@<TRIPOS>MOLECULE
REAL300019630838
  42   44    0    0    0
SMALL
NO_CHARGES
@<TRIPOS>ATOM
   1 C1             5.4767     8.7758    -1.7329 C.3     
   2 C2             6.4818     8.2993    -0.7160 C.ar    
   3 C3             7.6920     8.9509    -0.5826 C.ar    
   4 C4             8.6151     8.5140     0.3500 C.ar    
   5 C5             8.3296     7.4241     1.1514 C.ar    
   6 C6             7.1185     6.7714     1.0262 C.ar    
   7 C7             6.1921     7.2043     0.0874 C.ar    
   8 N8             4.9645     6.5413    -0.0453 N.pl3   
   9 N9             3.7041     7.1490    -0.0618 N.2     
  10 C10            2.7915     6.2267    -0.1996 C.2     
  11 C11            3.4422     4.9744    -0.2778 C.2     
  12 C12            2.7941     3.6602    -0.4365 C.2     
  13 O13            2.9444     2.8017     0.4116 O.2     
  14 N14            2.0349     3.4099    -1.5216 N.am    
  15 C15            1.7782     4.4725    -2.4969 C.3     
  16 C16            1.4918     2.1348    -1.7167 C.2     
  17 N17            0.7315     1.7463    -2.7302 N.2     
  18 N18            0.4375     0.5049    -2.5434 N.pl3   
  19 N19            0.9866     0.1038    -1.4500 N.2     
  20 N20            1.6387     1.0834    -0.9234 N.2     
  21 C21            4.7982     5.2121    -0.1716 C.2     
  22 C22            5.8907     4.1744    -0.1962 C.3     
  23 C23            5.8096     3.3185     1.0694 C.3     
  24 C24            5.7189     3.2821    -1.4271 C.3     
  25 H25            4.8654     9.5659    -1.2969 H       
  26 H26            6.0000     9.1621    -2.6075 H       
  27 H27            4.8379     7.9440    -2.0296 H       
  28 H28            7.9178     9.8028    -1.2069 H       
  29 H29            9.5608     9.0254     0.4528 H       
  30 H30            9.0522     7.0854     1.8790 H       
  31 H31            6.8942     5.9228     1.6556 H       
  32 H32            1.7252     6.3915    -0.2464 H       
  33 H33            0.9281     5.0701    -2.1678 H       
  34 H34            2.6590     5.1090    -2.5810 H       
  35 H35            1.5564     4.0289    -3.4676 H       
  36 H36            6.8609     4.6692    -0.2386 H       
  37 H37            4.9319     2.6744     1.0169 H       
  38 H38            6.7065     2.7044     1.1508 H       
  39 H39            5.7328     3.9668     1.9422 H       
  40 H40            5.8532     3.8784    -2.3297 H       
  41 H41            6.4619     2.4849    -1.4045 H       
  42 H42            4.7194     2.8474    -1.4242 H       
@<TRIPOS>BOND
   1    1    2 1
   2    1   25 1
   3    1   26 1
   4    1   27 1
   5    2    7 ar
   6    2    3 ar
   7    3    4 ar
   8    3   28 1
   9    4    5 ar
  10    4   29 1
  11    5    6 ar
  12    5   30 1
  13    6    7 ar
  14    6   31 1
  15    7    8 1
  16    8   21 1
  17    8    9 1
  18    9   10 2
  19   10   11 1
  20   10   32 1
  21   11   12 1
  22   11   21 2
  23   12   13 2
  24   12   14 am
  25   14   15 1
  26   14   16 1
  27   15   33 1
  28   15   34 1
  29   15   35 1
  30   16   20 1
  31   16   17 2
  32   17   18 1
  33   18   19 1
  34   19   20 2
  35   21   22 1
  36   22   23 1
  37   22   24 1
  38   22   36 1
  39   23   37 1
  40   23   38 1
  41   23   39 1
  42   24   40 1
  43   24   41 1
  44   24   42 1