REAL300018695747.mol2 38                                                        
   1       O    -0.69    -7.41    14.78      19.04       0.28    -7.13     16
   2       C     0.48     3.94     7.00      71.23       0.50     4.44     16
   3       O    -0.71   -17.66    17.87      19.06       0.34   -17.32     16
   4       C     0.04    -0.54     2.53      43.42       0.11    -0.44     16
   5       N    -0.47    13.84     1.25    -503.39      -0.63    13.21     16
   6       H     0.45   -18.24     8.59     -89.69      -0.77   -19.01     16
   7       H     0.43   -12.64     6.72     -89.70      -0.60   -13.24     16
   8       C     0.04    -1.21     5.11      85.56       0.44    -0.78     16
   9       C    -0.10     2.90     5.36     -19.80      -0.11     2.79     16
  10       C    -0.01     0.24     9.68      22.24       0.22     0.46     16
  11       C    -0.11     1.83     9.75      22.48       0.22     2.05     16
  12       C     0.33    -1.99     9.80      22.82       0.22    -1.77     16
  13       O    -0.74   -12.21    17.25    -127.47      -2.20   -14.40     16
  14       O    -0.75   -13.93    17.25    -127.47      -2.20   -16.13     16
  15       C    -0.12     1.40     9.75      22.48       0.22     1.62     16
  16       C    -0.02     0.54     9.68      22.24       0.22     0.75     16
  17       C    -0.09     0.81     4.74     -19.88      -0.09     0.72     16
  18       C    -0.13     1.47     9.30      22.28       0.21     1.68     16
  19       C    -0.10     0.78    10.04      22.25       0.22     1.01     16
  20       C    -0.15     0.61     9.99      22.37       0.22     0.84     16
  21       C     0.10    -0.21     6.70      22.51       0.15    -0.05     16
  22       O    -0.52     0.83    13.50     -92.41      -1.25    -0.42     16
  23       C    -0.13     0.56     9.61      22.37       0.21     0.77     16
  24       H     0.18    -3.60     7.95      -2.39      -0.02    -3.62     16
  25       H     0.14    -2.77     5.59      -2.39      -0.01    -2.78     16
  26       H     0.19    -6.94     8.06      -2.39      -0.02    -6.96     16
  27       H     0.24    -9.52     8.06      -2.91      -0.02    -9.54     16
  28       H     0.18    -2.67     7.77      -2.91      -0.02    -2.70     16
  29       H     0.34     4.73     8.90     -74.06      -0.66     4.08     16
  30       H     0.33     5.23     8.90     -74.05      -0.66     4.57     16
  31       H     0.17    -1.28     7.77      -2.91      -0.02    -1.30     16
  32       H     0.20    -4.58     8.06      -2.90      -0.02    -4.61     16
  33       H     0.15    -2.84     6.72      -2.91      -0.02    -2.86     16
  34       H     0.15    -1.80     8.06      -2.91      -0.02    -1.82     16
  35       H     0.14    -0.74     8.06      -2.91      -0.02    -0.77     16
  36       H     0.41    -5.16     9.06     -74.06      -0.67    -5.83     16
  37       H     0.14    -0.75     8.04      -2.91      -0.02    -0.78     16
 Total:          0.00   -88.97   327.26                 -6.29   -95.26