REAL300019868932.mol2 41                                                        
   1       O    -0.46   -11.35    12.44       5.56       0.07   -11.28     16
   2       C     0.49     9.61     7.52     -10.98      -0.08     9.53     16
   3       C    -0.13    -1.83     5.68     -27.88      -0.16    -1.99     16
   4       C    -0.07    -0.96     4.62     -27.88      -0.13    -1.08     16
   5       C    -0.07    -0.78     5.16    -104.37      -0.54    -1.32     16
   6       C    -0.09    -0.56     9.68     -39.59      -0.38    -0.94     16
   7       C    -0.10    -0.45    10.04     -39.47      -0.40    -0.85     16
   8       C    -0.11    -0.63    10.04     -39.62      -0.40    -1.03     16
   9       C    -0.08    -0.79     6.31    -104.35      -0.66    -1.45     16
  10       C     0.26     3.33     9.97     -38.81      -0.39     2.94     16
  11       O    -0.50   -10.30    17.75     -56.57      -1.00   -11.31     16
  12       O    -0.48    -8.85    15.05     -56.57      -0.85    -9.70     16
  13       C     0.10     1.16     7.74      35.91       0.28     1.44     16
  14       N    -0.72   -13.20     5.21     -47.92      -0.25   -13.45     16
  15       C     0.27     5.82     1.11    -132.16      -0.15     5.67     16
  16       C     0.05     1.35     7.02    -156.72      -1.10     0.25     16
  17       N    -0.39   -12.23    11.68      32.44       0.38   -11.85     16
  18       N    -0.21    -7.02    13.47      60.35       0.81    -6.21     16
  19       N    -0.21    -7.36    13.47      60.35       0.81    -6.54     16
  20       N    -0.32   -10.51     8.85      32.44       0.29   -10.22     16
  21       C    -0.13    -2.43     7.43     -25.77      -0.19    -2.62     16
  22       C    -0.14    -2.08     8.00     -25.78      -0.21    -2.28     16
  23       C    -0.12    -2.21     7.22     -25.92      -0.19    -2.40     16
  24       H     0.09     1.34     8.14     -51.93      -0.42     0.92     16
  25       H     0.09     0.86     8.14     -51.93      -0.42     0.44     16
  26       H     0.09     1.19     8.01     -51.93      -0.42     0.77     16
  27       H     0.10     1.90     7.29     -51.93      -0.38     1.52     16
  28       H     0.16     0.64     8.06     -52.49      -0.42     0.22     16
  29       H     0.15     0.20     8.06     -52.49      -0.42    -0.23     16
  30       H     0.16     0.41     8.06     -52.49      -0.42    -0.01     16
  31       H     0.36     6.38     9.30      45.56       0.42     6.81     16
  32       H     0.06     0.65     8.14     -51.93      -0.42     0.23     16
  33       H     0.06     0.66     8.14     -51.93      -0.42     0.24     16
  34       H     0.39     5.57     8.63     -40.82      -0.35     5.22     16
  35       H     0.06     1.20     8.14     -51.93      -0.42     0.78     16
  36       H     0.08     1.75     8.09     -51.93      -0.42     1.33     16
  37       H     0.07     0.88     8.14     -51.93      -0.42     0.45     16
  38       H     0.08     0.92     8.14     -51.93      -0.42     0.50     16
  39       H     0.10     2.09     7.62     -51.93      -0.40     1.69     16
  40       H     0.06     1.01     8.12     -51.93      -0.42     0.59     16
 Total:         -1.00   -44.59   343.70                 -5.44   -50.03