21600 1.000 H36 H 3.61200 0.40900 -2.74000 1.000 H37 H 3.78800 -1.27400 -2.26400 1.000 H38 H 3.16300 -0.45500 -6.02500 1.000 H39 H 0.12500 -2.12500 -3.01100 1.000 H40 H 0.47900 -1.43400 -1.43700 1.000 H41 H 1.52000 -2.71500 -2.09800 1.000 H42 H -1.31200 -0.15800 -2.10500 1.000 H43 H -3.42500 -0.28400 -3.37200 1.000 H44 H 0.79200 0.89000 -5.71100 1.000 H45 H -1.31900 0.76400 -6.98100 1.000 H46 H -3.74200 0.88000 -6.85100 1.000 H47 H -4.62300 0.47800 -5.39000 1.000 H48 H -5.00900 -1.23300 -7.14300 1.000 H49 H -3.27000 -1.55700 -7.27500 1.000 H50 H -2.94000 -3.21400 -4.17900 1.000 H51 H -2.11700 -2.56600 -5.60500 1.000 H52 H -3.26100 -4.29400 -7.03600 1.000 H53 H -4.07000 -4.93100 -5.60100 1.000 H54 H -1.80100 -5.42200 -4.58600 1.000 H55 H -1.04100 -4.82700 -6.05800 1.000 H56 H -2.19200 -6.57900 -7.38500 1.000 H57 H -2.91700 -7.23300 -5.92100 1.000 H58 H 0.08900 -7.05900 -6.50800 1.000 H59 H -0.60300 -7.69400 -5.01300 1.000 H60 H -1.09200 -8.83400 -7.81200 1.000 H61 H -1.82600 -9.44800 -6.32900 1.000 H62 H 1.18300 -9.35200 -6.91000 1.000 H63 H 0.44700 -9.96900 -5.41700 1.000 H64 H 0.15300 -10.79300 -6.95800 1.000 H65 H -6.53600 -4.89500 -1.88600 1.000 H66 H -8.91000 -4.43200 -1.23100 1.000 H67 H -10.20300 -2.65700 -2.35300 1.000 H68 H -9.18700 -1.28300 -4.16200 1.000