REAL300009850761.mol2 41                                                        
   1       O    -0.68   -23.28    17.33     -20.23      -0.35   -23.63     16
   2       C     0.49    15.15     8.12      36.00       0.29    15.45     16
   3       O    -0.68   -23.50    18.00     -20.23      -0.36   -23.87     16
   4       C     0.01     0.24     5.87      -5.19      -0.03     0.21     16
   5       N    -0.45    -9.09     2.06    -120.63      -0.25    -9.34     16
   6       C     0.19     3.01    10.25     -16.85      -0.17     2.83     16
   7       C    -0.26    -3.59     9.99     -40.01      -0.40    -3.99     16
   8       C     0.05     0.82     9.81     -38.71      -0.38     0.44     16
   9       C    -0.29    -5.54     5.24    -104.51      -0.55    -6.09     16
  10       C     0.60    11.66     7.08     -12.67      -0.09    11.57     16
  11       O    -0.54   -12.05    16.43       5.24       0.09   -11.96     16
  12       N    -0.60    -9.35     2.97    -174.42      -0.52    -9.87     16
  13       C     0.11     1.40     4.37      -3.93      -0.02     1.39     16
  14       C    -0.14    -1.07     6.06     -26.83      -0.16    -1.24     16
  15       C    -0.10    -0.46     5.17     -26.69      -0.14    -0.60     16
  16       C    -0.16    -1.19     2.05     -90.50      -0.19    -1.38     16
  17       C     0.38     2.11     9.01      37.16       0.33     2.44     16
  18       O    -0.68   -11.53    14.58     -57.73      -0.84   -12.37     16
  19       O    -0.75   -12.97    17.78     -57.73      -1.03   -14.00     16
  20       C     0.11     1.40     5.52      -3.72      -0.02     1.38     16
  21       C     0.53    11.26     5.90     -14.92      -0.09    11.17     16
  22       O    -0.54   -12.55    12.29       5.02       0.06   -12.49     16
  23       H     0.10     2.26     7.39     -51.93      -0.38     1.88     16
  24       H     0.09     1.69     8.00     -51.93      -0.42     1.27     16
  25       H     0.16     2.00     8.02     -52.48      -0.42     1.58     16
  26       H     0.15     1.43     8.06     -52.48      -0.42     1.00     16
  27       H     0.14     1.84     8.06     -52.49      -0.42     1.41     16
  28       H     0.11     1.72     3.83     -52.38      -0.20     1.52     16
  29       H     0.08     1.08     7.80     -51.93      -0.41     0.68     16
  30       H     0.09     0.56     8.14     -51.93      -0.42     0.14     16
  31       H     0.07     0.58     8.14     -51.93      -0.42     0.15     16
  32       H     0.08     0.29     8.14     -51.93      -0.42    -0.13     16
  33       H     0.08     0.13     8.14     -51.93      -0.42    -0.29     16
  34       H     0.12     1.12     8.04     -51.93      -0.42     0.70     16
  35       H     0.14     0.14     8.14     -51.93      -0.42    -0.28     16
  36       H     0.14     0.31     8.14     -51.93      -0.42    -0.12     16
  37       H     0.33     5.20     8.90      45.56       0.41     5.61     16
  38       H     0.32     5.10     8.90      45.56       0.41     5.51     16
  39       H     0.07     0.75     8.14     -51.93      -0.42     0.33     16
  40       H     0.13     2.17     4.83     -51.93      -0.25     1.92     16
 Total:         -1.00   -50.77   334.70                 -5.25   -56.02