REAL300009850706.mol2 37                                                        
   1       O    -0.66   -21.70    16.62     -20.23      -0.34   -22.04     16
   2       C     0.49    14.40     8.09      36.00       0.29    14.70     16
   3       O    -0.68   -22.15    18.00     -20.23      -0.36   -22.52     16
   4       C     0.04     0.78     7.10      -5.20      -0.04     0.74     16
   5       N    -0.31    -6.16     3.41     -62.24      -0.21    -6.37     16
   6       C     0.09     1.41    11.27     -16.82      -0.19     1.23     16
   7       C    -0.14    -2.14     6.99     -83.55      -0.58    -2.73     16
   8       C     0.62     8.17     7.65     -12.49      -0.10     8.08     16
   9       O    -0.52    -7.37    14.26       5.28       0.08    -7.30     16
  10       N    -0.67    -6.57     5.30     -10.84      -0.06    -6.63     16
  11       C     0.19     1.62     6.28     -83.78      -0.53     1.09     16
  12       C    -0.14    -0.86     9.69     -38.95      -0.38    -1.24     16
  13       C    -0.03    -0.18     5.74    -106.77      -0.61    -0.79     16
  14       C    -0.06    -0.23     9.73     -39.52      -0.38    -0.62     16
  15       C    -0.11    -0.72     9.65     -39.64      -0.38    -1.10     16
  16       C     0.32     2.98     9.78     -38.66      -0.38     2.60     16
  17       O    -0.68   -10.64    17.20     -57.73      -0.99   -11.63     16
  18       O    -0.68   -10.79    17.19     -57.73      -0.99   -11.78     16
  19       C    -0.08    -0.59     9.49     -38.78      -0.37    -0.96     16
  20       C    -0.04    -0.26     5.74    -106.81      -0.61    -0.87     16
  21       C    -0.08    -0.50     9.74     -39.48      -0.38    -0.88     16
  22       C    -0.10    -0.83     8.58     -39.75      -0.34    -1.17     16
  23       N    -0.23    -4.22    12.04      32.84       0.40    -3.82     16
  24       N    -0.01    -0.29    12.88      60.35       0.78     0.49     16
  25       H     0.10     1.90     8.14     -51.93      -0.42     1.48     16
  26       H     0.11     1.81     8.08     -51.93      -0.42     1.39     16
  27       H     0.20     2.40     8.06     -52.49      -0.42     1.98     16
  28       H     0.43     3.66     8.51     -40.82      -0.35     3.31     16
  29       H     0.15     0.53     8.06     -52.48      -0.42     0.11     16
  30       H     0.17     0.15     8.06     -52.49      -0.42    -0.27     16
  31       H     0.17     1.03     7.73     -52.48      -0.41     0.62     16
  32       H     0.33     4.28     8.90      45.56       0.41     4.68     16
  33       H     0.33     4.33     8.90      45.56       0.41     4.73     16
  34       H     0.18     1.26     7.73     -52.49      -0.41     0.85     16
  35       H     0.15     0.65     8.06     -52.49      -0.42     0.23     16
  36       H     0.16     1.52     6.18     -52.49      -0.32     1.19     16
 Total:         -1.00   -43.33   338.85                 -4.79   -48.12