REAL300018325224.mol2 41                                                        
   1       C     0.03     0.37     9.81     101.05       0.99     1.36     16
   2       O    -0.31    -5.66    10.27     -34.53      -0.35    -6.01     16
   3       C     0.13     2.63     6.69     -39.23      -0.26     2.37     16
   4       C    -0.19    -4.34     8.58     -38.99      -0.33    -4.68     16
   5       C    -0.06    -1.59     5.87    -105.02      -0.62    -2.20     16
   6       C     0.52    17.06     8.00      34.39       0.28    17.33     16
   7       O    -0.68   -23.90    17.23     -20.58      -0.35   -24.25     16
   8       O    -0.68   -23.82    17.23     -20.58      -0.35   -24.17     16
   9       C    -0.16    -3.62     8.85     -38.94      -0.34    -3.96     16
  10       C     0.22     4.20     6.66     -83.64      -0.56     3.64     16
  11       N    -0.66   -10.34     4.95     -59.73      -0.30   -10.63     16
  12       C     0.16     2.31     4.08      -5.19      -0.02     2.28     16
  13       C    -0.10    -1.12     5.28    -104.29      -0.55    -1.67     16
  14       C    -0.07    -0.49     9.66     -39.63      -0.38    -0.88     16
  15       C    -0.12    -0.58    10.04     -39.48      -0.40    -0.98     16
  16       C    -0.08    -0.43    10.03     -39.63      -0.40    -0.83     16
  17       C    -0.12    -1.16     9.75     -39.25      -0.38    -1.54     16
  18       C     0.30     4.03     9.76     -38.73      -0.38     3.66     16
  19       O    -0.64   -13.33    13.35     -57.73      -0.77   -14.10     16
  20       O    -0.75   -16.21    17.25     -57.73      -1.00   -17.20     16
  21       C    -0.01    -0.11     5.76     -38.76      -0.22    -0.33     16
  22       O    -0.32    -5.54     9.41     -34.08      -0.32    -5.86     16
  23       C     0.03     0.38    11.13     101.05       1.12     1.50     16
  24       H     0.09     1.03     8.14     -51.93      -0.42     0.60     16
  25       H     0.06     0.79     7.66     -51.93      -0.40     0.40     16
  26       H     0.06     0.85     7.65     -51.93      -0.40     0.45     16
  27       H     0.14     3.21     5.85     -52.49      -0.31     2.91     16
  28       H     0.14     3.16     6.29     -52.49      -0.33     2.83     16
  29       H     0.40     5.92     7.81     -40.82      -0.32     5.60     16
  30       H     0.12     2.17     5.60     -51.93      -0.29     1.88     16
  31       H     0.09     1.11     7.79     -51.93      -0.40     0.71     16
  32       H     0.16     0.72     8.03     -52.48      -0.42     0.30     16
  33       H     0.15     0.25     8.06     -52.48      -0.42    -0.17     16
  34       H     0.16     0.36     8.06     -52.49      -0.42    -0.07     16
  35       H     0.17     1.70     7.77     -52.48      -0.41     1.29     16
  36       H     0.33     6.62     8.90      45.56       0.41     7.03     16
  37       H     0.32     6.36     8.90      45.56       0.41     6.77     16
  38       H     0.04     0.59     8.14     -51.93      -0.42     0.17     16
  39       H     0.09     0.89     8.14     -51.92      -0.42     0.46     16
  40       H     0.04     0.43     8.14     -51.93      -0.42     0.01     16
 Total:         -1.00   -45.06   350.58                 -5.62   -50.68