REAL300018446687.mol2 41                                                        
   1       O    -0.66   -16.19    17.99     -20.56      -0.37   -16.56     16
   2       C     0.55    11.01     8.05      34.44       0.28    11.28     16
   3       O    -0.67   -14.81    17.82     -20.56      -0.37   -15.17     16
   4       C     0.01     0.08     7.13     -82.74      -0.59    -0.51     16
   5       N    -0.23    -1.82    12.03      33.42       0.40    -1.42     16
   6       N    -0.29     0.23     3.76     -56.59      -0.21     0.02     16
   7       C     0.11    -0.69     7.18      -3.70      -0.03    -0.72     16
   8       C    -0.13     1.52     5.91     -26.58      -0.16     1.37     16
   9       C    -0.14     2.37     4.76     -26.42      -0.13     2.25     16
  10       C     0.12    -1.92     2.63     -68.58      -0.18    -2.10     16
  11       N    -0.51    10.40     1.56    -108.92      -0.17    10.23     16
  12       H     0.43    -9.25     8.55     -39.29      -0.34    -9.59     16
  13       H     0.43    -8.97     7.86     -39.29      -0.31    -9.28     16
  14       C     0.05    -1.02     5.15      -4.97      -0.03    -1.05     16
  15       C    -0.16     2.86     5.35    -104.52      -0.56     2.30     16
  16       C    -0.05     0.81     9.68     -39.63      -0.38     0.43     16
  17       C    -0.11     1.10     9.75     -39.25      -0.38     0.72     16
  18       C     0.33    -2.14     9.79     -38.73      -0.38    -2.52     16
  19       O    -0.64    -1.71    17.25     -57.73      -1.00    -2.71     16
  20       O    -0.64    -1.66    17.25     -57.73      -1.00    -2.65     16
  21       C    -0.11     1.05     9.75     -39.25      -0.38     0.67     16
  22       C    -0.05     0.76     9.68     -39.63      -0.38     0.38     16
  23       C    -0.09     0.53     6.26     -81.94      -0.51     0.02     16
  24       C    -0.17    -0.14    10.18     -39.52      -0.40    -0.54     16
  25       H     0.10    -0.68     8.14     -51.93      -0.42    -1.10     16
  26       H     0.11    -0.51     8.14     -51.93      -0.42    -0.93     16
  27       H     0.09    -0.99     8.11     -51.93      -0.42    -1.41     16
  28       H     0.11    -1.47     8.14     -51.93      -0.42    -1.89     16
  29       H     0.10    -2.03     7.20     -51.93      -0.37    -2.40     16
  30       H     0.09    -1.57     8.01     -51.93      -0.42    -1.99     16
  31       H     0.15    -2.76     8.03     -51.92      -0.42    -3.18     16
  32       H     0.15    -3.56     7.97     -51.93      -0.41    -3.97     16
  33       H     0.15    -3.55     6.81     -51.93      -0.35    -3.91     16
  34       H     0.17    -3.24     8.06     -52.49      -0.42    -3.66     16
  35       H     0.18    -1.62     7.77     -52.48      -0.41    -2.03     16
  36       H     0.35     0.19     8.90      45.56       0.41     0.59     16
  37       H     0.35     0.17     8.90      45.56       0.41     0.58     16
  38       H     0.18    -1.56     7.77     -52.49      -0.41    -1.96     16
  39       H     0.17    -3.15     8.06     -52.49      -0.42    -3.57     16
  40       H     0.16    -0.34     7.83     -52.49      -0.41    -0.75     16
 Total:          0.00   -54.27   343.21                 -7.32   -61.59