 45

  O   -1.192963   -2.827225   -1.542709
  C   -1.160629   -1.435669   -1.720123
  C   -0.934692   -0.747787   -0.367752
  O    0.272064   -1.056427    0.304245
  C   -2.103027   -0.988098    0.603302
  C   -2.817368    0.356949    0.668854
  C   -1.748230    1.349518    0.216049
  C   -1.006393    2.070770    1.347366
  O   -1.628265   -1.322327    1.882828
  O   -3.865753    0.347183   -0.267502
  O   -0.834534    0.642853   -0.592712
  H   -1.321700   -3.215714   -2.390930
  H   -2.150467   -1.147049   -2.142380
  H   -0.384735   -1.197952   -2.482986
  H   -2.775681   -1.824249    0.299957
  H   -2.195053    2.130615   -0.444351
  O   -0.399811    1.145782    2.208115
  H   -2.379288   -1.521835    2.415817
  O    1.796295   -0.236130   -1.170624
  C    2.295517    0.829025   -0.385269
  C    3.486511    0.384903    0.470566
  C    3.068451   -0.779236    1.368149
  C    2.524445   -1.888016    0.470459
  C    1.411331   -1.385956   -0.454651
  H    1.476318    1.172104    0.286819
  H    4.356705    0.105133   -0.168839
  H    2.314270   -0.459747    2.126266
  H    3.353149   -2.325592   -0.135681
  H    1.172119   -2.193115   -1.181625
  C    2.637177    1.979309   -1.340271
  O    3.897797    1.454361    1.283661
  O    4.191071   -1.249878    2.069107
  O    2.028595   -2.931793    1.269974
  H    1.759323    2.267273   -1.964157
  O    3.652298    1.573502   -2.220062
  H    3.013290    2.875168   -0.795135
  H    4.657227    1.153839    1.753021
  H    3.912018   -2.017441    2.538712
  H    1.184800   -2.662262    1.591049
  H    3.840378    2.301514   -2.787354
  H   -0.202621    2.734436    0.952377
  H   -1.706497    2.675293    1.968872
  H    0.202652    1.616364    2.758179
  H   -4.351624    1.146393   -0.155548
  H   -3.270569    0.587738    1.661179
