@<TRIPOS>MOLECULE
REAL300019630679
  37   39    0    0    0
SMALL
NO_CHARGES
@<TRIPOS>ATOM
   1 C1            -5.8319     3.0672     3.5065 C.3     
   2 N2            -6.1892     2.1134     2.4536 N.am    
   3 C3            -5.2340     1.6131     1.6451 C.2     
   4 O4            -5.5405     0.8986     0.7142 O.2     
   5 C5            -3.7851     1.9413     1.8978 C.3     
   6 C6            -3.2333     1.0786     3.0544 C.3     
   7 C7            -2.6217    -0.1187     2.2906 C.3     
   8 C8            -2.3179     0.4328     0.9150 C.2     
   9 O9            -1.5873    -0.0923     0.1018 O.2     
  10 N10           -2.9732     1.5912     0.7263 N.am    
  11 C11           -2.8923     2.3974    -0.4942 C.3     
  12 C12           -1.7666     3.3911    -0.3662 C.ar    
  13 C13           -0.4934     3.0504    -0.7833 C.ar    
  14 C14            0.5381     3.9635    -0.6714 C.ar    
  15 C15            0.2975     5.2165    -0.1371 C.ar    
  16 Br16           1.7082     6.4664     0.0158 Br      
  17 C17           -0.9756     5.5551     0.2850 C.ar    
  18 C18           -2.0065     4.6413     0.1727 C.ar    
  19 C19           -7.5231     1.7216     2.2871 C.2     
  20 N20           -7.9912     0.8769     1.3796 N.2     
  21 N21           -9.2644     0.7793     1.5581 N.pl3   
  22 N22           -9.6099     1.5393     2.5384 N.2     
  23 N23           -8.5614     2.1283     3.0031 N.2     
  24 H24           -5.7988     4.0736     3.0892 H       
  25 H25           -6.5773     3.0276     4.3009 H       
  26 H26           -4.8538     2.8101     3.9130 H       
  27 H27           -3.6739     3.0003     2.1308 H       
  28 H28           -2.4676     1.6177     3.6122 H       
  29 H29           -4.0366     0.7516     3.7146 H       
  30 H30           -1.7080    -0.4565     2.7796 H       
  31 H31           -3.3408    -0.9350     2.2220 H       
  32 H32           -3.8321     2.9298    -0.6409 H       
  33 H33           -2.7066     1.7460    -1.3482 H       
  34 H34           -0.3057     2.0722    -1.2008 H       
  35 H35            1.5318     3.6989    -1.0014 H       
  36 H36           -1.1640     6.5334     0.7019 H       
  37 H37           -3.0005     4.9056     0.5022 H       
@<TRIPOS>BOND
   1    1    2 1
   2    1   24 1
   3    1   25 1
   4    1   26 1
   5    2    3 am
   6    2   19 1
   7    3    4 2
   8    3    5 1
   9    5   10 1
  10    5    6 1
  11    5   27 1
  12    6    7 1
  13    6   28 1
  14    6   29 1
  15    7    8 1
  16    7   30 1
  17    7   31 1
  18    8    9 2
  19    8   10 am
  20   10   11 1
  21   11   12 1
  22   11   32 1
  23   11   33 1
  24   12   18 ar
  25   12   13 ar
  26   13   14 ar
  27   13   34 1
  28   14   15 ar
  29   14   35 1
  30   15   16 1
  31   15   17 ar
  32   17   18 ar
  33   17   36 1
  34   18   37 1
  35   19   23 1
  36   19   20 2
  37   20   21 1
  38   21   22 1
  39   22   23 2