# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0S7' 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 -2.01500 5.14800 -0.00400 1.000 C1 C -2.80200 3.86200 -0.00300 1.000 C2 C -2.26100 2.57300 -0.00100 1.000 C3 C -3.29500 1.68700 0.00000 1.000 N4 N -3.19000 0.29800 -0.00200 1.000 C5 C -1.94000 -0.30300 -0.00100 1.000 N6 N -0.83600 0.43800 0.00400 1.000 C7 C 0.35900 -0.13300 0.00500 1.000 N8 N 1.48900 0.66700 0.01000 1.000 C9 C 2.82000 0.05500 0.01200 1.000 C10 C 3.88600 1.15200 0.01700 1.000 C11 C 5.25500 0.52300 0.01900 1.000 C12 C 5.88800 0.22100 1.21500 1.000 C13 C 7.14700 -0.35700 1.16900 1.000 C14 C 7.72600 -0.61300 -0.06000 1.000 N15 N 7.09500 -0.31200 -1.17800 1.000 C16 C 5.89400 0.23300 -1.17200 1.000 N17 N 0.50100 -1.45000 0.00300 1.000 C18 C -0.55700 -2.24900 -0.00100 1.000 C19 C -1.82200 -1.69500 0.00300 1.000 Br20 Br -3.36000 -2.79600 -0.00200 1.000 N21 N -4.44800 2.40500 -0.00100 1.000 N22 N -4.10600 3.76400 0.00300 1.000 H23 H -1.82500 5.45600 -1.03100 1.000 H24 H -2.58500 5.92300 0.50900 1.000 H25 H -1.06600 4.99300 0.51100 1.000 H26 H -1.21000 2.32500 -0.00100 1.000 H27 H -3.99100 -0.24900 -0.00500 1.000 H28 H 1.40000 1.63300 0.01200 1.000 H29 H 2.93300 -0.56600 0.90000 1.000 H30 H 2.93800 -0.56200 -0.88000 1.000 H31 H 3.77300 1.77300 -0.87200 1.000 H32 H 3.76900 1.76900 0.90800 1.000 H33 H 5.41100 0.43300 2.16100 1.000 H34 H 7.66900 -0.60500 2.08100 1.000 H35 H 8.70600 -1.06300 -0.10500 1.000 H36 H 5.40600 0.46000 -2.10900 1.000 H37 H -0.43000 -3.32200 0.00100 1.000 H38 H -5.34700 2.04200 -0.00100 1.000