@<TRIPOS>MOLECULE
FDBF00630
 13 12 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  O1        -4.0420    0.2060   -1.8270 O.2     1  FRG1       -0.2974
      2  C2        -3.2180    0.4840   -0.9570 C.2     1  FRG1        0.1576
      3  O1        -4.7470    1.9450    0.1930 O.3     1  FRG1       -0.4574
      4  C2        -5.0240    3.0060    1.0160 C.2     1  FRG1        0.3043
      5  O3        -4.1940    3.7240    1.5590 O.2     1  FRG1       -0.2512
      6  C4        -3.3800    1.6740   -0.0360 C.3     1  FRG1        0.1471
      7  C8        -6.5050    3.1740    1.1660 C.3     1  FRG1        0.0332
      8 H          -2.3854   -0.1165   -0.8512 H       1  FRG1        0.1062
      9 H          -2.9224    2.5307   -0.4851 H       1  FRG1        0.0775
     10 H          -2.9118    1.4511    0.9000 H       1  FRG1        0.0775
     11 H          -7.0089    2.4235    0.5935 H       1  FRG1        0.0342
     12 H          -6.7914    4.1431    0.8144 H       1  FRG1        0.0342
     13 H          -6.7725    3.0753    2.1973 H       1  FRG1        0.0342
@<TRIPOS>BOND
     1     1     2    2
     2     2     6    1
     3     6     3    1
     4     3     4    1
     5     4     7    1
     6     4     5    2
     7     2     8    1
     8     6     9    1
     9     6    10    1
    10     7    11    1
    11     7    12    1
    12     7    13    1