# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JN5' 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 -6.14600 1.92500 -0.32000 1.000 C1 C -7.39500 2.00800 -0.91600 1.000 C2 C -8.31400 0.99900 -0.69900 1.000 N3 N -8.01300 -0.03400 0.06500 1.000 C4 C -6.83600 -0.14500 0.64800 1.000 C5 C -5.86500 0.82300 0.47200 1.000 C6 C -4.52200 0.68700 1.14200 1.000 C7 C -3.56600 -0.07100 0.21900 1.000 N8 N -2.26000 -0.20300 0.87000 1.000 C9 C -1.22700 -0.85700 0.22300 1.000 N10 N -0.05200 -0.96700 0.82600 1.000 N11 N -1.43600 -1.36200 -0.98400 1.000 C12 C -0.47000 -1.99400 -1.63000 1.000 C13 C 0.77200 -2.12300 -1.03000 1.000 C14 C 0.95600 -1.58600 0.23500 1.000 C15 C 2.28900 -1.70700 0.92800 1.000 C16 C 2.90600 -2.99800 0.58400 1.000 N17 N 3.38200 -3.99500 0.31800 1.000 C18 C 3.19000 -0.58500 0.48300 1.000 N19 N 3.69500 0.28900 1.26900 1.000 C20 C 4.48500 1.23700 0.73200 1.000 C21 C 5.16100 2.30600 1.35600 1.000 C22 C 5.92000 3.16500 0.62100 1.000 C23 C 6.04200 3.00800 -0.75300 1.000 C24 C 5.39300 1.97300 -1.38900 1.000 C25 C 4.61300 1.08400 -0.65300 1.000 S26 S 3.67100 -0.32400 -1.13400 1.000 H27 H -5.40900 2.69900 -0.47200 1.000 H28 H -7.64700 2.85100 -1.54300 1.000 H29 H -9.28800 1.05600 -1.16000 1.000 H30 H -6.62600 -1.00500 1.26700 1.000 H31 H -4.11800 1.67800 1.34900 1.000 H32 H -4.63600 0.13800 2.07700 1.000 H33 H -3.97000 -1.06200 0.01200 1.000 H34 H -3.45200 0.47800 -0.71600 1.000 H35 H -2.12000 0.16800 1.75600 1.000 H36 H -0.64700 -2.40400 -2.61300 1.000 H37 H 1.57900 -2.63400 -1.53500 1.000 H38 H 2.14400 -1.65000 2.00700 1.000 H39 H 5.07700 2.44300 2.42400 1.000 H40 H 6.43100 3.97900 1.11200 1.000 H41 H 6.64700 3.69700 -1.32300 1.000 H42 H 5.48900 1.85200 -2.45800 1.000