REAL300013458591.mol2 34                                                        
   1       C    -0.11    -2.40     8.47      37.16       0.31    -2.09     16
   2       C    -0.14    -3.31     0.91    -153.78      -0.14    -3.45     16
   3       C     0.51    15.71     6.74      36.01       0.24    15.95     16
   4       O    -0.69   -23.44    17.47     -20.22      -0.35   -23.79     16
   5       O    -0.69   -23.27    17.01     -20.23      -0.34   -23.62     16
   6       C    -0.11    -2.03     5.77     -25.36      -0.15    -2.18     16
   7       C     0.09     1.41     6.62      -2.97      -0.02     1.39     16
   8       N    -0.62   -10.54     3.19    -175.47      -0.56   -11.10     16
   9       C     0.72    11.44     8.35     -86.92      -0.73    10.71     16
  10       O    -0.57   -10.10    13.94       5.29       0.07   -10.03     16
  11       N    -0.67    -8.41     5.30     -12.63      -0.07    -8.47     16
  12       C     0.23     2.63     6.51     -81.29      -0.53     2.10     16
  13       C    -0.13    -1.21     8.55     -39.97      -0.34    -1.56     16
  14       C    -0.02    -0.12     9.83     -40.14      -0.39    -0.51     16
  15       C    -0.11    -0.72    10.27     -37.01      -0.38    -1.10     16
  16       C     0.19     2.01     7.36     -79.59      -0.59     1.43     16
  17       C     0.15     1.88     7.34     -79.31      -0.58     1.30     16
  18       N    -0.36    -5.34    19.00      35.14       0.67    -4.68     16
  19       N    -0.31    -4.09    19.04      34.97       0.67    -3.43     16
  20       C     0.15     3.19     5.58      -2.13      -0.01     3.18     16
  21       H     0.05     1.12     8.14     -51.93      -0.42     0.70     16
  22       H     0.05     1.20     8.14     -51.93      -0.42     0.78     16
  23       H     0.04     0.76     8.07     -51.93      -0.42     0.34     16
  24       H     0.07     1.26     7.86     -51.93      -0.41     0.86     16
  25       H     0.09     1.78     7.45     -51.93      -0.39     1.39     16
  26       H     0.07     0.88     8.14     -51.93      -0.42     0.46     16
  27       H     0.06     0.79     7.38     -51.93      -0.38     0.40     16
  28       H     0.41     4.57     7.45     -40.82      -0.30     4.27     16
  29       H     0.17     1.77     6.03     -52.49      -0.32     1.46     16
  30       H     0.15     0.37     8.06     -52.49      -0.42    -0.06     16
  31       H     0.16     0.56     8.06     -52.49      -0.42     0.14     16
  32       H     0.08     1.64     8.04     -51.93      -0.42     1.22     16
  33       H     0.09     1.87     7.76     -51.93      -0.40     1.47     16
 Total:         -1.00   -38.15   287.84                 -4.03   -42.18