# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CV1' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -1.64000 2.40800 -0.14500 1.000 Br1 Br 4.69000 2.24400 0.32400 1.000 C2 C -1.42400 1.48100 -1.06500 1.000 N3 N -0.21400 1.02200 -1.32400 1.000 C4 C 0.85300 1.49000 -0.69700 1.000 C5 C 0.69300 2.60500 0.14700 1.000 C6 C -0.61400 3.05600 0.41100 1.000 N7 N -0.83100 4.15100 1.23000 1.000 N8 N 1.94100 2.98700 0.50700 1.000 C9 C 2.81800 2.11500 0.08900 1.000 N10 N 2.17000 1.09700 -0.54300 1.000 P11 P -0.42700 -3.72000 0.42100 1.000 P12 P -3.07300 -2.53100 -0.20100 1.000 C13 C 2.69300 -0.21300 -0.92200 1.000 O14 O -0.11700 -3.57800 -1.01900 1.000 O15 O -2.43100 -2.04400 -1.59400 1.000 C16 C -2.99200 2.56600 0.39100 1.000 C17 C 4.07000 -0.45100 -0.28600 1.000 O18 O 5.10200 -0.31300 -1.26500 1.000 O19 O -0.26300 -5.26100 0.85800 1.000 O20 O -4.16100 -3.49700 -0.47000 1.000 C21 C -4.00900 2.79000 -0.73700 1.000 O22 O -4.30900 4.18000 -0.88000 1.000 C23 C 4.01200 -1.90100 0.23400 1.000 O24 O 4.92700 -2.72500 -0.49100 1.000 O25 O -1.93500 -3.24000 0.69600 1.000 C26 C -5.24800 2.01000 -0.23900 1.000 O27 O -6.14200 2.88000 0.45900 1.000 C28 C 2.56600 -2.36300 -0.01500 1.000 O29 O 1.80600 -1.21800 -0.41000 1.000 C30 C -4.66000 0.95800 0.71800 1.000 O31 O -3.34500 1.35600 1.06300 1.000 C32 C 1.99900 -2.97900 1.26200 1.000 O33 O 0.58300 -2.80500 1.28200 1.000 C34 C -4.66300 -0.40700 0.02900 1.000 O35 O -3.67100 -1.26000 0.59000 1.000 H36 H -2.26300 1.08800 -1.61900 1.000 H37 H -1.73600 4.45400 1.40500 1.000 H38 H -0.07900 4.61500 1.62900 1.000 H39 H 2.76400 -0.27800 -2.00600 1.000 H40 H -3.02500 3.39800 1.09200 1.000 H41 H 4.23300 0.24400 0.53800 1.000 H42 H 5.99400 -0.45300 -0.91800 1.000 H43 H -3.64200 2.37600 -1.67600 1.000 H44 H -4.94700 4.37500 -1.58000 1.000 H45 H 4.23900 -1.93100 1.30000 1.000 H46 H 5.85200 -2.45500 -0.40500 1.000 H47 H -5.75800 1.52800 -1.07300 1.000 H48 H -6.49200 3.60000 -0.08300 1.000 H49 H 2.52900 -3.10000 -0.81900 1.000 H50 H -5.28200 0.90600 1.61700 1.000 H51 H 2.23500 -4.04300 1.28900 1.000 H52 H 2.43800 -2.48700 2.13000 1.000 H53 H -5.64300 -0.86800 0.15100 1.000 H54 H -4.46100 -0.27200 -1.03400 1.000 H55 H -0.84400 -5.86900 0.38100 1.000 H56 H -2.05300 -2.75900 -2.12500 1.000