REAL300009850680.mol2 41                                                        
   1       O    -0.70   -24.67    16.64     -20.23      -0.34   -25.01     16
   2       C     0.50    16.27     7.36      36.00       0.27    16.53     16
   3       O    -0.70   -25.32    17.98     -20.23      -0.36   -25.68     16
   4       C    -0.16    -3.77     3.37     -89.79      -0.30    -4.07     16
   5       H     0.07     1.51     8.14     -51.93      -0.42     1.08     16
   6       C    -0.10    -1.98     5.89     -25.07      -0.15    -2.13     16
   7       C    -0.12    -1.54     6.39     -25.62      -0.16    -1.71     16
   8       C    -0.11    -1.54     3.30     -90.66      -0.30    -1.84     16
   9       H     0.10     1.06     8.14     -51.93      -0.42     0.63     16
  10       C     0.52     6.85     6.77     -10.99      -0.07     6.78     16
  11       O    -0.50    -8.55    12.81       5.55       0.07    -8.48     16
  12       N    -0.68    -5.77     5.15      -9.89      -0.05    -5.82     16
  13       C     0.19     1.62     6.28     -83.75      -0.53     1.09     16
  14       C    -0.15    -0.89     9.69     -38.96      -0.38    -1.27     16
  15       C    -0.03    -0.19     5.74    -106.77      -0.61    -0.80     16
  16       C    -0.06    -0.26     9.73     -39.53      -0.38    -0.64     16
  17       C    -0.11    -0.76     9.65     -39.65      -0.38    -1.14     16
  18       C     0.32     3.14     9.78     -38.67      -0.38     2.76     16
  19       O    -0.68   -11.09    17.19     -57.73      -0.99   -12.08     16
  20       O    -0.68   -10.88    17.20     -57.73      -0.99   -11.87     16
  21       C    -0.08    -0.64     9.49     -38.78      -0.37    -1.01     16
  22       C    -0.04    -0.29     5.74    -106.82      -0.61    -0.90     16
  23       C    -0.07    -0.57     9.74     -39.48      -0.38    -0.95     16
  24       C    -0.10    -0.93     8.59     -39.75      -0.34    -1.27     16
  25       C    -0.08    -1.71     5.57     -25.08      -0.14    -1.85     16
  26       H     0.06     1.12     8.14     -51.93      -0.42     0.69     16
  27       H     0.08     1.71     7.46     -51.93      -0.39     1.33     16
  28       H     0.07     0.72     8.14     -51.93      -0.42     0.30     16
  29       H     0.06     0.70     7.59     -51.93      -0.39     0.31     16
  30       H     0.42     2.06     8.82     -40.82      -0.36     1.70     16
  31       H     0.14     0.47     8.06     -52.49      -0.42     0.04     16
  32       H     0.17     0.18     8.06     -52.48      -0.42    -0.24     16
  33       H     0.17     1.08     7.73     -52.48      -0.41     0.68     16
  34       H     0.33     4.47     8.90      45.56       0.41     4.88     16
  35       H     0.33     4.39     8.90      45.56       0.41     4.79     16
  36       H     0.18     1.39     7.73     -52.49      -0.41     0.99     16
  37       H     0.15     0.82     8.06     -52.49      -0.42     0.40     16
  38       H     0.16     1.71     6.18     -52.49      -0.32     1.38     16
  39       H     0.08     1.90     6.80     -51.93      -0.35     1.55     16
  40       H     0.07     1.31     8.14     -51.93      -0.42     0.89     16
 Total:         -1.00   -46.87   345.06                 -7.90   -54.77