# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CEM' 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 0.03200 -1.29500 -1.59400 1.000 C1 C 0.19600 0.12100 -1.67400 1.000 C2 C 0.93700 0.61900 -0.43200 1.000 N3 N 0.16400 0.28400 0.76500 1.000 C4 C 0.23700 1.08000 1.86900 1.000 C5 C -0.47700 0.76900 2.97700 1.000 C6 C -1.29300 -0.37000 2.98800 1.000 O7 O -1.93500 -0.64800 3.98200 1.000 C8 C -1.17700 0.79000 -1.75000 1.000 C9 C -1.90800 0.29900 -2.97300 1.000 O10 O -2.96600 -0.27100 -2.85700 1.000 C11 C 2.29100 -0.03900 -0.35700 1.000 O12 O 3.24500 0.47900 -0.88700 1.000 O13 O 2.43600 -1.20100 0.29700 1.000 H14 H -0.48000 -1.47300 -0.79400 1.000 H15 H 0.77100 0.37100 -2.56500 1.000 H16 H 1.06200 1.70000 -0.49300 1.000 H17 H -0.40000 -0.50400 0.77300 1.000 H18 H 0.86600 1.95800 1.86000 1.000 H19 H -0.41900 1.40000 3.85200 1.000 H20 H -1.35200 -1.00100 2.11400 1.000 H21 H -1.75300 0.54000 -0.85900 1.000 H22 H -1.05200 1.87100 -1.81100 1.000 H23 H -1.48600 0.45800 -3.95500 1.000 H24 H 3.30400 -1.62400 0.34500 1.000