@<TRIPOS>MOLECULE
REAL300011087074
  30   31    0    0    0
SMALL
NO_CHARGES
@<TRIPOS>ATOM
   1 O1             0.0021    -0.0041     0.0020 O.co2   
   2 C2            -0.0145     1.2197     0.0087 C.2     
   3 O3             1.0370     1.8460     0.0021 O.co2   
   4 C4            -1.2968     1.9370     0.0187 C.2     
   5 C5            -1.4676     3.2876     0.0214 C.2     
   6 O6            -2.7918     3.5188     0.0312 O.3     
   7 C7            -3.4264     2.3352     0.0345 C.2     
   8 N8            -4.7960     2.1611     0.0442 N.pl3   
   9 C9            -5.6826     3.3273     0.0524 C.3     
  10 C10           -7.1177     2.8673     0.0621 C.ar    
  11 C11           -7.7827     2.6528    -1.1304 C.ar    
  12 C12           -9.0993     2.2308    -1.1215 C.ar    
  13 C13           -9.7502     2.0230     0.0800 C.ar    
  14 C14           -9.0847     2.2367     1.2728 C.ar    
  15 S15           -9.9374     1.9652     2.8461 Du      
  16 F16          -10.6959     1.7237     4.2456 F       
  17 F17          -11.2266     2.7477     2.2824 F       
  18 F18           -8.6482     1.1827     3.4098 F       
  19 F19          -10.5330     0.5791     2.2841 F       
  20 F20           -9.3418     3.3514     3.4081 F       
  21 C21           -7.7673     2.6545     1.2639 C.ar    
  22 N22           -2.5402     1.3743     0.0211 N.2     
  23 H23           -0.6862     4.0332     0.0166 H       
  24 H24           -5.1713     1.2666     0.0455 H       
  25 H25           -5.4870     3.9262     0.9419 H       
  26 H26           -5.4999     3.9289    -0.8381 H       
  27 H27           -7.2740     2.8151    -2.0691 H       
  28 H28           -9.6191     2.0638    -2.0533 H       
  29 H29          -10.7789     1.6940     0.0869 H       
  30 H30           -7.2474     2.8215     2.1957 H       
@<TRIPOS>BOND
   1    1    2 ar
   2    2    3 ar
   3    2    4 1
   4    4   22 1
   5    4    5 2
   6    5    6 1
   7    5   23 1
   8    6    7 1
   9    7    8 1
  10    7   22 2
  11    8    9 1
  12    8   24 1
  13    9   10 1
  14    9   25 1
  15    9   26 1
  16   10   21 ar
  17   10   11 ar
  18   11   12 ar
  19   11   27 1
  20   12   13 ar
  21   12   28 1
  22   13   14 ar
  23   13   29 1
  24   14   15 1
  25   14   21 ar
  26   15   16 1
  27   15   17 1
  28   15   18 1
  29   15   19 1
  30   15   20 1
  31   21   30 1