REAL300018307878.mol2 41                                                        
   1       O    -0.67   -17.29    17.40     -26.62      -0.46   -17.75     16
   2       C     0.50    11.39     8.13      36.01       0.29    11.68     16
   3       O    -0.68   -17.81    18.00     -20.23      -0.36   -18.18     16
   4       C    -0.01    -0.16     5.30      36.01       0.19     0.03     16
   5       O    -0.27    -2.93     9.67     -39.28      -0.38    -3.31     16
   6       C     0.15     0.53     6.69     -39.22      -0.26     0.27     16
   7       C    -0.19    -0.37     9.04     -39.43      -0.36    -0.73     16
   8       C    -0.07     0.14    10.04     -39.60      -0.40    -0.25     16
   9       C    -0.15     0.84     9.70     -39.56      -0.38     0.46     16
  10       C    -0.13     1.00     5.35    -104.64      -0.56     0.44     16
  11       C     0.06    -0.83     5.50      -4.98      -0.03    -0.85     16
  12       N    -0.50     8.70     1.59    -116.34      -0.18     8.52     16
  13       H     0.43    -6.94     7.07     -39.29      -0.28    -7.22     16
  14       H     0.42    -8.20     8.66     -39.29      -0.34    -8.54     16
  15       C     0.04    -0.78     4.65      -4.97      -0.02    -0.80     16
  16       C    -0.14     2.16     5.38    -104.29      -0.56     1.60     16
  17       C    -0.06     0.94     9.66     -39.63      -0.38     0.55     16
  18       C    -0.10     1.58    10.04     -39.49      -0.40     1.19     16
  19       C    -0.04     0.61    10.03     -39.63      -0.40     0.21     16
  20       C    -0.11     1.33     9.75     -39.25      -0.38     0.95     16
  21       C     0.32    -3.71     9.76     -38.73      -0.38    -4.09     16
  22       O    -0.58     2.07    17.25     -57.73      -1.00     1.07     16
  23       O    -0.74     6.43    12.38     -57.73      -0.71     5.72     16
  24       C    -0.14     0.38     9.64     -39.43      -0.38     0.00     16
  25       H     0.07     0.77     7.66     -51.93      -0.40     0.37     16
  26       H     0.06     0.72     7.66     -51.93      -0.40     0.33     16
  27       H     0.14     0.43     6.30     -52.49      -0.33     0.10     16
  28       H     0.13    -0.44     8.06     -52.49      -0.42    -0.86     16
  29       H     0.13    -1.05     8.06     -52.49      -0.42    -1.48     16
  30       H     0.14    -2.22     8.08     -51.93      -0.42    -2.64     16
  31       H     0.14    -2.06     8.08     -51.93      -0.42    -2.48     16
  32       H     0.14    -2.92     8.00     -51.93      -0.42    -3.33     16
  33       H     0.17    -2.56     5.75     -51.93      -0.30    -2.86     16
  34       H     0.18    -3.42     8.04     -52.48      -0.42    -3.84     16
  35       H     0.17    -2.81     8.06     -52.49      -0.42    -3.23     16
  36       H     0.18    -2.78     8.06     -52.49      -0.42    -3.20     16
  37       H     0.18    -2.02     7.77     -52.49      -0.41    -2.43     16
  38       H     0.35    -1.98     8.90      45.56       0.41    -1.58     16
  39       H     0.34    -2.84     8.90      45.56       0.41    -2.43     16
  40       H     0.14    -0.61     8.06     -52.49      -0.42    -1.03     16
 Total:          0.00   -46.69   346.13                 -7.72   -54.41