# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JAK' 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 1.06700 3.67800 0.00500 1.000 C1 C 0.06400 2.55400 0.00300 1.000 N2 N -1.22800 2.70600 -0.00100 1.000 C3 C -1.82900 1.48900 -0.00200 1.000 C4 C -3.15900 1.05700 -0.00600 1.000 N5 N -3.45700 -0.22300 -0.00400 1.000 C6 C -2.52500 -1.17200 -0.00000 1.000 C7 C -1.16300 -0.82600 0.00300 1.000 C8 C -0.80400 0.52900 0.00300 1.000 N9 N 0.37700 1.22800 -0.00000 1.000 C10 C 1.72500 0.65500 -0.00300 1.000 C11 C 1.91600 -0.20900 1.24700 1.000 C12 C 3.30300 -0.85400 1.20800 1.000 N13 N 3.42800 -1.67700 -0.00200 1.000 C14 C 3.29500 -0.86100 -1.21600 1.000 C15 C 1.90800 -0.21600 -1.24900 1.000 C16 C -0.42000 -2.08600 0.00800 1.000 C17 C -1.32800 -3.07500 0.00700 1.000 N18 N -2.59000 -2.54600 0.00200 1.000 H19 H 1.37900 3.88900 -1.01800 1.000 H20 H 0.61300 4.57000 0.43700 1.000 H21 H 1.93600 3.39000 0.59700 1.000 H22 H -3.95500 1.78700 -0.00900 1.000 H23 H 2.46200 1.45700 -0.00700 1.000 H24 H 1.82900 0.41400 2.13700 1.000 H25 H 1.15300 -0.98800 1.27100 1.000 H26 H 4.06600 -0.07500 1.19700 1.000 H27 H 3.43700 -1.48100 2.08900 1.000 H28 H 4.29800 -2.18800 -0.00300 1.000 H29 H 4.05800 -0.08200 -1.21500 1.000 H30 H 3.42300 -1.49300 -2.09400 1.000 H31 H 1.14500 -0.99500 -1.26400 1.000 H32 H 1.81500 0.40200 -2.14200 1.000 H33 H 0.65400 -2.19800 0.01100 1.000 H34 H -1.09700 -4.13000 0.00900 1.000 H35 H -3.41000 -3.06400 -0.00000 1.000