# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CJ1' 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 4.94500 0.70300 0.91800 1.000 C1 C 2.92800 -0.06200 0.10800 1.000 C2 C 3.58700 -1.20200 -0.38900 1.000 C3 C 4.96700 -1.33000 -0.17900 1.000 C4 C 2.55900 -2.01900 -1.03400 1.000 P5 P -5.06800 -0.81700 0.34700 1.000 O6 O -5.02500 -1.71000 -0.83200 1.000 O7 O -3.64200 -0.08900 0.52100 1.000 C8 C -3.02500 0.67100 -0.52000 1.000 C9 C -1.68600 1.22200 -0.02400 1.000 C10 C -1.05900 2.14900 -1.08800 1.000 O11 O -1.32800 3.51900 -0.77900 1.000 C12 C 0.45500 1.85800 -0.99400 1.000 C13 C 0.56400 0.78800 0.11500 1.000 O14 O -0.73200 0.15000 0.14100 1.000 N15 N 1.60600 -0.18700 -0.21600 1.000 C16 C 1.39800 -1.35900 -0.89800 1.000 N17 N 3.64500 0.85800 0.75100 1.000 O18 O 5.63700 1.66300 1.57900 1.000 N19 N 5.60000 -0.35900 0.46900 1.000 O20 O 5.64100 -2.41000 -0.63900 1.000 O21 O -6.21500 0.29300 0.13900 1.000 H22 H 2.70600 -2.96900 -1.52700 1.000 H23 H -2.85600 0.03100 -1.38600 1.000 H24 H -3.67600 1.49800 -0.80100 1.000 H25 H -1.82200 1.75900 0.91500 1.000 H26 H -1.43500 1.90100 -2.08000 1.000 H27 H -0.95600 4.14500 -1.41600 1.000 H28 H 0.82800 1.46500 -1.94000 1.000 H29 H 1.00100 2.75800 -0.71400 1.000 H30 H 0.77500 1.25800 1.07600 1.000 H31 H 0.44300 -1.70000 -1.27000 1.000 H32 H -6.30000 0.91400 0.87500 1.000 O33 O -5.39200 -1.68300 1.66500 1.000 H34 H -6.23800 -2.15100 1.63000 1.000 H35 H 5.68900 1.52300 2.53400 1.000 H36 H 5.99100 -2.30400 -1.53400 1.000