# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0FQ' 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 -13.37600 -1.73000 0.23900 1.000 N1 N 7.34300 -7.68700 -0.49700 1.000 O2 O 5.59700 2.79500 -2.23300 1.000 P3 P 5.09900 2.74000 -0.84100 1.000 C4 C -14.55400 -2.24900 1.02200 1.000 O5 O -14.67400 -1.96700 2.19500 1.000 C6 C 7.25900 -2.56900 0.38400 1.000 S7 S -12.32600 -0.72300 1.32200 1.000 C8 C 7.41300 -7.04700 0.65500 1.000 O9 O 5.63800 4.02000 -0.02600 1.000 P10 P 2.37700 3.53200 -1.70700 1.000 C11 C -15.56000 -3.09700 0.36300 1.000 C12 C 8.72100 -2.16400 0.67300 1.000 O13 O 9.19000 -2.79800 1.86500 1.000 C14 C -10.98600 -0.19700 0.21900 1.000 N15 N 7.38000 -5.73300 0.73700 1.000 O16 O 3.48900 2.74700 -0.84700 1.000 C17 C -16.65400 -3.58100 1.08600 1.000 C18 C 8.65600 -0.63200 0.86400 1.000 O19 O 9.08200 -0.27300 2.18000 1.000 P20 P 10.31800 0.72000 2.46100 1.000 C21 C -9.99800 0.67600 0.99500 1.000 C22 C 7.27300 -4.98900 -0.35900 1.000 O23 O 2.81000 4.93200 -1.91200 1.000 C24 C -17.59200 -4.37600 0.46100 1.000 C25 C 7.16200 -0.29300 0.66800 1.000 O26 O 6.64100 -1.37200 -0.13800 1.000 N27 N -8.91600 1.10000 0.10400 1.000 C28 C 7.19600 -5.62300 -1.61000 1.000 O29 O 2.19600 2.81100 -3.13500 1.000 C30 C -17.45200 -4.69500 -0.87800 1.000 C31 C 7.01000 1.04100 -0.06600 1.000 O32 O 5.62700 1.39300 -0.13400 1.000 C33 C -7.92400 1.88200 0.57300 1.000 O34 O -7.92700 2.23500 1.73400 1.000 C35 C 7.23500 -7.02700 -1.64600 1.000 N36 N 7.16300 -7.70700 -2.84900 1.000 O37 O 0.97500 3.51400 -0.91500 1.000 C38 C -16.37200 -4.22000 -1.60100 1.000 C39 C -6.81000 2.31900 -0.34400 1.000 N40 N 7.09500 -4.64800 -2.54600 1.000 O41 O 10.09600 1.99700 1.74800 1.000 C42 C -15.42900 -3.42000 -0.99200 1.000 C43 C -5.82300 3.19200 0.43300 1.000 C44 C 7.10600 -3.48500 -1.96200 1.000 O45 O 10.43100 1.00100 4.04300 1.000 N46 N -4.74000 3.61600 -0.45900 1.000 N47 N 7.21400 -3.64200 -0.61300 1.000 O48 O 11.68100 0.04200 1.93800 1.000 C49 C -3.74800 4.39800 0.01000 1.000 O50 O -3.79900 4.82700 1.14400 1.000 C51 C -2.57600 4.74000 -0.87300 1.000 O52 O -2.86700 4.35900 -2.21900 1.000 C53 C -1.33500 3.98800 -0.38700 1.000 C54 C -0.18400 4.21600 -1.36800 1.000 C55 C -0.93600 4.50200 0.99700 1.000 C56 C -1.64500 2.49200 -0.30500 1.000 H57 H -12.79900 -2.56900 -0.14900 1.000 H58 H -13.73200 -1.12000 -0.59100 1.000 H59 H 6.76300 -2.88200 1.30300 1.000 H60 H 7.50000 -7.62200 1.56500 1.000 H61 H 5.34900 4.04900 0.89600 1.000 H62 H 9.36200 -2.41900 -0.17100 1.000 H63 H 9.19400 -3.76400 1.82100 1.000 H64 H -10.46900 -1.07500 -0.16900 1.000 H65 H -11.40200 0.37500 -0.61100 1.000 H66 H -16.76500 -3.33300 2.13200 1.000 H67 H 9.26600 -0.12700 0.11500 1.000 H68 H -10.51600 1.55400 1.38200 1.000 H69 H -9.58200 0.10400 1.82500 1.000 H70 H -18.43800 -4.75000 1.01900 1.000 H71 H 6.65200 -0.25500 1.63100 1.000 H72 H -8.91300 0.81800 -0.82500 1.000 H73 H 1.91300 1.88800 -3.07700 1.000 H74 H -18.19000 -5.31800 -1.36200 1.000 H75 H 7.55600 1.81600 0.47200 1.000 H76 H 7.41200 0.94800 -1.07500 1.000 H77 H 7.19100 -8.67700 -2.86100 1.000 H78 H 7.08400 -7.21400 -3.68100 1.000 H79 H -16.26900 -4.47400 -2.64500 1.000 H80 H -6.29300 1.44100 -0.73100 1.000 H81 H -7.22600 2.89100 -1.17400 1.000 H82 H -14.58600 -3.04900 -1.55700 1.000 H83 H -6.34000 4.07000 0.82000 1.000 H84 H -5.40700 2.62000 1.26200 1.000 H85 H 7.03900 -2.53500 -2.47300 1.000 H86 H 11.15600 1.59300 4.28600 1.000 H87 H -4.73800 3.33400 -1.38700 1.000 H88 H 11.89000 -0.80100 2.36300 1.000 H89 H -2.39000 5.81300 -0.83100 1.000 H90 H -3.04400 3.41500 -2.33200 1.000 H91 H 0.03700 5.28200 -1.42700 1.000 H92 H -0.46800 3.85000 -2.35500 1.000 H93 H -1.72400 4.26900 1.71300 1.000 H94 H -0.00800 4.02300 1.30900 1.000 H95 H -0.79000 5.58200 0.95500 1.000 H96 H -1.93000 2.12500 -1.29100 1.000 H97 H -0.76200 1.95600 0.04100 1.000 H98 H -2.46600 2.32900 0.39400 1.000