# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'COW' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 9.48600 2.63000 2.12700 1.000 P1 P 9.39400 1.65600 1.01600 1.000 O2 O 10.66300 1.83200 0.04100 1.000 O3 O 9.37900 0.16100 1.61400 1.000 O4 O 8.03900 1.91600 0.18600 1.000 C5 C 6.74600 1.93600 0.79400 1.000 C6 C 6.01500 3.26200 0.46800 1.000 O7 O 6.94500 4.27300 0.07600 1.000 C8 C 5.11100 2.85000 -0.72200 1.000 N9 N 3.94900 3.73700 -0.81800 1.000 C10 C 3.90300 4.94700 -1.46400 1.000 N11 N 4.77500 5.67700 -2.15300 1.000 C12 C 4.42000 6.83500 -2.66700 1.000 N13 N 3.20300 7.33000 -2.53100 1.000 C14 C 2.26500 6.67100 -1.85900 1.000 N15 N 0.99200 7.19700 -1.72100 1.000 C16 C 2.59500 5.42900 -1.29100 1.000 N17 N 1.92300 4.50600 -0.56200 1.000 C18 C 2.71400 3.51000 -0.28800 1.000 O19 O 4.69900 1.50800 -0.38300 1.000 C20 C 5.84400 0.84700 0.18100 1.000 C21 C 5.39700 -0.13100 1.26900 1.000 O22 O 4.65900 -1.20000 0.67400 1.000 P23 P 4.03400 -2.41500 1.52600 1.000 O24 O 5.22400 -3.27500 2.18700 1.000 O25 O 3.16500 -1.87200 2.59500 1.000 O26 O 3.16400 -3.36000 0.55500 1.000 P27 P 1.99700 -4.44300 0.79900 1.000 O28 O 2.63700 -5.79500 1.39300 1.000 O29 O 1.01300 -3.89900 1.76200 1.000 O30 O 1.26300 -4.76400 -0.59600 1.000 C31 C 0.11500 -5.60900 -0.69500 1.000 C32 C -0.32700 -5.70000 -2.15700 1.000 C33 C -0.67800 -4.30200 -2.67200 1.000 C34 C 0.81000 -6.28300 -2.99900 1.000 C35 C -1.55600 -6.60500 -2.26300 1.000 O36 O -1.19300 -7.94400 -1.91900 1.000 C37 C -2.62400 -6.11600 -1.31800 1.000 O38 O -2.87200 -6.74000 -0.30900 1.000 N39 N -3.30200 -4.98400 -1.59600 1.000 C40 C -4.26500 -4.45200 -0.62900 1.000 C41 C -4.89100 -3.17200 -1.18500 1.000 C42 C -5.88200 -2.62400 -0.19100 1.000 O43 O -6.07000 -3.20200 0.85900 1.000 N44 N -6.56100 -1.49300 -0.46800 1.000 C45 C -7.52400 -0.96100 0.49900 1.000 C46 C -8.15000 0.32000 -0.05700 1.000 S47 S -9.34100 0.97700 1.13700 1.000 C48 C -9.89100 2.40600 0.26600 1.000 O49 O -9.43500 2.66200 -0.83300 1.000 C50 C -10.90400 3.29200 0.86800 1.000 C51 C -11.43600 4.36100 0.12900 1.000 N52 N -11.01200 4.58900 -1.17400 1.000 C53 C -11.34400 3.07000 2.17500 1.000 C54 C -12.29100 3.90200 2.73200 1.000 C55 C -12.81000 4.95900 2.00200 1.000 C56 C -12.39000 5.18800 0.70800 1.000 H57 H 11.51500 1.68900 0.47500 1.000 H58 H 9.31900 -0.53100 0.94100 1.000 H59 H 6.83000 1.80000 1.87200 1.000 H60 H 5.41600 3.59400 1.31600 1.000 H61 H 6.53500 5.12200 -0.13900 1.000 H62 H 5.67700 2.85400 -1.65300 1.000 H63 H 5.15300 7.40300 -3.22200 1.000 H64 H 0.77600 8.05500 -2.11800 1.000 H65 H 0.31600 6.70700 -1.22800 1.000 H66 H 2.43400 2.63400 0.27800 1.000 H67 H 6.38600 0.31400 -0.60000 1.000 H68 H 6.27300 -0.53300 1.77800 1.000 H69 H 4.76500 0.39000 1.98900 1.000 H70 H 5.83300 -3.66200 1.54300 1.000 H71 H 3.29300 -6.20800 0.81400 1.000 H72 H 0.36400 -6.60500 -0.32900 1.000 H73 H -0.69500 -5.19400 -0.09600 1.000 H74 H 0.20700 -3.66700 -2.62700 1.000 H75 H -1.02400 -4.37100 -3.70300 1.000 H76 H -1.46500 -3.87400 -2.05200 1.000 H77 H 1.12400 -7.23600 -2.57400 1.000 H78 H 0.46300 -6.43800 -4.02100 1.000 H79 H 1.65200 -5.59100 -3.00100 1.000 H80 H -1.93700 -6.58300 -3.28400 1.000 H81 H -0.84500 -8.03900 -1.02100 1.000 H82 H -3.15100 -4.52300 -2.43500 1.000 H83 H -5.04700 -5.19100 -0.45100 1.000 H84 H -3.75500 -4.23100 0.30800 1.000 H85 H -4.10900 -2.43300 -1.36300 1.000 H86 H -5.40100 -3.39300 -2.12200 1.000 H87 H -6.41000 -1.03100 -1.30800 1.000 H88 H -8.30600 -1.70000 0.67600 1.000 H89 H -7.01400 -0.73900 1.43600 1.000 H90 H -7.36800 1.05800 -0.23500 1.000 H91 H -8.66000 0.09800 -0.99400 1.000 H92 H -10.64200 3.86100 -1.69700 1.000 H93 H -11.08600 5.47600 -1.55900 1.000 H94 H -10.94300 2.24800 2.74800 1.000 H95 H -12.63000 3.72900 3.74300 1.000 H96 H -13.55200 5.60500 2.44800 1.000 H97 H -12.80000 6.01500 0.14600 1.000