# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0K3' 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 6.09400 -1.43500 -1.57400 1.000 P1 P 6.84700 -1.90700 -0.39000 1.000 O2 O 6.31900 -3.36800 0.03400 1.000 O3 O 8.41500 -1.98500 -0.74700 1.000 O4 O 6.62400 -0.88100 0.83000 1.000 C5 C 6.89500 0.51900 0.73000 1.000 C6 C 6.58100 1.18600 2.04400 1.000 C7 C 5.94100 2.32900 2.06200 1.000 C8 C 5.52100 2.93700 3.37500 1.000 C9 C 5.62400 3.03500 0.76800 1.000 C10 C 4.22100 2.63900 0.30200 1.000 C11 C 3.90400 3.34500 -0.99100 1.000 C12 C 3.64800 2.65000 -2.07200 1.000 C13 C 3.18200 3.34700 -3.32400 1.000 C14 C 3.81900 1.15300 -2.06200 1.000 C15 C 2.48900 0.49000 -1.69800 1.000 C16 C 2.66000 -1.00800 -1.68800 1.000 C17 C 2.51600 -1.67600 -0.57100 1.000 C18 C 2.63700 -3.17800 -0.57100 1.000 C19 C 2.22800 -0.94300 0.71400 1.000 C20 C 0.71500 -0.84900 0.92000 1.000 C21 C 0.42800 -0.11600 2.20500 1.000 C22 C -0.20500 1.03000 2.17800 1.000 C23 C -0.57600 1.71700 3.46700 1.000 C24 C -0.56300 1.66200 0.85800 1.000 C25 C -1.98700 1.25900 0.46900 1.000 C26 C -2.34500 1.89000 -0.85200 1.000 C27 C -2.59000 1.13600 -1.89400 1.000 C28 C -3.08600 1.75700 -3.17400 1.000 C29 C -2.37700 -0.35400 -1.81200 1.000 C30 C -3.70400 -1.04200 -1.48600 1.000 C31 C -3.49000 -2.53200 -1.40400 1.000 C32 C -3.73300 -3.16800 -0.28500 1.000 C33 C -3.67300 -4.67300 -0.24600 1.000 C34 C -4.07100 -2.39500 0.96300 1.000 C35 C -5.59000 -2.25200 1.07900 1.000 C36 C -5.92800 -1.47900 2.32700 1.000 C37 C -6.56500 -0.33800 2.23800 1.000 C38 C -7.04500 0.35700 3.48700 1.000 C39 C -6.81800 0.28100 0.88800 1.000 C40 C -8.20700 -0.12500 0.39200 1.000 C41 C -8.46000 0.49300 -0.95800 1.000 C42 C -9.54000 1.20700 -1.16000 1.000 C43 C -10.56600 1.34800 -0.06500 1.000 C44 C -9.75600 1.88700 -2.48700 1.000 H45 H 6.42200 -4.03800 -0.65500 1.000 H46 H 8.97000 -2.28700 -0.01500 1.000 H47 H 7.94700 0.66900 0.48800 1.000 H48 H 6.27600 0.95300 -0.05500 1.000 H49 H 6.88400 0.72300 2.97100 1.000 H50 H 6.31500 3.58500 3.74600 1.000 H51 H 4.61300 3.52200 3.23000 1.000 H52 H 5.33100 2.14500 4.09800 1.000 H53 H 5.66400 4.11300 0.92400 1.000 H54 H 6.35300 2.75000 0.01000 1.000 H55 H 4.18100 1.56100 0.14600 1.000 H56 H 3.49200 2.92400 1.06000 1.000 H57 H 3.88900 4.42400 -1.02800 1.000 H58 H 4.04600 3.62500 -3.92800 1.000 H59 H 2.53900 2.67700 -3.89500 1.000 H60 H 2.62400 4.24400 -3.05400 1.000 H61 H 4.13400 0.81700 -3.05000 1.000 H62 H 4.57500 0.87800 -1.32700 1.000 H63 H 2.17400 0.82600 -0.71000 1.000 H64 H 1.73300 0.76400 -2.43300 1.000 H65 H 2.90200 -1.52900 -2.60200 1.000 H66 H 3.67500 -3.45900 -0.39200 1.000 H67 H 2.00700 -3.59400 0.21600 1.000 H68 H 2.31600 -3.56900 -1.53700 1.000 H69 H 2.67600 -1.48400 1.54800 1.000 H70 H 2.65100 0.06000 0.66300 1.000 H71 H 0.26800 -0.30800 0.08600 1.000 H72 H 0.29200 -1.85200 0.97200 1.000 H73 H 0.74500 -0.53600 3.14900 1.000 H74 H -1.56500 1.38600 3.78400 1.000 H75 H 0.15500 1.46600 4.23600 1.000 H76 H -0.58600 2.79600 3.31400 1.000 H77 H -0.50500 2.74700 0.94600 1.000 H78 H 0.13300 1.32200 0.09100 1.000 H79 H -2.04600 0.17400 0.38000 1.000 H80 H -2.68400 1.59900 1.23500 1.000 H81 H -2.40000 2.96600 -0.93900 1.000 H82 H -2.23500 2.02800 -3.79900 1.000 H83 H -3.71400 1.04200 -3.70600 1.000 H84 H -3.66700 2.65000 -2.94400 1.000 H85 H -2.00300 -0.72000 -2.76900 1.000 H86 H -1.65100 -0.57500 -1.03000 1.000 H87 H -4.07700 -0.67600 -0.53000 1.000 H88 H -4.43000 -0.82200 -2.26800 1.000 H89 H -3.13700 -3.07500 -2.26800 1.000 H90 H -4.65700 -5.08200 -0.47900 1.000 H91 H -2.95000 -5.02800 -0.98000 1.000 H92 H -3.37100 -4.99900 0.74900 1.000 H93 H -3.68800 -2.92600 1.83500 1.000 H94 H -3.61600 -1.40500 0.91200 1.000 H95 H -5.97200 -1.72100 0.20800 1.000 H96 H -6.04500 -3.24100 1.13000 1.000 H97 H -5.64500 -1.86500 3.29500 1.000 H98 H -6.26800 1.02800 3.85100 1.000 H99 H -7.94400 0.93100 3.26100 1.000 H100 H -7.27200 -0.38600 4.25200 1.000 H101 H -6.76500 1.36700 0.97000 1.000 H102 H -6.06400 -0.06800 0.18200 1.000 H103 H -8.26100 -1.21100 0.31100 1.000 H104 H -8.96100 0.22300 1.09800 1.000 H105 H -7.75100 0.34800 -1.76000 1.000 H106 H -10.32700 2.21800 0.54600 1.000 H107 H -11.55400 1.47400 -0.50800 1.000 H108 H -10.55800 0.45300 0.55700 1.000 H109 H -9.32100 2.88600 -2.45900 1.000 H110 H -9.27800 1.30600 -3.27600 1.000 H111 H -10.82500 1.96200 -2.68800 1.000