# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CN4' 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 -5.35000 -0.87500 -1.00700 1.000 C1 C -4.34400 -0.17800 -0.07100 1.000 C2 C -4.04200 -3.97100 0.88400 1.000 C3 C -3.63300 0.96700 -0.78600 1.000 C4 C -2.03500 2.84100 -0.49900 1.000 C5 C -2.62100 4.09400 -0.55300 1.000 C6 C -1.97200 5.13400 -1.19800 1.000 C7 C -0.74000 4.92400 -1.78800 1.000 C8 C -0.15200 3.67600 -1.73800 1.000 C9 C 1.13900 1.24800 -1.07300 1.000 C10 C 3.94100 -1.32600 -1.00800 1.000 C11 C 4.19700 -3.49000 -0.01500 1.000 C12 C 5.11200 -3.83100 -0.99700 1.000 C13 C 5.44500 -2.91500 -1.98000 1.000 F14 F -3.82500 4.30200 0.02300 1.000 C15 C -0.79800 2.63000 -1.09200 1.000 N16 N -0.20300 1.36400 -1.04000 1.000 O17 O 1.83000 2.23600 -1.20800 1.000 C18 C 1.78200 -0.10800 -0.94400 1.000 C19 C 3.30300 0.03900 -1.01300 1.000 C20 C 3.78700 0.82500 0.17800 1.000 C21 C 3.42500 0.43600 1.45500 1.000 C22 C 3.86700 1.15500 2.54900 1.000 C23 C 4.67400 2.26600 2.36600 1.000 F24 F 5.10300 2.97300 3.43400 1.000 C25 C 5.03600 2.65400 1.08700 1.000 C26 C 4.59600 1.93000 -0.00500 1.000 C27 C 4.85900 -1.66400 -1.98500 1.000 F28 F 5.68500 -5.05500 -0.99100 1.000 C29 C 3.61200 -2.23800 -0.02200 1.000 C30 C -2.73700 1.71000 0.20700 1.000 N31 N -4.78700 -1.81200 -1.96900 1.000 N32 N -3.40300 -1.25000 0.32800 1.000 C33 C -2.81200 -1.91500 -0.74700 1.000 S34 S -3.14500 -1.61600 1.93700 1.000 O35 O -3.59900 -0.48800 2.67200 1.000 O36 O -1.80700 -2.08600 2.02000 1.000 C37 C -4.31300 -2.94800 1.99400 1.000 C38 C -4.77200 -3.58600 -0.34800 1.000 C39 C -3.86100 -2.84500 -1.40000 1.000 H40 H -6.10800 -1.36800 -0.40200 1.000 H41 H -5.86700 -0.08600 -1.57200 1.000 H42 H -4.86900 0.20400 0.81000 1.000 H43 H -2.97300 -4.01300 0.67700 1.000 H44 H -4.38200 -4.95600 1.20900 1.000 H45 H -3.02300 0.56700 -1.59600 1.000 H46 H -4.37300 1.65600 -1.19400 1.000 H47 H -2.43100 6.11100 -1.23900 1.000 H48 H -0.23700 5.73700 -2.29100 1.000 H49 H 0.81100 3.51300 -2.20000 1.000 H50 H 3.93700 -4.20400 0.75200 1.000 H51 H 6.15800 -3.18100 -2.74600 1.000 H52 H -0.75700 0.57000 -0.97900 1.000 H53 H 1.50300 -0.55300 0.01200 1.000 H54 H 1.44200 -0.75100 -1.75600 1.000 H55 H 3.57600 0.56400 -1.92900 1.000 H56 H 2.79500 -0.43000 1.59700 1.000 H57 H 3.58400 0.85200 3.54600 1.000 H58 H 5.66500 3.52000 0.94300 1.000 H59 H 4.87900 2.23200 -1.00300 1.000 H60 H 5.11800 -0.94900 -2.75200 1.000 H61 H 2.89800 -1.97200 0.74300 1.000 H62 H -3.34700 2.11000 1.01700 1.000 H63 H -1.99700 1.02200 0.61500 1.000 H64 H -5.50100 -2.22500 -2.55100 1.000 H65 H -2.43200 -1.22000 -1.48600 1.000 H66 H -1.98500 -2.52500 -0.37600 1.000 H67 H -5.31900 -2.54500 1.87500 1.000 H68 H -4.24100 -3.44300 2.96300 1.000 H69 H -5.15700 -4.50000 -0.81100 1.000 H70 H -5.61600 -2.96400 -0.07700 1.000 H71 H -3.42200 -3.52400 -2.14000 1.000