# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CPX' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -3.92700 0.86200 1.21400 1.000 C1 C 7.72100 2.67400 0.12000 1.000 C2 C 7.65800 1.61000 -0.97800 1.000 C3 C 6.39000 2.36000 -0.56600 1.000 C4 C -3.87700 0.49200 0.05700 1.000 N5 N -4.93500 0.68000 -0.75700 1.000 C6 C -6.14500 1.32900 -0.24700 1.000 C7 C -6.92000 1.98300 -1.40400 1.000 C8 C -8.30600 1.30600 -1.44500 1.000 C9 C -8.50600 0.76500 -0.00800 1.000 C10 C -7.08700 0.27700 0.37500 1.000 N11 N -2.76400 -0.10500 -0.41200 1.000 C12 C -1.61400 -0.30900 0.47300 1.000 C13 C -1.80100 -1.60700 1.26100 1.000 C14 C -0.66900 -1.75300 2.27900 1.000 C15 C -3.14400 -1.57000 1.99300 1.000 C16 C -0.35600 -0.39900 -0.35200 1.000 O17 O -0.39600 -0.86100 -1.47200 1.000 N18 N 0.81500 0.03500 0.15600 1.000 C19 C 2.13200 -0.10700 -0.48300 1.000 C20 C 3.16700 0.56000 0.44700 1.000 C21 C 2.30200 1.53100 1.29300 1.000 C22 C 0.98900 0.72400 1.44800 1.000 N23 N 4.16900 1.29800 -0.32600 1.000 C24 C 5.35900 1.60100 0.22900 1.000 O25 O 5.60000 1.26300 1.36800 1.000 C26 C 2.47500 -1.58600 -0.66800 1.000 C27 C 2.58400 -2.33000 0.63800 1.000 O28 O 1.85700 -3.26700 0.86200 1.000 C29 C 1.59500 -2.29800 -1.71000 1.000 C30 C 2.86800 -3.02600 -2.17200 1.000 C31 C 3.65900 -1.83000 -1.61900 1.000 H32 H 8.20200 3.62100 -0.12500 1.000 H33 H 7.85100 2.33100 1.14600 1.000 H34 H 7.74700 0.56700 -0.67300 1.000 H35 H 8.09800 1.85700 -1.94400 1.000 H36 H 5.99500 3.10100 -1.26200 1.000 H37 H -4.89500 0.38600 -1.68000 1.000 H38 H -5.88100 2.08100 0.49700 1.000 H39 H -7.03200 3.05200 -1.22200 1.000 H40 H -6.39600 1.81800 -2.34500 1.000 H41 H -9.07900 2.03400 -1.69000 1.000 H42 H -8.30900 0.48800 -2.16500 1.000 H43 H -8.83600 1.55900 0.66200 1.000 H44 H -9.21400 -0.06500 -0.00300 1.000 H45 H -6.89300 -0.70700 -0.05100 1.000 H46 H -6.97100 0.25500 1.45900 1.000 H47 H -2.72400 -0.39900 -1.33500 1.000 H48 H -1.53500 0.52900 1.16500 1.000 H49 H -1.78400 -2.45400 0.57500 1.000 H50 H -0.84700 -2.63200 2.89800 1.000 H51 H 0.28000 -1.86500 1.75400 1.000 H52 H -0.63200 -0.86500 2.91100 1.000 H53 H -3.16100 -0.72300 2.67900 1.000 H54 H -3.95100 -1.46600 1.26700 1.000 H55 H -3.27700 -2.49500 2.55400 1.000 H56 H 2.12400 0.39600 -1.45000 1.000 H57 H 3.64500 -0.18500 1.08300 1.000 H58 H 2.12600 2.46500 0.75900 1.000 H59 H 2.76200 1.71900 2.26400 1.000 H60 H 0.15100 1.39500 1.63500 1.000 H61 H 1.08300 -0.00200 2.25500 1.000 H62 H 3.97600 1.56800 -1.23700 1.000 H63 H 3.31300 -2.02400 1.37400 1.000 H64 H 0.84800 -2.95900 -1.27100 1.000 H65 H 1.17900 -1.62600 -2.46100 1.000 H66 H 3.05500 -3.95800 -1.63900 1.000 H67 H 2.94000 -3.13500 -3.25400 1.000 H68 H 3.80700 -1.03100 -2.34500 1.000 H69 H 4.57900 -2.11400 -1.10700 1.000