REAL300013458614.mol2 34                                                        
   1       O    -0.74   -53.04    17.24      17.81       0.31   -52.73     16
   2       C     0.50    31.79     7.98      70.27       0.56    32.35     16
   3       O    -0.69   -45.38    13.63      17.79       0.24   -45.14     16
   4       C    -0.16    -8.06     5.87     -20.11      -0.12    -8.18     16
   5       C    -0.11    -4.57     9.60      22.55       0.22    -4.35     16
   6       C    -0.12    -3.54    10.03      22.23       0.22    -3.32     16
   7       C    -0.11    -2.64    10.04      22.34       0.22    -2.42     16
   8       C    -0.11    -3.16     9.66      22.23       0.21    -2.94     16
   9       C    -0.09    -3.42     5.29     -19.58      -0.10    -3.52     16
  10       C     0.19     7.71     4.82      85.63       0.41     8.12     16
  11       N    -0.70   -26.62     4.82    -482.30      -2.32   -28.95     16
  12       C     0.71    26.34     8.33     179.06       1.49    27.84     16
  13       O    -0.59   -23.86    13.50      -3.99      -0.05   -23.91     16
  14       N    -0.66   -20.79     5.36    -312.13      -1.67   -22.47     16
  15       C     0.22     6.21     6.64      40.07       0.27     6.47     16
  16       C    -0.16    -3.81     8.58      22.02       0.19    -3.62     16
  17       C     0.02     0.29     9.83      21.91       0.22     0.51     16
  18       C    -0.12    -1.45    10.27      23.94       0.25    -1.21     16
  19       C     0.20     4.58     7.36      44.11       0.32     4.91     16
  20       C     0.15     4.30     7.33      44.50       0.33     4.62     16
  21       N    -0.46   -15.55    18.95     -42.74      -0.81   -16.36     16
  22       N    -0.29    -7.71    19.05     -43.28      -0.82    -8.53     16
  23       H     0.10     4.80     7.65      -2.91      -0.02     4.77     16
  24       H     0.16     3.41     8.06      -2.91      -0.02     3.39     16
  25       H     0.17     2.62     8.06      -2.91      -0.02     2.60     16
  26       H     0.16     3.36     8.03      -2.91      -0.02     3.33     16
  27       H     0.07     3.40     5.94      -2.39      -0.01     3.39     16
  28       H     0.08     2.79     8.00      -2.38      -0.02     2.77     16
  29       H     0.40    14.27     8.48     -92.71      -0.79    13.48     16
  30       H     0.42    12.03     8.77     -92.71      -0.81    11.22     16
  31       H     0.15     4.53     5.61      -2.91      -0.02     4.51     16
  32       H     0.20     0.78     8.06      -2.91      -0.02     0.75     16
  33       H     0.21     0.77     8.06      -2.91      -0.02     0.75     16
 Total:         -1.00   -89.64   298.88                 -2.24   -91.87