@<TRIPOS>MOLECULE
REAL300019996799
  38   41    0    0    0
SMALL
NO_CHARGES
@<TRIPOS>ATOM
   1 O1             4.5972    -0.1433     1.1729 O.2     
   2 C2             4.4641     1.0406     1.4125 C.2     
   3 N3             3.4414     1.7278     0.8663 N.am    
   4 C4             2.4902     1.0476    -0.0161 C.3     
   5 C5             3.0356     1.0252    -1.4208 C.2     
   6 N6             3.5925     2.0384    -2.0683 N.2     
   7 N7             3.9292     1.6149    -3.2387 N.2     
   8 N8             3.5953     0.3763    -3.3487 N.2     
   9 N9             3.0455    -0.0098    -2.2482 N.pl3   
  10 C10            1.1750     1.7832     0.0004 C.ar    
  11 C11           -0.0126     1.0758     0.0080 C.ar    
  12 C12           -1.2190     1.7507     0.0173 C.ar    
  13 C13           -1.2377     3.1328     0.0299 C.ar    
  14 C14           -0.0501     3.8402     0.0223 C.ar    
  15 C15            1.1563     3.1654     0.0076 C.ar    
  16 C16            5.4256     1.7282     2.3045 C.ar    
  17 C17            5.2755     3.0887     2.5745 C.ar    
  18 C18            6.1692     3.7272     3.4097 C.ar    
  19 C19            7.2232     3.0151     3.9715 C.ar    
  20 B20            8.3936     3.4252     4.9355 Du      
  21 O21            8.6306     4.7178     5.4735 O.3     
  22 O22            9.1704     2.2583     5.1676 O.3     
  23 C23            8.5957     1.1720     4.4434 C.3     
  24 C24            7.3796     1.6561     3.6997 C.ar    
  25 C25            6.4843     1.0159     2.8696 C.ar    
  26 H26            3.3351     2.6728     1.0575 H       
  27 H27            2.3392     0.0255     0.3313 H       
  28 H28            0.0021    -0.0041     0.0020 H       
  29 H29           -2.1469     1.1980     0.0188 H       
  30 H30           -2.1802     3.6600     0.0410 H       
  31 H31           -0.0647     4.9201     0.0276 H       
  32 H32            2.0841     3.7181     0.0014 H       
  33 H33            4.4586     3.6405     2.1334 H       
  34 H34            6.0529     4.7795     3.6231 H       
  35 H35            9.4058     4.7681     6.0493 H       
  36 H36            8.3072     0.3834     5.1385 H       
  37 H37            9.3249     0.7815     3.7336 H       
  38 H38            6.6023    -0.0363     2.6565 H       
@<TRIPOS>BOND
   1    1    2 2
   2    2    3 am
   3    2   16 1
   4    3    4 1
   5    3   26 1
   6    4    5 1
   7    4   10 1
   8    4   27 1
   9    5    9 1
  10    5    6 2
  11    6    7 1
  12    7    8 2
  13    8    9 1
  14   10   15 ar
  15   10   11 ar
  16   11   12 ar
  17   11   28 1
  18   12   13 ar
  19   12   29 1
  20   13   14 ar
  21   13   30 1
  22   14   15 ar
  23   14   31 1
  24   15   32 1
  25   16   25 ar
  26   16   17 ar
  27   17   18 ar
  28   17   33 1
  29   18   19 ar
  30   18   34 1
  31   19   24 ar
  32   19   20 1
  33   20   21 1
  34   20   22 1
  35   21   35 1
  36   22   23 1
  37   23   24 1
  38   23   36 1
  39   23   37 1
  40   24   25 ar
  41   25   38 1