# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J1V' 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 6.35000 -0.94500 0.46700 1.000 C1 C 7.21700 -2.10800 -0.01800 1.000 C2 C 6.57400 -3.43200 0.40100 1.000 C3 C 5.18000 -3.54100 -0.22000 1.000 C4 C 4.31300 -2.37700 0.26400 1.000 C5 C 4.95600 -1.05400 -0.15500 1.000 C6 C 4.10200 0.09300 0.32200 1.000 O7 O 4.56300 0.91600 1.08400 1.000 N8 N 2.82600 0.20300 -0.09700 1.000 C9 C 1.99600 1.31800 0.36600 1.000 C10 C 2.23600 2.52100 -0.50800 1.000 O11 O 3.02300 2.45400 -1.42900 1.000 N12 N 1.57700 3.67100 -0.26800 1.000 O13 O 1.80200 4.80200 -1.09000 1.000 C14 C 0.54300 0.92600 0.29400 1.000 C15 C -0.32300 1.30000 1.30500 1.000 C16 C -1.65500 0.94400 1.24400 1.000 C17 C 0.07900 0.19800 -0.78700 1.000 C18 C -1.25200 -0.16400 -0.85800 1.000 C19 C -2.12700 0.20600 0.16100 1.000 C20 C -3.55800 -0.18100 0.09000 1.000 C21 C -4.43500 0.19800 1.10400 1.000 C22 C -5.76700 -0.16300 1.03500 1.000 F23 F -6.61800 0.20400 2.01700 1.000 C24 C -6.23100 -0.90300 -0.04300 1.000 F25 F -7.53400 -1.25400 -0.10800 1.000 C26 C -5.36100 -1.28200 -1.05400 1.000 F27 F -5.81700 -2.00200 -2.10200 1.000 C28 C -4.02900 -0.92000 -0.99400 1.000 H29 H 6.26700 -0.98000 1.55300 1.000 H30 H 6.80800 -0.00200 0.16800 1.000 H31 H 7.29900 -2.07200 -1.10400 1.000 H32 H 8.21000 -2.03100 0.42500 1.000 H33 H 7.19100 -4.26100 0.05600 1.000 H34 H 6.49100 -3.46800 1.48700 1.000 H35 H 5.26200 -3.50500 -1.30600 1.000 H36 H 4.72200 -4.48400 0.07900 1.000 H37 H 3.32000 -2.45500 -0.17800 1.000 H38 H 4.23100 -2.41300 1.35100 1.000 H39 H 5.03800 -1.01800 -1.24100 1.000 H40 H 2.45800 -0.45500 -0.70700 1.000 H41 H 2.25600 1.56000 1.39700 1.000 H42 H 0.94700 3.72500 0.46800 1.000 H43 H 1.28400 5.57900 -0.84100 1.000 H44 H 0.04400 1.87300 2.14500 1.000 H45 H -2.33000 1.23600 2.03500 1.000 H46 H 0.75800 -0.08900 -1.57600 1.000 H47 H -1.61300 -0.73200 -1.70300 1.000 H48 H -4.07400 0.77400 1.94400 1.000 H49 H -3.35200 -1.21200 -1.78400 1.000