REAL300019804335.mol2 39                                                        
   1       C    -0.15    -5.31     9.46      71.98       0.68    -4.62     16
   2       C    -0.11    -3.92     4.52      30.60       0.14    -3.78     16
   3       C     0.30    11.36     0.42       2.86       0.00    11.36     16
   4       C    -0.12    -4.12     4.67      30.60       0.14    -3.98     16
   5       C    -0.15    -5.17     9.43      71.98       0.68    -4.49     16
   6       N    -0.70   -22.78     3.35    -429.24      -1.44   -24.22     16
   7       C     0.56    14.82     6.97      86.77       0.60    15.42     16
   8       O    -0.51   -13.81    10.22      -3.90      -0.04   -13.85     16
   9       C    -0.08    -1.60     5.87     -20.10      -0.12    -1.72     16
  10       C    -0.07    -1.63     9.24      22.74       0.21    -1.42     16
  11       C     0.32     6.63     9.79      22.81       0.22     6.86     16
  12       O    -0.70   -23.40    17.23    -127.47      -2.20   -25.60     16
  13       O    -0.74   -30.22    17.23    -127.47      -2.20   -32.42     16
  14       C    -0.04    -0.41     9.74      22.53       0.22    -0.19     16
  15       C    -0.03    -0.14     9.80      22.23       0.22     0.08     16
  16       C     0.02     0.27     6.36      22.68       0.14     0.41     16
  17       Cl    0.02     0.30    26.00      -2.72      -0.07     0.22     16
  18       C     0.06     3.06     6.11     138.58       0.85     3.91     16
  19       N    -0.38   -21.07    10.04     -51.29      -0.52   -21.58     16
  20       N    -0.22   -13.59    13.47      37.02       0.50   -13.09     16
  21       N    -0.22   -13.56    13.47      37.02       0.50   -13.06     16
  22       N    -0.38   -21.00     9.55     -51.29      -0.49   -21.49     16
  23       H     0.06     1.99     8.14      -2.38      -0.02     1.97     16
  24       H     0.04     1.45     7.60      -2.39      -0.02     1.43     16
  25       H     0.05     2.31     5.50      -2.39      -0.01     2.30     16
  26       H     0.06     2.30     8.14      -2.39      -0.02     2.28     16
  27       H     0.10     3.07     6.16      -2.39      -0.01     3.06     16
  28       H     0.10     3.17     6.32      -2.39      -0.02     3.15     16
  29       H     0.05     2.01     8.14      -2.39      -0.02     1.99     16
  30       H     0.05     1.68     7.29      -2.39      -0.02     1.66     16
  31       H     0.06     1.89     8.14      -2.39      -0.02     1.87     16
  32       H     0.05     2.25     5.69      -2.39      -0.01     2.24     16
  33       H     0.40    13.82     6.49     -92.71      -0.60    13.22     16
  34       H     0.16     4.45     6.10      -2.91      -0.02     4.43     16
  35       H     0.34    10.05     8.90     -74.06      -0.66     9.40     16
  36       H     0.34    12.06     8.90     -74.06      -0.66    11.40     16
  37       H     0.21     1.15     7.76      -2.91      -0.02     1.13     16
  38       H     0.24    -1.41     8.06      -2.91      -0.02    -1.44     16
 Total:         -1.00   -83.06   330.31                 -4.11   -87.17