# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CSQ' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -5.02700 3.79100 1.45900 1.000 C1 C -4.37100 3.17500 0.34900 1.000 C2 C -3.73600 1.85800 0.79900 1.000 O3 O -4.76200 0.91600 1.15400 1.000 C4 C -2.92700 1.24400 -0.36000 1.000 O5 O -1.55300 1.10600 0.00700 1.000 C6 C -3.57100 -0.14700 -0.57700 1.000 O7 O -2.57300 -1.14000 -0.82000 1.000 C8 C -4.27900 -0.39300 0.78500 1.000 N9 N -5.39500 -1.32900 0.62800 1.000 C10 C -6.41800 -1.02000 -0.19000 1.000 N11 N -7.44500 -1.85200 -0.35000 1.000 C12 C -7.48500 -3.01200 0.29400 1.000 C13 C -6.42800 -3.36500 1.15700 1.000 C14 C -5.38900 -2.51100 1.30600 1.000 O15 O -6.40500 0.04000 -0.79300 1.000 N16 N -8.55100 -3.86300 0.12000 1.000 P17 P -0.35300 1.80200 -0.81000 1.000 O18 O -0.60000 3.25800 -0.90600 1.000 S19 S -0.25200 0.97400 -2.75900 1.000 O20 O 1.03900 1.54300 -0.04400 1.000 C21 C 2.27700 2.12100 -0.46300 1.000 C22 C 3.39500 1.67200 0.48100 1.000 O23 O 3.67100 0.26600 0.30000 1.000 C24 C 4.71900 2.38300 0.12300 1.000 O25 O 4.93500 3.50200 0.98500 1.000 C26 C 5.80000 1.30400 0.35600 1.000 O27 O 6.71600 1.72400 1.36900 1.000 C28 C 5.00100 0.06800 0.82700 1.000 N29 N 5.58900 -1.15800 0.28100 1.000 C30 C 6.07700 -2.09200 1.11700 1.000 N31 N 6.62300 -3.22700 0.64300 1.000 C32 C 6.68800 -3.44700 -0.68600 1.000 C33 C 6.17700 -2.47200 -1.57700 1.000 C34 C 5.63000 -1.34400 -1.07400 1.000 O35 O 6.02600 -1.90700 2.31800 1.000 O36 O 7.18100 -4.47300 -1.11600 1.000 H37 H -5.45300 4.63300 1.24600 1.000 H38 H -5.09800 2.97700 -0.43900 1.000 H39 H -3.59600 3.84100 -0.03100 1.000 H40 H -3.08300 2.03500 1.65400 1.000 H41 H -3.02300 1.85300 -1.25800 1.000 H42 H -4.29400 -0.11800 -1.39200 1.000 H43 H -2.92700 -2.02800 -0.96200 1.000 H44 H -3.56800 -0.76200 1.52300 1.000 H45 H -6.44600 -4.30500 1.68900 1.000 H46 H -4.56700 -2.76000 1.96200 1.000 H47 H -9.27700 -3.61700 -0.47500 1.000 H48 H -8.57800 -4.71000 0.59200 1.000 H49 H -0.02700 -0.33100 -2.52200 1.000 H50 H 2.50600 1.79500 -1.47800 1.000 H51 H 2.19700 3.20800 -0.44000 1.000 H52 H 3.12200 1.87700 1.51600 1.000 H53 H 4.71200 2.70100 -0.92000 1.000 H54 H 5.75300 3.98600 0.80400 1.000 H55 H 6.32800 1.08600 -0.57200 1.000 H56 H 7.20100 2.53100 1.15000 1.000 H57 H 4.97500 0.02600 1.91600 1.000 H58 H 6.22000 -2.63000 -2.64400 1.000 H59 H 5.23200 -0.59100 -1.73800 1.000 H60 H 6.97100 -3.89000 1.25900 1.000