# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JDP' 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 -5.41000 3.47300 -1.19200 1.000 C1 C -5.99200 3.84300 0.00600 1.000 O2 O 6.47300 0.57900 -0.00700 1.000 C3 C 5.85800 1.62800 0.00500 1.000 C4 C 4.38400 1.61800 0.00700 1.000 C5 C 3.67200 2.81600 0.01500 1.000 C6 C 2.28900 2.80300 0.01700 1.000 C7 C 1.59200 1.61200 0.01100 1.000 C8 C 2.27400 0.40100 0.00300 1.000 C9 C 3.68000 0.39800 -0.00500 1.000 C10 C 4.08400 -1.00600 -0.02100 1.000 C11 C 2.95800 -1.74100 -0.02700 1.000 C12 C 2.90700 -3.24700 -0.04200 1.000 N13 N 1.86400 -0.91800 -0.00400 1.000 C14 C 0.54000 -1.34500 -0.00500 1.000 N15 N -0.42900 -0.44300 -0.00400 1.000 C16 C -1.70300 -0.82100 -0.00200 1.000 N17 N -2.71600 0.12400 -0.00100 1.000 C18 C -2.38700 1.55200 -0.00000 1.000 C19 C -3.65800 2.36100 0.00200 1.000 C20 C -4.24000 2.73100 1.20000 1.000 C21 C -5.40600 3.47300 1.20200 1.000 C22 C -4.24400 2.73100 -1.19400 1.000 C23 C -2.00500 -2.18600 -0.00400 1.000 C24 C -3.44300 -2.62800 0.00300 1.000 O25 O -3.53600 -4.00500 -0.36100 1.000 C26 C -2.66900 -4.85100 0.40500 1.000 C27 C -1.22400 -4.57400 -0.01400 1.000 C28 C -0.96900 -3.09000 -0.00700 1.000 N29 N 0.28100 -2.64300 -0.01200 1.000 N30 N 6.52400 2.80000 0.01600 1.000 H31 H -5.87000 3.75800 -2.12700 1.000 H32 H -6.90300 4.42300 0.00800 1.000 H33 H 4.20200 3.75700 0.02000 1.000 H34 H 1.74800 3.73800 0.02300 1.000 H35 H 0.51200 1.62000 0.01300 1.000 H36 H 5.09600 -1.38300 -0.02600 1.000 H37 H 2.89700 -3.62100 0.98200 1.000 H38 H 2.00500 -3.57600 -0.55800 1.000 H39 H 3.78400 -3.63500 -0.56200 1.000 H40 H -3.64400 -0.16000 0.00000 1.000 H41 H -1.80300 1.78900 0.88900 1.000 H42 H -1.80500 1.79100 -0.89100 1.000 H43 H -3.78300 2.44000 2.13500 1.000 H44 H -5.86000 3.76300 2.13800 1.000 H45 H -3.78900 2.44100 -2.13000 1.000 H46 H -3.85800 -2.48900 1.00100 1.000 H47 H -4.00900 -2.02700 -0.70800 1.000 H48 H -2.79100 -4.63400 1.46600 1.000 H49 H -2.91500 -5.89500 0.21400 1.000 H50 H -0.54400 -5.06200 0.68500 1.000 H51 H -1.05500 -4.96600 -1.01700 1.000 H52 H 7.49400 2.80600 0.01500 1.000 H53 H 6.03300 3.63600 0.02600 1.000