# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net data_I _chemical_name_common '2QR' loop_ _atom_site_type_symbol _atom_site_label _atom_site_Cartn_x _atom_site_Cartn_y _atom_site_Cartn_z O O1 -10.43100 -1.51100 -1.84100 C C2 -9.39300 -0.74300 -1.22900 C C3 -8.44700 -0.14100 -2.29700 O O4 -8.55600 -0.86400 -3.52500 C C5 -7.03900 -0.31200 -1.69400 C C6 -6.35900 1.05200 -1.56700 O O7 -5.01400 0.87400 -1.11700 P P8 -4.00100 2.10200 -0.87300 O O9 -4.54600 3.01400 0.33700 O O10 -2.54400 1.52900 -0.49800 P P11 -1.07000 2.17300 -0.44000 O O12 -0.88600 3.08800 -1.59000 O O13 0.03200 1.00000 -0.50600 C C14 1.43600 1.25500 -0.58000 C C15 2.12100 0.12000 -1.34500 O O16 1.85100 -1.12500 -0.69700 O O17 1.97600 1.33000 0.74100 C C18 3.37700 1.60900 0.78400 C C19 4.14000 0.48800 0.07200 C C20 3.63200 0.36900 -1.36800 O O21 3.90600 1.58100 -2.07300 N N22 5.57500 0.80100 0.06200 C C23 6.21900 0.36200 1.30800 C C24 7.68700 0.69900 1.26100 C C25 8.15200 1.92200 1.73200 O O26 7.28800 2.83800 2.24400 C C27 9.51100 2.19400 1.67100 C C28 10.03100 3.51500 2.17800 N N29 10.35300 1.30900 1.17600 C C30 9.94400 0.14100 0.72200 C C31 8.60700 -0.20400 0.75300 C C32 8.15200 -1.54300 0.23100 O O33 9.28200 -2.27800 -0.24300 P P34 9.16600 -3.75600 -0.87200 O O35 10.60800 -4.22200 -1.41600 O O36 8.66300 -4.78300 0.26200 O O37 8.19700 -3.74100 -1.99000 O O38 -0.89700 2.99500 0.93300 O O39 -3.90900 2.91800 -2.10400 O O40 -7.20000 -0.90400 -0.39400 C C41 -8.43400 -1.65400 -0.42100 N N42 -8.94200 -1.86300 0.93700 C C43 -9.32100 -3.11600 1.33400 C C44 -9.79000 -3.30800 2.58600 C C45 -9.02600 -0.82100 1.78400 N N46 -9.48900 -0.98400 3.03700 C C47 -9.87800 -2.20200 3.46500 O O48 -10.29800 -2.35100 4.59800 O O49 -8.67800 0.28300 1.41300 H H50 -11.03000 -0.99200 -2.39400 H H51 -9.81200 0.03900 -0.59600 H H52 -8.67000 0.91400 -2.45300 H H53 -9.43900 -0.83900 -3.91900 H H54 -6.44100 -0.96700 -2.32800 H H55 -6.35400 1.54800 -2.53800 H H56 -6.90400 1.66500 -0.84900 H H57 -4.63200 2.54400 1.17700 H H58 1.60800 2.19800 -1.09700 H H59 1.74200 0.08900 -2.36700 H H60 0.91100 -1.34400 -0.64200 H H61 3.57500 2.55700 0.28400 H H62 3.70400 1.66900 1.82100 H H63 3.97600 -0.45400 0.59600 H H64 4.13100 -0.46400 -1.86300 H H65 3.60500 1.57800 -2.99200 H H66 5.73000 1.78500 -0.09700 H H67 5.75600 0.87000 2.15400 H H68 6.09700 -0.71500 1.42000 H H69 7.14400 2.75300 3.19600 H H70 10.27900 3.42700 3.23600 H H71 10.92300 3.79400 1.61700 H H72 9.26600 4.28100 2.04700 H H73 10.66500 -0.55800 0.32300 H H74 7.66700 -2.10000 1.03300 H H75 7.44600 -1.39400 -0.58600 H H76 10.61200 -5.10500 -1.81000 H H77 9.25100 -4.84400 1.02700 H H78 -1.00500 2.45800 1.72900 H H79 -8.29100 -2.60800 -0.92900 H H80 -9.24700 -3.94800 0.64900 H H81 -10.09300 -4.29200 2.91100 H H82 -9.54300 -0.22200 3.63500