# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'IVM' 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 -0.65100 4.43900 3.47400 1.000 O1 O -3.92400 3.70100 0.71100 1.000 C2 C -1.43900 4.09600 2.20900 1.000 O3 O 1.81900 0.40100 -1.29000 1.000 C4 C -2.47300 5.19000 1.93900 1.000 O5 O 4.44000 2.03300 1.58600 1.000 C6 C -3.50600 5.20500 3.06800 1.000 O7 O 5.88800 -0.12400 0.38900 1.000 C8 C -3.17500 4.91200 0.60900 1.000 O9 O 8.65300 -2.64400 2.33900 1.000 C10 C -4.61300 3.33100 -0.48400 1.000 O11 O 9.70800 -2.26600 -0.29200 1.000 C12 C -5.60800 4.42700 -0.86200 1.000 O13 O 7.98000 0.90800 0.31500 1.000 C14 C -4.87200 5.76100 -1.01300 1.000 O15 O 3.78400 1.03100 -2.38000 1.000 C16 C -4.11300 6.07500 0.27500 1.000 O17 O -3.99900 -6.03300 -0.12100 1.000 C18 C -3.29400 7.35400 0.08600 1.000 O19 O -6.29600 -4.98200 -1.00000 1.000 C20 C -5.38300 2.02900 -0.24900 1.000 O21 O -3.38300 -1.34100 0.97300 1.000 C22 C -4.40700 0.88000 0.01800 1.000 O23 O -5.15300 -0.36500 0.09800 1.000 C24 C -3.40700 0.78100 -1.13000 1.000 O25 O -3.76900 -3.57000 2.24500 1.000 C26 C -2.70200 2.12500 -1.32000 1.000 O27 O -3.67700 3.14700 -1.54400 1.000 C28 C -1.78800 2.04800 -2.54400 1.000 C29 C -0.46700 1.42800 -2.18100 1.000 C30 C -0.09000 0.30500 -2.74100 1.000 C31 C -0.99600 -0.38700 -3.72800 1.000 C32 C 1.24600 -0.30300 -2.39400 1.000 C33 C 2.64000 1.50800 -1.66800 1.000 C34 C 3.09700 2.25700 -0.41400 1.000 C35 C 3.94800 1.32000 0.44900 1.000 C36 C 3.57700 1.97800 2.72400 1.000 C37 C 5.12700 0.80800 -0.38400 1.000 C38 C 6.92000 0.47700 1.17200 1.000 C39 C 7.46100 -0.54500 2.17500 1.000 C40 C 8.08100 -1.71900 1.41200 1.000 C41 C 7.75000 -3.66000 2.77900 1.000 C42 C 9.17300 -1.18800 0.47800 1.000 C43 C 8.56600 -0.14100 -0.46000 1.000 C44 C 9.66300 0.43900 -1.35500 1.000 C45 C 4.59200 0.11400 -1.63900 1.000 C46 C 5.76500 -0.34800 -2.50600 1.000 C47 C 1.04200 -1.77400 -2.01500 1.000 C48 C 2.29000 -2.30000 -1.30400 1.000 C49 C -0.14200 -1.86900 -1.09300 1.000 C50 C -0.85600 -2.98500 -0.97300 1.000 C51 C -2.01300 -2.94100 -0.06700 1.000 C52 C -2.89500 -3.92400 0.02700 1.000 C53 C -2.92600 -5.26200 -0.65700 1.000 C54 C -4.75200 -5.27300 0.82500 1.000 C55 C -6.21700 -5.22100 0.40700 1.000 C56 C -6.94900 -4.12300 1.13800 1.000 C57 C -6.40400 -2.91500 1.11800 1.000 C58 C -5.09900 -2.82000 0.35900 1.000 C59 C -4.48800 -1.45600 0.49700 1.000 C60 C -4.13600 -3.87900 0.90200 1.000 C61 C -8.24500 -4.38800 1.86000 1.000 H62 H -0.14200 5.39400 3.33800 1.000 H63 H -1.33400 4.50900 4.32000 1.000 H64 H 0.08600 3.65900 3.66600 1.000 H65 H -0.75500 4.02600 1.36300 1.000 H66 H -1.94700 3.14100 2.34500 1.000 H67 H -1.97400 6.15800 1.89100 1.000 H68 H -4.24300 5.98500 2.87600 1.000 H69 H -4.00500 4.23700 3.11500 1.000 H70 H -3.00600 5.40300 4.01600 1.000 H71 H -2.43000 4.81200 -0.18100 1.000 H72 H 10.40600 -2.00100 -0.90700 1.000 H73 H -6.09100 4.17000 -1.80500 1.000 H74 H -6.36400 4.51600 -0.08100 1.000 H75 H -4.16800 5.69500 -1.84300 1.000 H76 H -5.59400 6.55400 -1.21200 1.000 H77 H -4.82300 6.21500 1.09100 1.000 H78 H -3.96200 8.18100 -0.15200 1.000 H79 H -2.75300 7.57700 1.00600 1.000 H80 H -2.58400 7.21300 -0.72800 1.000 H81 H -7.20000 -4.93600 -1.34100 1.000 H82 H -6.04300 2.14900 0.61000 1.000 H83 H -5.98000 1.79800 -1.13200 1.000 H84 H -3.88600 1.05100 0.95600 1.000 H85 H -2.66700 0.01300 -0.90200 1.000 H86 H -3.93200 0.51600 -2.04800 1.000 H87 H -3.34200 -2.70800 2.34700 1.000 H88 H -2.12000 2.36100 -0.43300 1.000 H89 H -2.26800 1.44500 -3.31500 1.000 H90 H -1.61800 3.05400 -2.93000 1.000 H91 H 0.17800 1.90400 -1.45500 1.000 H92 H -1.14300 0.25400 -4.59700 1.000 H93 H -0.54100 -1.32700 -4.04200 1.000 H94 H -1.95800 -0.58800 -3.25800 1.000 H95 H 1.91200 -0.23500 -3.25400 1.000 H96 H 2.06900 2.18200 -2.30700 1.000 H97 H 3.68900 3.12400 -0.70300 1.000 H98 H 2.22500 2.58300 0.15400 1.000 H99 H 3.34100 0.47800 0.78100 1.000 H100 H 4.02100 2.54300 3.54400 1.000 H101 H 2.60900 2.41000 2.46700 1.000 H102 H 3.44200 0.94000 3.02900 1.000 H103 H 5.76100 1.64600 -0.67100 1.000 H104 H 6.51600 1.33500 1.70900 1.000 H105 H 8.22100 -0.07500 2.80000 1.000 H106 H 6.64600 -0.90700 2.80100 1.000 H107 H 7.31000 -2.22100 0.82600 1.000 H108 H 6.89500 -3.19700 3.27200 1.000 H109 H 7.40600 -4.23700 1.92100 1.000 H110 H 8.26000 -4.32100 3.48000 1.000 H111 H 9.96700 -0.73200 1.06900 1.000 H112 H 7.80000 -0.60700 -1.07900 1.000 H113 H 10.40200 0.95000 -0.73900 1.000 H114 H 10.14500 -0.36800 -1.90700 1.000 H115 H 9.22200 1.14600 -2.05700 1.000 H116 H 3.99100 -0.74800 -1.35000 1.000 H117 H 6.42700 0.49600 -2.70100 1.000 H118 H 6.31600 -1.13000 -1.98400 1.000 H119 H 5.38600 -0.73900 -3.45100 1.000 H120 H 0.85700 -2.36200 -2.91400 1.000 H121 H 2.46800 -1.71500 -0.40200 1.000 H122 H 2.14200 -3.34600 -1.03600 1.000 H123 H 3.15000 -2.21400 -1.96900 1.000 H124 H -0.42800 -1.00300 -0.50300 1.000 H125 H -0.59800 -3.87900 -1.49900 1.000 H126 H -2.14500 -2.05900 0.56300 1.000 H127 H -1.98300 -5.78100 -0.48700 1.000 H128 H -3.07600 -5.12200 -1.72700 1.000 H129 H -4.68300 -5.75000 1.80500 1.000 H130 H -6.68800 -6.17800 0.63400 1.000 H131 H -6.85600 -2.06500 1.60600 1.000 H132 H -5.28000 -3.03300 -0.69900 1.000 H133 H -8.03500 -4.67400 2.89100 1.000 H134 H -8.85700 -3.48700 1.85100 1.000 H135 H -8.78100 -5.19600 1.36100 1.000