REAL300018353251.mol2 44                                                        
   1       O    -0.67    -7.14    14.83     -20.23      -0.30    -7.44     16
   2       C     0.49     4.02     6.95      36.01       0.25     4.27     16
   3       O    -0.63    -9.06    17.59     -20.23      -0.36    -9.42     16
   4       C    -0.05     0.10     2.67     -68.87      -0.18    -0.08     16
   5       C    -0.13     0.27     4.32     -26.73      -0.12     0.15     16
   6       C    -0.10     0.45     2.20     -90.43      -0.20     0.25     16
   7       C    -0.16     1.13     4.52     -26.59      -0.12     1.01     16
   8       C     0.06    -0.30     6.84      37.20       0.25    -0.05     16
   9       O    -0.38     0.47    10.77     -35.23      -0.38     0.09     16
  10       C     0.06    -0.14     6.84      37.20       0.25     0.11     16
  11       C    -0.15     0.45     5.42     -26.59      -0.14     0.31     16
  12       N    -0.49     3.70     1.04    -109.22      -0.11     3.59     16
  13       H     0.40    -4.74     4.08     -39.29      -0.16    -4.90     16
  14       H     0.42    -3.81     7.04     -39.29      -0.28    -4.09     16
  15       C     0.03    -0.13     3.07      -4.98      -0.02    -0.15     16
  16       C    -0.10     0.52     5.88    -104.29      -0.61    -0.09     16
  17       C    -0.11     1.09     8.96     -39.63      -0.36     0.73     16
  18       C    -0.09     0.86    10.04     -39.49      -0.40     0.47     16
  19       C    -0.07     0.58    10.03     -39.63      -0.40     0.19     16
  20       C    -0.09     0.46     9.76     -39.25      -0.38     0.08     16
  21       C     0.31    -0.68     9.75     -38.72      -0.38    -1.06     16
  22       O    -0.64    -3.46    17.27     -57.73      -1.00    -4.46     16
  23       O    -0.65    -2.65    14.09     -57.73      -0.81    -3.46     16
  24       H     0.14    -0.58     7.81     -51.93      -0.41    -0.99     16
  25       H     0.12     0.17     7.62     -51.93      -0.40    -0.23     16
  26       H     0.09    -0.22     5.23     -51.93      -0.27    -0.49     16
  27       H     0.09    -0.39     7.99     -51.93      -0.41    -0.81     16
  28       H     0.08    -0.55     8.14     -51.93      -0.42    -0.98     16
  29       H     0.05    -0.57     5.07     -51.93      -0.26    -0.83     16
  30       H     0.06    -0.30     8.14     -51.93      -0.42    -0.72     16
  31       H     0.10    -0.60     8.14     -51.93      -0.42    -1.02     16
  32       H     0.05    -0.17     8.14     -51.93      -0.42    -0.59     16
  33       H     0.10    -0.27     8.14     -51.93      -0.42    -0.69     16
  34       H     0.08    -0.23     8.14     -51.93      -0.42    -0.65     16
  35       H     0.08    -0.18     8.14     -51.93      -0.42    -0.60     16
  36       H     0.19     0.37     4.72     -51.93      -0.24     0.13     16
  37       H     0.15    -0.63     5.17     -51.93      -0.27    -0.90     16
  38       H     0.15    -2.05     6.12     -52.49      -0.32    -2.37     16
  39       H     0.16    -2.00     8.06     -52.48      -0.42    -2.42     16
  40       H     0.17    -1.84     8.06     -52.49      -0.42    -2.27     16
  41       H     0.18    -0.80     7.79     -52.49      -0.41    -1.21     16
  42       H     0.34     1.11     8.91      45.56       0.41     1.52     16
  43       H     0.34     0.96     8.91      45.56       0.41     1.36     16
 Total:          0.00   -26.78   332.41                 -6.92   -33.70