REAL300009850684.mol2 43                                                        
   1       C    -0.15    -2.78     9.31      37.16       0.35    -2.43     16
   2       C    -0.08    -1.68     3.84     -26.73      -0.10    -1.78     16
   3       C    -0.15    -3.26     0.36    -156.81      -0.06    -3.32     16
   4       C    -0.09    -1.67     3.83     -26.73      -0.10    -1.77     16
   5       C    -0.16    -2.33     9.31      37.16       0.35    -1.99     16
   6       C     0.51    14.39     5.31      36.01       0.19    14.58     16
   7       O    -0.68   -21.85    17.70     -20.23      -0.36   -22.21     16
   8       O    -0.68   -20.69    16.88     -20.23      -0.34   -21.03     16
   9       C     0.56    11.23     4.83     -10.99      -0.05    11.18     16
  10       O    -0.53   -11.14    13.65       5.55       0.08   -11.06     16
  11       N    -0.67   -11.36     5.12      -9.89      -0.05   -11.41     16
  12       C     0.21     2.94     6.25     -83.76      -0.52     2.42     16
  13       C    -0.16    -1.66     9.69     -38.96      -0.38    -2.04     16
  14       C    -0.03    -0.24     5.74    -106.77      -0.61    -0.86     16
  15       C    -0.06    -0.41     9.73     -39.53      -0.38    -0.80     16
  16       C    -0.11    -1.02     9.65     -39.64      -0.38    -1.40     16
  17       C     0.32     3.80     9.78     -38.67      -0.38     3.42     16
  18       O    -0.69   -12.35    17.19     -57.73      -0.99   -13.34     16
  19       O    -0.69   -12.13    17.20     -57.73      -0.99   -13.13     16
  20       C    -0.08    -0.80     9.49     -38.79      -0.37    -1.16     16
  21       C    -0.04    -0.45     5.74    -106.81      -0.61    -1.06     16
  22       C    -0.08    -0.85     9.74     -39.48      -0.38    -1.24     16
  23       C    -0.09    -1.34     8.55     -39.76      -0.34    -1.68     16
  24       H     0.05     0.76     8.14     -51.93      -0.42     0.34     16
  25       H     0.05     0.91     6.43     -51.93      -0.33     0.58     16
  26       H     0.06     1.35     7.22     -51.93      -0.37     0.97     16
  27       H     0.07     1.56     8.04     -51.93      -0.42     1.14     16
  28       H     0.06     1.07     6.39     -51.93      -0.33     0.74     16
  29       H     0.06     1.08     7.41     -51.93      -0.38     0.69     16
  30       H     0.08     1.52     6.39     -51.93      -0.33     1.19     16
  31       H     0.06     0.86     6.43     -51.93      -0.33     0.53     16
  32       H     0.04     0.68     7.22     -51.93      -0.37     0.30     16
  33       H     0.05     0.65     8.14     -51.92      -0.42     0.23     16
  34       H     0.42     6.62     8.05     -40.82      -0.33     6.30     16
  35       H     0.14     1.12     8.06     -52.49      -0.42     0.70     16
  36       H     0.17     0.63     8.06     -52.49      -0.42     0.21     16
  37       H     0.17     1.41     7.73     -52.48      -0.41     1.01     16
  38       H     0.33     4.97     8.90      45.56       0.41     5.37     16
  39       H     0.33     4.88     8.90      45.56       0.41     5.29     16
  40       H     0.18     1.76     7.73     -52.48      -0.41     1.36     16
  41       H     0.15     1.26     8.06     -52.49      -0.42     0.84     16
  42       H     0.15     2.57     6.40     -52.48      -0.34     2.23     16
 Total:         -1.00   -39.99   352.60                 -6.80   -46.79