@<TRIPOS>MOLECULE
REAL300019630816
  41   43    0    0    0
SMALL
NO_CHARGES
@<TRIPOS>ATOM
   1 C1             0.9669    10.1539     2.8477 C.3     
   2 N2            -0.1863     9.3242     2.4897 N.am    
   3 C3            -0.1227     7.9853     2.6301 C.2     
   4 O4            -1.0774     7.2985     2.3337 O.2     
   5 C5             1.1346     7.3416     3.1552 C.3     
   6 H6             2.0102     7.8313     2.7289 H       
   7 C7             1.1701     7.4443     4.6945 C.3     
   8 C8             1.7776     6.0808     5.1178 C.3     
   9 C9             1.1678     5.1270     4.0604 C.3     
  10 N10            1.1450     5.9119     2.8127 N.am    
  11 C11            1.1403     5.4031     1.5647 C.2     
  12 O12            1.1212     6.1481     0.6049 O.2     
  13 O13            1.1568     4.0694     1.3813 O.3     
  14 C14            1.1505     3.5924     0.0099 C.3     
  15 C15            1.1709     2.0855     0.0021 C.ar    
  16 C16           -0.0167     1.3781     0.0096 C.ar    
  17 C17            0.0021    -0.0041     0.0020 C.ar    
  18 C18            1.2084    -0.6789    -0.0132 C.ar    
  19 C19            2.3961     0.0285    -0.0212 C.ar    
  20 C20            2.3773     1.4107    -0.0145 C.ar    
  21 C21           -1.3545     9.9223     2.0018 C.2     
  22 N22           -2.4662     9.3014     1.6350 N.2     
  23 N23           -3.3059    10.2008     1.2496 N.pl3   
  24 N24           -2.7558    11.3603     1.3538 N.2     
  25 N25           -1.5592    11.2178     1.8126 N.2     
  26 H26            1.6109    10.2760     1.9768 H       
  27 H27            0.6210    11.1313     3.1837 H       
  28 H28            1.5269     9.6714     3.6488 H       
  29 H29            0.1651     7.5613     5.1001 H       
  30 H30            1.8122     8.2669     5.0092 H       
  31 H31            1.4577     5.8057     6.1228 H       
  32 H32            2.8651     6.0988     5.0469 H       
  33 H33            0.1559     4.8403     4.3468 H       
  34 H34            1.7941     4.2429     3.9411 H       
  35 H35            2.0306     3.9704    -0.5103 H       
  36 H36            0.2509     3.9462    -0.4937 H       
  37 H37           -0.9592     1.9054     0.0170 H       
  38 H38           -0.9258    -0.5567     0.0083 H       
  39 H39            1.2231    -1.7588    -0.0184 H       
  40 H40            3.3386    -0.4987    -0.0324 H       
  41 H41            3.3052     1.9634    -0.0201 H       
@<TRIPOS>BOND
   1    1    2 1
   2    1   26 1
   3    1   27 1
   4    1   28 1
   5    2    3 am
   6    2   21 1
   7    3    4 2
   8    3    5 1
   9    5    6 1
  10    5   10 1
  11    5    7 1
  12    7    8 1
  13    7   29 1
  14    7   30 1
  15    8    9 1
  16    8   31 1
  17    8   32 1
  18    9   10 1
  19    9   33 1
  20    9   34 1
  21   10   11 am
  22   11   12 2
  23   11   13 1
  24   13   14 1
  25   14   15 1
  26   14   35 1
  27   14   36 1
  28   15   20 ar
  29   15   16 ar
  30   16   17 ar
  31   16   37 1
  32   17   18 ar
  33   17   38 1
  34   18   19 ar
  35   18   39 1
  36   19   20 ar
  37   19   40 1
  38   20   41 1
  39   21   25 1
  40   21   22 2
  41   22   23 1
  42   23   24 1
  43   24   25 2