REAL300019699643.mol2 35                                                        
   1       O    -0.51    -7.95    16.51       5.35       0.09    -7.87     16
   2       C     0.56     6.42     7.27     -12.21      -0.09     6.33     16
   3       C    -0.11    -0.80     5.07    -104.89      -0.53    -1.34     16
   4       C    -0.05    -0.25     7.36     -39.23      -0.29    -0.54     16
   5       C    -0.11    -0.65     9.74     -39.30      -0.38    -1.03     16
   6       C     0.33     2.82     9.79     -38.76      -0.38     2.44     16
   7       O    -0.67    -9.74    17.23     -57.73      -0.99   -10.73     16
   8       O    -0.67    -9.83    17.23     -57.73      -0.99   -10.83     16
   9       C    -0.11    -0.70     9.74     -39.30      -0.38    -1.08     16
  10       C    -0.03    -0.15     9.70     -39.23      -0.38    -0.54     16
  11       N    -0.60    -7.24     3.03    -173.55      -0.53    -7.77     16
  12       C     0.06     0.49     5.38      -3.75      -0.02     0.47     16
  13       C     0.05     0.51     6.97      37.10       0.26     0.77     16
  14       O    -0.36    -6.49    10.37     -35.23      -0.37    -6.85     16
  15       C     0.20     4.03     3.33     -27.73      -0.09     3.94     16
  16       C     0.05     1.40     7.25    -156.72      -1.14     0.27     16
  17       N    -0.36   -10.50    12.43      32.44       0.40   -10.10     16
  18       N    -0.19    -5.99    13.47      60.35       0.81    -5.18     16
  19       N    -0.19    -5.89    13.47      60.35       0.81    -5.07     16
  20       N    -0.38   -10.99    12.43      32.44       0.40   -10.58     16
  21       C     0.09     1.60     5.90      -3.53      -0.02     1.58     16
  22       H     0.17     0.52     6.90     -52.48      -0.36     0.16     16
  23       H     0.18     0.94     7.76     -52.48      -0.41     0.53     16
  24       H     0.33     3.96     8.90      45.56       0.41     4.36     16
  25       H     0.33     3.99     8.90      45.56       0.41     4.39     16
  26       H     0.18     1.07     7.75     -52.49      -0.41     0.66     16
  27       H     0.18     0.86     8.06     -52.49      -0.42     0.43     16
  28       H     0.10     0.49     4.69     -51.93      -0.24     0.24     16
  29       H     0.09     0.69     8.14     -51.93      -0.42     0.27     16
  30       H     0.11     0.91     8.14     -51.93      -0.42     0.49     16
  31       H     0.05     0.56     8.14     -51.93      -0.42     0.13     16
  32       H     0.07     1.35     8.14     -51.93      -0.42     0.92     16
  33       H     0.09     1.59     8.14     -51.93      -0.42     1.17     16
  34       H     0.11     1.92     7.11     -51.93      -0.37     1.55     16
 Total:         -1.00   -41.07   304.42                 -2.73   -43.80