# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JPD' 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 1.97700 -0.16300 -0.19700 1.000 C1 C 1.19600 -2.51100 -0.59600 1.000 C2 C -3.96800 -1.27600 0.00300 1.000 C3 C -1.41500 3.42100 0.67200 1.000 C4 C -1.16800 2.06600 0.00600 1.000 C5 C 0.27900 1.63200 0.25400 1.000 O6 O 1.16600 2.66800 -0.17100 1.000 C7 C 0.57100 0.35500 -0.53600 1.000 N8 N -0.37800 -0.70800 -0.14700 1.000 C9 C 0.22200 -1.92600 0.43400 1.000 C10 C 1.01400 -1.51500 1.68100 1.000 C11 C 2.05200 -0.45700 1.30300 1.000 O12 O 2.94900 0.82600 -0.54300 1.000 C13 C 2.23400 -1.45500 -0.97600 1.000 C14 C -1.70900 -0.57400 -0.31100 1.000 O15 O -2.15200 0.36800 -0.93900 1.000 O16 O -2.54800 -1.48300 0.22000 1.000 H17 H 1.69900 -3.37800 -0.16800 1.000 H18 H 0.64400 -2.81400 -1.48500 1.000 H19 H -4.53000 -2.07800 0.48200 1.000 H20 H -4.26500 -0.31800 0.43100 1.000 H21 H -4.17600 -1.27500 -1.06700 1.000 H22 H -2.44500 3.73000 0.49500 1.000 H23 H -1.24000 3.33600 1.74400 1.000 H24 H -0.73600 4.16200 0.25000 1.000 H25 H -1.84600 1.32500 0.42800 1.000 H26 H -1.34300 2.15000 -1.06600 1.000 H27 H 0.42400 1.44300 1.31700 1.000 H28 H 1.09200 2.89000 -1.11000 1.000 H29 H 0.49400 0.55200 -1.60500 1.000 H30 H -0.55200 -2.65200 0.68400 1.000 H31 H 0.33100 -1.10400 2.42500 1.000 H32 H 1.51900 -2.38800 2.09400 1.000 H33 H 3.04800 -0.82400 1.55000 1.000 H34 H 1.85600 0.45800 1.86200 1.000 H35 H 3.86100 0.56300 -0.35400 1.000 H36 H 2.16900 -1.25200 -2.04500 1.000 H37 H 3.23100 -1.82700 -0.74100 1.000