REAL300013458578.mol2 34                                                        
   1       O    -0.70   -25.10    18.00     -20.23      -0.36   -25.46     16
   2       C     0.50    15.97     6.99      36.01       0.25    16.22     16
   3       O    -0.69   -24.50    17.31     -20.23      -0.35   -24.85     16
   4       C    -0.15    -3.63     2.54     -91.73      -0.23    -3.86     16
   5       C    -0.11    -2.24     5.06     -26.61      -0.13    -2.37     16
   6       C     0.13     1.97     6.44      -3.71      -0.02     1.95     16
   7       N    -0.61    -9.03     2.97    -178.24      -0.53    -9.55     16
   8       C     0.71    10.08     8.17     -86.93      -0.71     9.37     16
   9       O    -0.56    -8.73    12.65       5.29       0.07    -8.67     16
  10       N    -0.67    -7.97     5.15     -12.63      -0.07    -8.04     16
  11       C     0.23     2.60     6.65     -81.29      -0.54     2.06     16
  12       C    -0.16    -1.43     8.69     -39.97      -0.35    -1.78     16
  13       C    -0.01    -0.06     9.83     -40.14      -0.39    -0.45     16
  14       C    -0.12    -0.79    10.27     -37.01      -0.38    -1.17     16
  15       C     0.19     2.07     7.36     -79.59      -0.59     1.48     16
  16       C     0.15     1.82     7.33     -79.31      -0.58     1.23     16
  17       N    -0.37    -5.52    18.99      35.14       0.67    -4.85     16
  18       N    -0.30    -3.92    19.04      34.97       0.67    -3.25     16
  19       C     0.11     1.52     6.33      -3.48      -0.02     1.50     16
  20       C    -0.11    -2.18     5.36     -26.38      -0.14    -2.32     16
  21       H     0.06     1.42     8.14     -51.93      -0.42     1.00     16
  22       H     0.07     1.65     7.92     -51.93      -0.41     1.24     16
  23       H     0.07     1.43     8.14     -51.93      -0.42     1.00     16
  24       H     0.09     1.39     7.00     -51.93      -0.36     1.02     16
  25       H     0.07     0.92     8.14     -51.93      -0.42     0.49     16
  26       H     0.41     4.48     6.53     -40.82      -0.27     4.21     16
  27       H     0.18     1.85     5.29     -52.50      -0.28     1.57     16
  28       H     0.15     0.33     8.06     -52.49      -0.42    -0.09     16
  29       H     0.16     0.56     8.06     -52.49      -0.42     0.13     16
  30       H     0.08     0.95     8.14     -51.93      -0.42     0.52     16
  31       H     0.07     0.82     5.86     -51.93      -0.30     0.52     16
  32       H     0.07     1.45     8.14     -51.93      -0.42     1.03     16
  33       H     0.07     1.44     8.14     -51.93      -0.42     1.02     16
 Total:         -1.00   -40.39   282.70                 -4.50   -44.88