REAL300019689787.mol2 37                                                        
   1       O    -0.55    -8.54    16.34      -3.78      -0.06    -8.60     16
   2       C     0.57     4.63     7.78      86.86       0.68     5.31     16
   3       N    -0.70    -4.41     5.50    -469.46      -2.58    -7.00     16
   4       C     0.17     1.71     5.79      85.63       0.50     2.20     16
   5       C    -0.11    -1.67     5.25     -19.83      -0.10    -1.78     16
   6       C    -0.08    -1.65     9.68      22.24       0.22    -1.43     16
   7       C    -0.11    -3.57     9.70      22.47       0.22    -3.36     16
   8       C     0.01     0.26     5.88     -20.04      -0.12     0.14     16
   9       C     0.09     4.65     7.93     137.43       1.09     5.74     16
  10       N    -0.39   -23.04    12.15     -52.22      -0.63   -23.67     16
  11       N    -0.21   -13.40    13.45      37.02       0.50   -12.90     16
  12       N    -0.21   -13.40    13.45      37.02       0.50   -12.90     16
  13       N    -0.39   -23.03    12.15     -52.22      -0.63   -23.67     16
  14       C    -0.11    -3.58     9.70      22.47       0.22    -3.36     16
  15       C    -0.08    -1.65     9.68      22.24       0.22    -1.43     16
  16       C    -0.11    -0.42     5.88     -20.04      -0.12    -0.54     16
  17       C     0.00     0.01     9.58      22.50       0.22     0.23     16
  18       C    -0.10    -0.76     9.74      22.45       0.22    -0.55     16
  19       C     0.34     4.64     9.79      22.80       0.22     4.86     16
  20       O    -0.74   -22.99    17.23    -127.47      -2.20   -25.19     16
  21       O    -0.74   -23.31    17.23    -127.47      -2.20   -25.50     16
  22       C    -0.11    -0.73     9.74      22.45       0.22    -0.51     16
  23       C    -0.01    -0.01     9.53      22.50       0.21     0.20     16
  24       H     0.42     0.86     6.49     -92.70      -0.60     0.26     16
  25       H     0.09     0.87     8.08      -2.39      -0.02     0.85     16
  26       H     0.09     0.87     8.08      -2.39      -0.02     0.85     16
  27       H     0.16     2.08     8.06      -2.91      -0.02     2.05     16
  28       H     0.11     3.98     7.88      -2.91      -0.02     3.96     16
  29       H     0.11     3.98     7.88      -2.91      -0.02     3.96     16
  30       H     0.16     2.08     8.06      -2.91      -0.02     2.05     16
  31       H     0.20     0.15     7.64      -2.91      -0.02     0.13     16
  32       H     0.19     1.40     7.75      -2.91      -0.02     1.37     16
  33       H     0.34     9.14     8.90     -74.06      -0.66     8.48     16
  34       H     0.34     9.30     8.90     -74.05      -0.66     8.64     16
  35       H     0.19     1.42     7.75      -2.91      -0.02     1.40     16
  36       H     0.21    -1.07     6.39      -2.91      -0.02    -1.09     16
 Total:         -1.00   -95.20   335.05                 -5.57  -100.77