# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'DOI' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy P0 P -5.89500 -1.20700 0.17100 1.000 O1 O -5.37600 -2.17200 -0.82400 1.000 O2 O -6.50500 -2.00800 1.42800 1.000 O3 O -7.04800 -0.30900 -0.50300 1.000 O4 O -4.69700 -0.25600 0.67200 1.000 P5 P 5.39600 -1.08100 -0.57400 1.000 O6 O 6.52800 -2.22200 -0.66500 1.000 O7 O 4.19500 -1.43500 -1.58500 1.000 O8 O 5.98300 0.22700 -0.94400 1.000 C9 C -4.12200 0.33400 -0.49600 1.000 C10 C -2.97100 1.25600 -0.08800 1.000 O11 O -1.88500 0.48500 0.47600 1.000 C12 C -0.71800 1.32800 0.36200 1.000 N13 N 0.50400 0.52300 0.43200 1.000 C14 C 1.76000 0.97900 0.74400 1.000 N15 N 2.27600 2.15900 1.07000 1.000 C16 C 3.56100 2.28000 1.32800 1.000 N17 N 4.39200 1.25500 1.28400 1.000 C18 C 3.96700 0.03700 0.97300 1.000 O19 O 4.82800 -1.00800 0.93000 1.000 C20 C 2.60500 -0.14400 0.68900 1.000 N21 N 1.83600 -1.20500 0.34500 1.000 C22 C 0.60300 -0.81600 0.19400 1.000 C23 C -0.84500 1.99300 -1.02600 1.000 C24 C -2.36000 1.94500 -1.32800 1.000 O25 O -2.88300 3.26700 -1.47500 1.000 H26 H -7.21800 -2.56500 1.08500 1.000 H27 H -7.35800 0.30500 0.17700 1.000 H28 H 3.84100 -2.29200 -1.31000 1.000 H29 H 64.06700 57.12000 36.31600 1.000 H30 H -4.88200 0.91300 -1.02200 1.000 H31 H -3.74500 -0.45100 -1.15100 1.000 H32 H -3.31800 2.00200 0.62600 1.000 H33 H -0.71800 2.08400 1.14700 1.000 H34 H 3.94900 3.25400 1.58600 1.000 H35 H -0.22100 -1.45900 -0.07900 1.000 H36 H -0.28900 1.42600 -1.77300 1.000 H37 H -0.49500 3.02400 -0.98900 1.000 H38 H -2.55200 1.35700 -2.22600 1.000 H39 H -2.44400 3.65700 -2.24400 1.000