REAL300013458609.mol2 34                                                        
   1       O    -0.69   -21.71    16.07     -20.23      -0.33   -22.04     16
   2       C     0.51    14.97     6.59      36.00       0.24    15.21     16
   3       O    -0.69   -22.23    16.15     -20.23      -0.33   -22.56     16
   4       C    -0.17    -3.73     1.04    -154.85      -0.16    -3.89     16
   5       C     0.18     3.54     4.77      -4.04      -0.02     3.52     16
   6       N    -0.70   -13.51     4.74     -65.23      -0.31   -13.82     16
   7       C     0.70    12.46     8.33     -86.92      -0.72    11.73     16
   8       O    -0.58   -10.79    13.50       5.29       0.07   -10.72     16
   9       N    -0.67   -10.01     5.36     -12.63      -0.07   -10.08     16
  10       C     0.25     3.37     6.64     -81.29      -0.54     2.83     16
  11       C    -0.17    -1.91     8.58     -39.97      -0.34    -2.25     16
  12       C     0.00     0.00     9.83     -40.13      -0.39    -0.40     16
  13       C    -0.13    -1.06    10.27     -37.00      -0.38    -1.44     16
  14       C     0.20     2.38     7.36     -79.59      -0.59     1.79     16
  15       C     0.15     2.06     7.33     -79.31      -0.58     1.48     16
  16       N    -0.37    -6.09    18.95      35.14       0.67    -5.42     16
  17       N    -0.31    -4.30    19.05      34.97       0.67    -3.63     16
  18       C    -0.12    -2.35     7.07     -25.83      -0.18    -2.53     16
  19       C    -0.13    -2.46     7.64     -25.83      -0.20    -2.66     16
  20       C    -0.11    -2.20     7.22     -25.92      -0.19    -2.39     16
  21       H     0.07     1.40     8.14     -51.93      -0.42     0.97     16
  22       H     0.06     1.00     7.98     -51.93      -0.41     0.59     16
  23       H     0.41     8.18     7.43     -40.82      -0.30     7.88     16
  24       H     0.41     5.85     8.77     -40.82      -0.36     5.49     16
  25       H     0.17     2.29     5.60     -52.49      -0.29     2.00     16
  26       H     0.15     0.60     8.06     -52.49      -0.42     0.17     16
  27       H     0.16     0.77     8.06     -52.48      -0.42     0.34     16
  28       H     0.07     1.11     7.99     -51.93      -0.41     0.70     16
  29       H     0.06     1.32     8.09     -51.93      -0.42     0.90     16
  30       H     0.10     2.11     7.03     -51.93      -0.37     1.74     16
  31       H     0.05     0.81     8.14     -51.93      -0.42     0.39     16
  32       H     0.06     1.33     8.09     -51.92      -0.42     0.91     16
  33       H     0.07     1.15     8.10     -51.93      -0.42     0.73     16
 Total:         -1.00   -35.67   287.99                 -4.45   -40.12