REAL300018699242.mol2 40                                                        
   1       O    -0.67   -23.54    17.32     -20.23      -0.35   -23.89     16
   2       C     0.48    15.34     8.12      36.00       0.29    15.63     16
   3       O    -0.69   -24.29    18.00     -20.23      -0.36   -24.65     16
   4       C     0.03     0.78     6.56      -5.20      -0.03     0.74     16
   5       N    -0.44    -9.90     2.27    -115.70      -0.26   -10.17     16
   6       C     0.06     1.14    11.28     -16.68      -0.19     0.96     16
   7       C    -0.22    -3.77    10.86     -37.69      -0.41    -4.18     16
   8       C    -0.16    -3.02     6.27    -104.99      -0.66    -3.68     16
   9       C     0.25     3.69     6.68     -83.56      -0.56     3.13     16
  10       N    -0.75    -7.34     5.72     -59.63      -0.34    -7.68     16
  11       C     0.17     1.01     5.03      -5.19      -0.03     0.98     16
  12       C    -0.09    -0.40     5.26    -104.52      -0.55    -0.95     16
  13       C    -0.06    -0.23     9.68     -39.63      -0.38    -0.62     16
  14       C    -0.11    -0.68     9.75     -39.25      -0.38    -1.06     16
  15       C     0.33     2.84     9.80     -38.72      -0.38     2.46     16
  16       O    -0.68   -10.41    17.25     -57.73      -1.00   -11.41     16
  17       O    -0.67   -10.45    17.25     -57.73      -1.00   -11.44     16
  18       C    -0.11    -0.65     9.75     -39.25      -0.38    -1.03     16
  19       C    -0.06    -0.22     9.69     -39.62      -0.38    -0.60     16
  20       C    -0.24    -3.43     9.31     -39.36      -0.37    -3.79     16
  21       C    -0.07    -1.06    10.00     -39.58      -0.40    -1.45     16
  22       C    -0.17    -3.29     9.98     -39.39      -0.39    -3.69     16
  23       C     0.15     3.32     6.80     -84.01      -0.57     2.75     16
  24       H     0.09     1.85     8.12     -51.93      -0.42     1.43     16
  25       H     0.08     1.86     8.14     -51.93      -0.42     1.44     16
  26       H     0.16     2.57     8.06     -52.49      -0.42     2.15     16
  27       H     0.13     1.81     8.06     -52.48      -0.42     1.39     16
  28       H     0.40     3.68     8.29     -40.82      -0.34     3.35     16
  29       H     0.08     0.39     7.88     -51.93      -0.41    -0.02     16
  30       H     0.08     0.44     7.90     -51.93      -0.41     0.03     16
  31       H     0.17     0.45     8.06     -52.49      -0.42     0.02     16
  32       H     0.17     1.09     7.77     -52.49      -0.41     0.69     16
  33       H     0.33     4.21     8.90      45.56       0.41     4.62     16
  34       H     0.33     4.24     8.90      45.56       0.41     4.65     16
  35       H     0.17     1.02     7.77     -52.48      -0.41     0.61     16
  36       H     0.17     0.30     8.06     -52.49      -0.42    -0.12     16
  37       H     0.11     1.20     6.72     -52.49      -0.35     0.85     16
  38       H     0.12     1.52     8.06     -52.48      -0.42     1.09     16
  39       H     0.11     2.22     8.06     -52.48      -0.42     1.80     16
 Total:         -1.00   -45.70   351.39                 -8.68   -54.39