# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JC2' 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 6.40700 0.33600 -1.01100 1.000 C1 C -1.68300 -1.58500 -1.46100 1.000 C2 C -3.75500 -0.36500 -1.07100 1.000 C3 C -5.72000 0.96000 -0.78900 1.000 C4 C -7.05600 0.89800 -0.09400 1.000 C5 C -8.15000 0.35700 -0.74500 1.000 C6 C -9.37500 0.30200 -0.10800 1.000 C7 C -7.18800 1.37800 1.19600 1.000 O8 O -0.50300 -1.96900 1.05600 1.000 P9 P -0.42500 -1.04200 -0.25800 1.000 N10 N 1.10500 -1.17400 -0.94800 1.000 C11 C 2.15200 -0.85300 0.03100 1.000 C12 C 2.66400 -2.14400 0.67200 1.000 C13 C 3.65000 -1.80200 1.79000 1.000 C14 C 2.90700 -1.10200 2.92900 1.000 C15 C 4.29200 -3.08800 2.31500 1.000 C16 C 3.29100 -0.15200 -0.66400 1.000 N17 N 4.23400 0.48300 0.06000 1.000 C18 C 5.28000 1.25500 -0.61600 1.000 O19 O 7.48200 0.82700 -1.64800 1.000 O20 O 6.34600 -0.84200 -0.75000 1.000 O21 O 3.35900 -0.15800 -1.87500 1.000 O22 O -0.67700 0.36700 0.11700 1.000 N23 N -3.01400 -1.47000 -0.86100 1.000 O24 O -4.97900 -0.25900 -0.52000 1.000 C25 C -9.50800 0.78600 1.17900 1.000 C26 C -8.41300 1.32100 1.83300 1.000 O27 O -3.31900 0.53700 -1.75900 1.000 C28 C 5.81000 2.33400 0.33100 1.000 C29 C 4.69600 3.33900 0.63300 1.000 N30 N 5.20500 4.37400 1.54300 1.000 H31 H -1.63000 -0.95700 -2.35100 1.000 H32 H -1.49700 -2.62300 -1.73700 1.000 H33 H -5.87400 1.06200 -1.86300 1.000 H34 H -5.15800 1.81600 -0.41900 1.000 H35 H -8.04600 -0.02100 -1.75100 1.000 H36 H -10.22900 -0.12000 -0.61700 1.000 H37 H -6.33300 1.79600 1.70600 1.000 H38 H -0.42400 -2.91600 0.87400 1.000 H39 H 1.24600 -2.09200 -1.34100 1.000 H40 H 1.74200 -0.20200 0.80200 1.000 H41 H 1.82400 -2.70200 1.08600 1.000 H42 H 3.16600 -2.75000 -0.08300 1.000 H43 H 4.42600 -1.14200 1.40200 1.000 H44 H 3.62000 -0.79200 3.69300 1.000 H45 H 2.38800 -0.22600 2.54000 1.000 H46 H 2.18200 -1.78800 3.36700 1.000 H47 H 4.82200 -3.58700 1.50400 1.000 H48 H 4.99500 -2.84500 3.11200 1.000 H49 H 3.51700 -3.74900 2.70400 1.000 H50 H 4.22100 0.42800 1.02800 1.000 H51 H 4.86600 1.72600 -1.50800 1.000 H52 H 8.17900 0.19900 -1.88100 1.000 H53 H -3.36200 -2.19100 -0.31200 1.000 H54 H -10.46500 0.74300 1.67700 1.000 H55 H -8.51700 1.69900 2.83900 1.000 H56 H 6.14300 1.87000 1.26000 1.000 H57 H 6.64700 2.85000 -0.13800 1.000 H58 H 4.36300 3.80200 -0.29500 1.000 H59 H 3.85900 2.82200 1.10300 1.000 H60 H 4.48700 5.05000 1.75800 1.000 H61 H 5.57900 3.96400 2.38500 1.000