REAL300020175943.mol2 34                                                        
   1       O    -0.53   -14.83    13.76      -3.85      -0.05   -14.88     16
   2       C     0.56    14.77     7.62      86.85       0.66    15.43     16
   3       N    -0.65   -20.36     4.69    -305.39      -1.43   -21.79     16
   4       C     0.14     4.85     6.31      38.42       0.24     5.09     16
   5       C    -0.12    -3.43     8.69      22.37       0.19    -3.24     16
   6       C    -0.09    -2.12    10.03      22.28       0.22    -1.89     16
   7       C    -0.12    -2.96    10.03      22.26       0.22    -2.74     16
   8       C    -0.09    -3.25     9.70      22.46       0.22    -3.03     16
   9       C    -0.03    -1.19     5.89     -19.93      -0.12    -1.31     16
  10       C     0.09     4.72     7.87     137.39       1.08     5.80     16
  11       N    -0.38   -19.33     9.75     -52.26      -0.51   -19.84     16
  12       N    -0.20   -11.28    13.45      37.02       0.50   -10.78     16
  13       N    -0.21   -12.52    13.45      37.02       0.50   -12.02     16
  14       N    -0.39   -21.76    12.15     -52.26      -0.64   -22.40     16
  15       C    -0.12    -2.31     5.88     -20.04      -0.12    -2.42     16
  16       C    -0.02    -0.41     9.53      22.50       0.21    -0.20     16
  17       C    -0.10    -2.17     9.73      22.45       0.22    -1.95     16
  18       C     0.35     7.95     9.79      22.80       0.22     8.17     16
  19       O    -0.72   -25.54    17.23    -127.47      -2.20   -27.74     16
  20       O    -0.73   -28.09    17.23    -127.47      -2.20   -30.29     16
  21       C    -0.09    -1.44     9.74      22.45       0.22    -1.22     16
  22       C     0.01     0.17     9.58      22.50       0.22     0.39     16
  23       H     0.42    13.79     4.53     -92.71      -0.42    13.37     16
  24       H     0.15     3.81     6.21      -2.91      -0.02     3.79     16
  25       H     0.17     2.34     8.06      -2.91      -0.02     2.32     16
  26       H     0.16     2.71     8.06      -2.91      -0.02     2.69     16
  27       H     0.12     4.36     7.88      -2.91      -0.02     4.33     16
  28       H     0.18     3.81     6.40      -2.91      -0.02     3.80     16
  29       H     0.18     3.93     7.75      -2.91      -0.02     3.91     16
  30       H     0.34    10.38     8.90     -74.05      -0.66     9.72     16
  31       H     0.34    11.06     8.90     -74.06      -0.66    10.40     16
  32       H     0.20     2.51     7.75      -2.91      -0.02     2.49     16
  33       H     0.21     1.78     7.64      -2.91      -0.02     1.76     16
 Total:         -1.00   -80.04   304.19                 -4.24   -84.27