# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9MD' 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 3.62600 2.67400 0.98400 1.000 C1 C 2.36700 2.23600 0.56100 1.000 C2 C 2.19600 0.89600 0.17100 1.000 C3 C 0.28000 1.99000 -0.01400 1.000 C4 C -1.14200 2.29700 -0.28400 1.000 C5 C 1.25800 -1.55000 -0.86900 1.000 C6 C 3.19600 -2.28900 -2.25700 1.000 C7 C 2.18800 -1.16000 -2.02100 1.000 C8 C -3.04800 -3.78600 0.80000 1.000 C9 C -5.37200 -3.31500 1.58600 1.000 C10 C -3.91300 -1.44200 0.80800 1.000 C11 C -3.13500 1.95200 -1.57800 1.000 C12 C 2.43400 -3.58800 -2.54000 1.000 C13 C 1.49400 -3.88400 -1.36800 1.000 O14 O 0.60400 -2.78200 -1.18300 1.000 C15 C 0.21100 -0.45400 -0.66500 1.000 C16 C -0.80300 -0.91000 0.35200 1.000 O17 O -0.86900 -0.35900 1.43100 1.000 N18 N -1.63500 -1.93000 0.06400 1.000 C19 C -2.67700 -2.31800 1.01900 1.000 C20 C -4.13500 -4.19100 1.79700 1.000 C21 C -5.00100 -1.84700 1.80400 1.000 N22 N 0.86700 0.76600 -0.18800 1.000 C23 C 3.27100 0.02000 0.20800 1.000 C24 C 4.50800 0.46700 0.62800 1.000 C25 C 4.68300 1.79100 1.01500 1.000 N26 N 1.16600 2.84900 0.42600 1.000 C27 C -1.80900 1.66100 -1.33200 1.000 C28 C -3.80300 2.87200 -0.78900 1.000 C29 C -3.14800 3.50300 0.25500 1.000 C30 C -1.82200 3.22000 0.51200 1.000 Cl31 Cl -5.47200 3.23300 -1.10500 1.000 F32 F 5.89900 2.21500 1.42300 1.000 Cl33 Cl 5.85200 -0.63000 0.67400 1.000 H34 H 3.77000 3.70300 1.28100 1.000 H35 H 1.84100 -1.67000 0.04400 1.000 H36 H 3.82600 -2.04300 -3.11200 1.000 H37 H 3.81800 -2.41500 -1.37100 1.000 H38 H 1.60100 -1.00000 -2.92500 1.000 H39 H 2.72100 -0.24400 -1.76400 1.000 H40 H -3.41800 -3.92000 -0.21600 1.000 H41 H -2.16700 -4.41000 0.95100 1.000 H42 H -5.74300 -3.44900 0.57000 1.000 H43 H -6.14700 -3.60300 2.29600 1.000 H44 H -3.64900 -0.39600 0.96300 1.000 H45 H -4.28400 -1.57600 -0.20900 1.000 H46 H -3.65200 1.46000 -2.38900 1.000 H47 H 1.85200 -3.47700 -3.45500 1.000 H48 H 3.14300 -4.40800 -2.65600 1.000 H49 H 0.91800 -4.78400 -1.58300 1.000 H50 H 2.08000 -4.03500 -0.46200 1.000 H51 H -0.29100 -0.25000 -1.61100 1.000 H52 H -1.54400 -2.40800 -0.77500 1.000 H53 H -2.30600 -2.18400 2.03500 1.000 H54 H -4.40000 -5.23700 1.64200 1.000 H55 H -3.76500 -4.05700 2.81300 1.000 H56 H -5.88200 -1.22300 1.65400 1.000 H57 H -4.63100 -1.71300 2.82100 1.000 H58 H 3.14100 -1.01000 -0.09000 1.000 H59 H -1.28900 0.94300 -1.94800 1.000 H60 H -3.67400 4.22000 0.86800 1.000 H61 H -1.31200 3.71200 1.32700 1.000