@<TRIPOS>MOLECULE
FDBD00021
 22 21 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1 O           1.6884   -1.5615    0.7827 O.co2   1   UNK        -0.5442
      2 O1          2.1485   -0.6169   -1.2261 O.co2   1   UNK        -0.5442
      3 N           1.2965    1.8348   -0.4347 N.4     1   UNK         0.2249
      4 N1         -3.6082   -0.4932   -0.7057 N.4     1   UNK         0.2185
      5 C          -0.3416    0.5599    0.9520 C.3     1   UNK         0.0005
      6 C1         -1.2979    0.1323   -0.1704 C.3     1   UNK        -0.0072
      7 C2          1.1222    0.7429    0.5227 C.3     1   UNK         0.0162
      8 C3         -2.7133   -0.0799    0.3687 C.3     1   UNK        -0.0352
      9 C4          1.7055   -0.5185   -0.0891 C.2     1   UNK         0.0894
     10 H           0.9109    2.6944   -0.0439 H       1   UNK         0.2001
     11 H1          0.8101    1.6075   -1.3019 H       1   UNK         0.2001
     12 H2          2.2901    1.9640   -0.6259 H       1   UNK         0.2001
     13 H3         -4.5472   -0.6308   -0.3320 H       1   UNK         0.1994
     14 H4         -3.2721   -1.3668   -1.1110 H       1   UNK         0.1994
     15 H5         -3.6312    0.2289   -1.4257 H       1   UNK         0.1994
     16 H6         -0.3723   -0.1876    1.7170 H       1   UNK         0.0326
     17 H7         -0.6787    1.5201    1.2827 H       1   UNK         0.0326
     18 H8         -0.9463   -0.7821   -0.6006 H       1   UNK         0.0319
     19 H9         -1.3261    0.9065   -0.9085 H       1   UNK         0.0319
     20 H10         1.6442    0.9790    1.4264 H       1   UNK         0.0914
     21 H11        -2.6935   -0.8386    1.1229 H       1   UNK         0.0813
     22 H12        -3.0691    0.8402    0.7830 H       1   UNK         0.0813
@<TRIPOS>BOND
     1     1     9   ar
     2     2     9   ar
     3     3     7    1
     4     4     8    1
     5     5     6    1
     6     5     7    1
     7     6     8    1
     8     7     9    1
     9     3    10    1
    10     3    11    1
    11     3    12    1
    12     4    13    1
    13     4    14    1
    14     4    15    1
    15     5    16    1
    16     5    17    1
    17     6    18    1
    18     6    19    1
    19     7    20    1
    20     8    21    1
    21     8    22    1