REAL300018408847.mol2 38                                                        
   1       O    -0.70   -33.27    17.20      17.77       0.31   -32.96     16
   2       C     0.50    20.11     8.00      70.26       0.56    20.67     16
   3       O    -0.71   -34.25    17.20      17.76       0.31   -33.95     16
   4       C    -0.13    -2.65     5.87     -20.14      -0.12    -2.76     16
   5       C     0.08     0.89     9.34      22.86       0.21     1.10     16
   6       C    -0.13    -0.46     5.74     -21.29      -0.12    -0.59     16
   7       C     0.00     0.00     9.89      22.54       0.22     0.23     16
   8       C    -0.14     1.03    10.03      22.14       0.22     1.25     16
   9       C     0.16    -0.72    11.15      85.04       0.95     0.23     16
  10       N    -0.47    -0.25     9.56    -188.08      -1.80    -2.05     16
  11       C     0.11     0.33     6.62      40.53       0.27     0.60     16
  12       C     0.29     0.67     6.65      38.26       0.25     0.92     16
  13       N    -0.52     1.52     5.71    -343.20      -1.96    -0.44     16
  14       C     0.12    -0.49     5.01      85.63       0.43    -0.06     16
  15       C    -0.11    -0.54     5.25     -19.80      -0.10    -0.64     16
  16       C    -0.02    -0.21     9.68      22.24       0.22     0.00     16
  17       C    -0.13    -4.14     9.75      22.49       0.22    -3.92     16
  18       C     0.31    14.66     9.79      22.82       0.22    14.88     16
  19       O    -1.09   -95.33    17.25    -127.47      -2.20   -97.53     16
  20       O    -1.09   -95.33    17.25    -127.47      -2.20   -97.53     16
  21       C    -0.13    -4.14     9.75      22.48       0.22    -3.92     16
  22       C    -0.02    -0.21     9.68      22.24       0.22     0.00     16
  23       C    -0.06    -0.58     8.78      22.42       0.20    -0.38     16
  24       H     0.17     2.01     7.61      -2.92      -0.02     1.99     16
  25       H     0.19    -1.63     8.06      -2.91      -0.02    -1.65     16
  26       H     0.19    -2.65     8.06      -2.91      -0.02    -2.67     16
  27       H     0.21    -2.09     8.06      -2.91      -0.02    -2.12     16
  28       H     0.44    -1.59     7.82     -92.71      -0.73    -2.31     16
  29       H     0.16    -1.24     7.86      -2.38      -0.02    -1.26     16
  30       H     0.16    -1.24     7.86      -2.39      -0.02    -1.26     16
  31       H     0.21     0.12     8.06      -2.91      -0.02     0.10     16
  32       H     0.14     5.50     7.77      -2.91      -0.02     5.48     16
  33       H     0.23    21.07     8.90     -74.06      -0.66    20.41     16
  34       H     0.23    21.07     8.90     -74.06      -0.66    20.41     16
  35       H     0.14     5.50     7.77      -2.91      -0.02     5.48     16
  36       H     0.21     0.12     8.06      -2.91      -0.02     0.10     16
  37       H     0.18     1.53     6.15      -2.91      -0.02     1.51     16
 Total:         -1.00  -186.89   336.11                 -5.76  -192.65