# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JZY' 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 -2.09500 -1.37500 0.00900 1.000 N1 N -3.19100 -0.65900 0.21900 1.000 C2 C -3.26300 0.60600 -0.18700 1.000 N3 N -2.26700 1.20500 -0.80700 1.000 C4 C -1.11100 0.55200 -1.06400 1.000 C5 C -1.00600 -0.77800 -0.65000 1.000 S6 S 0.57500 -1.40700 -1.09300 1.000 C7 C 1.03400 0.12800 -1.81200 1.000 C8 C 0.05200 1.00800 -1.70600 1.000 N9 N -2.02300 -2.69000 0.43800 1.000 C10 C -3.26900 -3.09700 1.10300 1.000 C11 C -3.12400 -4.53400 1.61200 1.000 O12 O -2.79000 -5.39100 0.51700 1.000 C13 C -1.58100 -5.02400 -0.15300 1.000 C14 C -1.71100 -3.59200 -0.68000 1.000 C15 C -4.50800 1.36900 0.06900 1.000 C16 C -5.75900 0.81800 -0.22500 1.000 N17 N -6.84500 1.53000 0.01800 1.000 C18 C -6.76000 2.74900 0.53100 1.000 N19 N -5.59200 3.30500 0.82300 1.000 C20 C -4.46100 2.65500 0.61500 1.000 C21 C -3.13900 3.29300 0.95600 1.000 N22 N -7.92000 3.46000 0.76900 1.000 C23 C 2.36500 0.40400 -2.46100 1.000 N24 N 3.30600 0.91300 -1.45400 1.000 C25 C 4.67200 0.97000 -1.99000 1.000 C26 C 5.58500 1.67100 -0.97900 1.000 N27 N 5.45500 0.99000 0.31900 1.000 C28 C 4.10300 0.77300 0.85700 1.000 C29 C 3.24800 0.10800 -0.22600 1.000 S30 S 6.79300 0.48200 1.15000 1.000 O31 O 6.32300 -0.60000 1.94300 1.000 O32 O 7.77500 0.27900 0.14400 1.000 C33 C 7.23800 1.89300 2.19900 1.000 H34 H 0.13900 2.01400 -2.08800 1.000 H35 H -3.46700 -2.43100 1.94300 1.000 H36 H -4.09500 -3.04400 0.39300 1.000 H37 H -2.33400 -4.57600 2.36200 1.000 H38 H -4.06500 -4.85900 2.05600 1.000 H39 H -0.74600 -5.08100 0.54500 1.000 H40 H -1.40700 -5.70400 -0.98700 1.000 H41 H -2.51100 -3.54800 -1.41900 1.000 H42 H -0.77100 -3.28800 -1.14200 1.000 H43 H -5.83500 -0.17400 -0.64300 1.000 H44 H -2.72400 3.76600 0.06600 1.000 H45 H -3.28700 4.04500 1.73100 1.000 H46 H -2.45000 2.53000 1.31700 1.000 H47 H -8.78200 3.06600 0.56000 1.000 H48 H -7.87400 4.35300 1.14500 1.000 H49 H 2.75800 -0.51700 -2.89200 1.000 H50 H 2.23800 1.14800 -3.24800 1.000 H51 H 5.03500 -0.04200 -2.16800 1.000 H52 H 4.67200 1.52700 -2.92700 1.000 H53 H 6.61900 1.61500 -1.31900 1.000 H54 H 5.28600 2.71400 -0.87700 1.000 H55 H 4.15700 0.12400 1.73100 1.000 H56 H 3.66200 1.73000 1.13600 1.000 H57 H 2.21600 0.04000 0.11600 1.000 H58 H 3.63200 -0.89200 -0.42900 1.000 H59 H 6.40800 2.12600 2.86600 1.000 H60 H 8.12000 1.64400 2.78900 1.000 H61 H 7.45300 2.75800 1.57200 1.000