# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FDJ' 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 -5.29800 -0.40900 0.86500 1.000 C1 C -6.68200 -2.28900 0.77500 1.000 C2 C -6.52100 -2.32600 -0.63100 1.000 C3 C -5.74900 -1.39400 -1.22900 1.000 C4 C -7.20200 -3.39300 -1.45000 1.000 O5 O -4.74200 0.45100 1.52100 1.000 N6 N -5.13700 -0.43300 -0.47000 1.000 N7 N -6.06300 -1.32600 1.48700 1.000 O8 O -7.37400 -3.12000 1.33700 1.000 P9 P 1.17100 1.56500 0.73700 1.000 P10 P 3.86400 0.41000 0.28700 1.000 P11 P 6.25700 -1.15400 -0.54300 1.000 C12 C -4.29900 0.57900 -1.11800 1.000 O13 O 0.88800 1.17900 2.27400 1.000 O14 O 4.19400 0.16100 1.70900 1.000 O15 O 6.61600 -1.42600 1.00300 1.000 C16 C -4.88300 1.99000 -0.88500 1.000 O17 O 1.67900 2.95300 0.66200 1.000 O18 O 4.58200 1.76600 -0.20000 1.000 Cl19 Cl 3.64800 -2.50500 -0.18100 1.000 O20 O 6.77500 -2.38800 -1.43900 1.000 C21 C -3.63700 2.88500 -0.70200 1.000 O22 O -3.58700 3.88800 -1.71800 1.000 O23 O 2.26900 0.55800 0.12500 1.000 C24 C 4.45100 -0.98600 -0.72700 1.000 O25 O 6.91700 0.09300 -0.99100 1.000 C26 C -2.44800 1.90900 -0.84700 1.000 O27 O -2.99100 0.61400 -0.50800 1.000 C28 C -1.32700 2.28700 0.12300 1.000 O29 O -0.19500 1.44600 -0.10700 1.000 H30 H -5.61500 -1.40600 -2.30000 1.000 H31 H -7.77500 -4.04600 -0.79100 1.000 H32 H -7.87300 -2.92500 -2.17000 1.000 H33 H -6.45100 -3.97900 -1.98000 1.000 H34 H -6.16800 -1.29400 2.45100 1.000 H35 H -4.21500 0.37300 -2.18600 1.000 H36 H 0.55300 0.28100 2.39900 1.000 H37 H 6.21600 -2.22800 1.36500 1.000 H38 H -5.46100 2.31300 -1.75000 1.000 H39 H -5.49900 2.00400 0.01500 1.000 H40 H 4.40900 1.99200 -1.12400 1.000 H41 H 7.73000 -2.53600 -1.38900 1.000 H42 H -3.63700 3.34200 0.28800 1.000 H43 H -4.34200 4.49300 -1.71100 1.000 H44 H 4.20800 -0.80300 -1.77300 1.000 H45 H -2.07900 1.91100 -1.87200 1.000 H46 H -1.04500 3.32800 -0.03500 1.000 H47 H -1.67400 2.15600 1.14800 1.000