REAL300020232015.mol2 36                                                        
   1       O    -0.54    -6.82    11.19       5.30       0.06    -6.76     16
   2       C     0.71     7.50     8.07     -86.92      -0.70     6.79     16
   3       N    -0.67    -7.34     5.35     -14.23      -0.08    -7.42     16
   4       C     0.15     2.12     6.28     -83.69      -0.53     1.59     16
   5       C    -0.13    -1.89     8.66     -39.40      -0.34    -2.23     16
   6       C    -0.10    -1.56    10.04     -39.61      -0.40    -1.96     16
   7       C    -0.11    -1.93     9.70     -39.55      -0.38    -2.32     16
   8       C    -0.04    -0.70     5.11    -104.65      -0.54    -1.23     16
   9       C     0.03     0.65     5.97     -29.03      -0.17     0.48     16
  10       C     0.06     1.61     7.60    -156.73      -1.19     0.42     16
  11       N    -0.39   -11.47    12.43      32.43       0.40   -11.07     16
  12       N    -0.20    -6.30    13.47      60.35       0.81    -5.49     16
  13       N    -0.20    -6.30    13.47      60.35       0.81    -5.49     16
  14       N    -0.39   -11.43    12.43      32.43       0.40   -11.03     16
  15       C    -0.13    -2.03     9.62     -39.39      -0.38    -2.41     16
  16       N    -0.66    -5.53     5.36     -12.63      -0.07    -5.60     16
  17       C     0.24     1.98     6.63     -81.30      -0.54     1.44     16
  18       C    -0.16    -1.02     8.57     -39.97      -0.34    -1.36     16
  19       C     0.00    -0.02     9.83     -40.14      -0.39    -0.41     16
  20       C    -0.12    -0.53    10.27     -37.01      -0.38    -0.92     16
  21       C     0.19     1.66     7.36     -79.59      -0.59     1.08     16
  22       C     0.14     1.40     7.33     -79.31      -0.58     0.82     16
  23       N    -0.38    -4.73    18.96      35.14       0.67    -4.07     16
  24       N    -0.28    -3.08    19.05      34.97       0.67    -2.42     16
  25       H     0.41     3.47     8.84     -40.82      -0.36     3.11     16
  26       H     0.13     1.87     6.40     -52.48      -0.34     1.53     16
  27       H     0.12     1.52     8.06     -52.48      -0.42     1.09     16
  28       H     0.13     2.04     8.06     -52.49      -0.42     1.62     16
  29       H     0.08     1.42     8.09     -51.93      -0.42     1.00     16
  30       H     0.08     1.47     8.08     -51.93      -0.42     1.05     16
  31       H     0.13     1.93     8.06     -52.49      -0.42     1.51     16
  32       H     0.42     2.81     8.79     -40.82      -0.36     2.46     16
  33       H     0.17     1.32     5.64     -52.49      -0.30     1.02     16
  34       H     0.15     0.05     8.06     -52.49      -0.42    -0.37     16
  35       H     0.16     0.25     8.06     -52.49      -0.42    -0.17     16
 Total:         -1.00   -37.63   318.87                 -3.27   -40.90