REAL300009850683.mol2 38                                                        
   1       C     0.09     0.80     9.75      59.84       0.58     1.38     16
   2       N    -0.37    -6.14     4.01     -63.80      -0.26    -6.39     16
   3       N    -0.29    -5.40    12.50      30.78       0.38    -5.01     16
   4       C     0.07     1.50    11.79     -17.10      -0.20     1.30     16
   5       C    -0.18    -4.71     6.15    -104.75      -0.64    -5.36     16
   6       C     0.53    17.30     8.05      34.47       0.28    17.58     16
   7       O    -0.69   -24.22    17.82     -20.55      -0.37   -24.59     16
   8       O    -0.65   -22.29    14.17     -28.42      -0.40   -22.70     16
   9       C     0.03     0.58     6.96     -82.12      -0.57     0.01     16
  10       C     0.56    10.71     7.49     -12.47      -0.09    10.61     16
  11       O    -0.40    -9.56    10.95     -19.50      -0.21    -9.78     16
  12       N    -0.69    -8.56     5.14     -10.84      -0.06    -8.61     16
  13       C     0.20     2.28     6.26     -83.79      -0.52     1.76     16
  14       C    -0.16    -1.20     9.69     -38.95      -0.38    -1.58     16
  15       C    -0.03    -0.20     5.74    -106.77      -0.61    -0.82     16
  16       C    -0.06    -0.32     9.73     -39.52      -0.38    -0.71     16
  17       C    -0.11    -0.86     9.65     -39.64      -0.38    -1.24     16
  18       C     0.32     3.44     9.78     -38.67      -0.38     3.07     16
  19       O    -0.68   -11.75    17.19     -57.73      -0.99   -12.75     16
  20       O    -0.69   -11.54    17.20     -57.73      -0.99   -12.53     16
  21       C    -0.08    -0.71     9.49     -38.78      -0.37    -1.08     16
  22       C    -0.04    -0.36     5.74    -106.81      -0.61    -0.98     16
  23       C    -0.07    -0.70     9.74     -39.48      -0.38    -1.09     16
  24       C    -0.10    -1.21     8.54     -39.75      -0.34    -1.55     16
  25       H     0.08     0.51     7.99     -51.93      -0.41     0.10     16
  26       H     0.10     0.75     8.14     -51.93      -0.42     0.33     16
  27       H     0.08     0.53     6.31     -51.92      -0.33     0.20     16
  28       H     0.19     3.79     8.06     -52.49      -0.42     3.36     16
  29       H     0.40     3.49     4.62     -40.82      -0.19     3.31     16
  30       H     0.14     0.61     8.06     -52.49      -0.42     0.19     16
  31       H     0.17     0.30     8.06     -52.49      -0.42    -0.12     16
  32       H     0.17     1.21     7.73     -52.48      -0.41     0.80     16
  33       H     0.33     4.76     8.90      45.56       0.41     5.16     16
  34       H     0.33     4.64     8.90      45.56       0.41     5.05     16
  35       H     0.18     1.63     7.73     -52.48      -0.41     1.22     16
  36       H     0.15     1.18     8.06     -52.49      -0.42     0.76     16
  37       H     0.16     2.45     6.37     -52.49      -0.33     2.12     16
 Total:         -1.00   -47.28   332.46                 -6.28   -53.56