@<TRIPOS>MOLECULE
FDBF00456
 19 19 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1        -1.9930    0.4660   -0.9470 C.3     1  FRG1       -0.0276
      2  O1        -3.6450    0.4840    0.7830 O.3     1  FRG1       -0.4615
      3  C2        -3.1830   -0.2780   -0.3530 C.3     1  FRG1        0.1026
      4  C3        -4.2750   -0.4860   -1.3920 C.3     1  FRG1        0.0107
      5  C4        -5.4950   -1.0900   -0.7220 C.3     1  FRG1        0.0686
      6  C5        -5.9690   -0.1940    0.4050 C.3     1  FRG1        0.0710
      7  C6        -4.8820    0.3310    1.3110 C.2     1  FRG1        0.3098
      8  O7        -5.1380    0.7140    2.4510 O.2     1  FRG1       -0.2507
      9  O14       -5.1940   -2.3790   -0.1950 O.3     1  FRG1       -0.3911
     10 H          -1.6229   -0.0720   -1.7946 H       1  FRG1        0.0265
     11 H          -1.2203    0.5479   -0.2114 H       1  FRG1        0.0265
     12 H          -2.3003    1.4445   -1.2520 H       1  FRG1        0.0265
     13 H          -2.8966   -1.2585   -0.0343 H       1  FRG1        0.0732
     14 H          -4.5363    0.4549   -1.8294 H       1  FRG1        0.0326
     15 H          -3.9218   -1.1461   -2.1565 H       1  FRG1        0.0326
     16 H          -6.2655   -1.1826   -1.4587 H       1  FRG1        0.0600
     17 H          -6.6578   -0.7523    1.0040 H       1  FRG1        0.0403
     18 H          -6.4054    0.6640   -0.0622 H       1  FRG1        0.0403
     19 H          -4.4957   -2.3000    0.4736 H       1  FRG1        0.2098
@<TRIPOS>BOND
     1     4     5    1
     2     4     3    1
     3     1     3    1
     4     5     9    1
     5     5     6    1
     6     3     2    1
     7     6     7    1
     8     2     7    1
     9     7     8    2
    10     1    10    1
    11     1    11    1
    12     1    12    1
    13     3    13    1
    14     4    14    1
    15     4    15    1
    16     5    16    1
    17     6    17    1
    18     6    18    1
    19     9    19    1