@<TRIPOS>MOLECULE
FDBF00049
 17 17 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1        -2.8050    1.9680   -0.5230 C.3     1  FRG1       -0.0024
      2  N1        -2.0260    1.9780    0.6860 N.pl3   1  FRG1       -0.3469
      3  C1        -0.6430    1.8550    0.7170 C.ar    1  FRG1        0.0269
      4  C2         0.0710    1.7120   -0.4720 C.ar    1  FRG1       -0.0409
      5  C3         1.4600    1.5900   -0.4410 C.ar    1  FRG1       -0.0600
      6  C4         2.1350    1.6100    0.7790 C.ar    1  FRG1       -0.0616
      7  C5         1.4210    1.7530    1.9690 C.ar    1  FRG1       -0.0600
      8  C6         0.0320    1.8760    1.9380 C.ar    1  FRG1       -0.0409
      9 H          -3.8413    2.0779   -0.2805 H       1  FRG1        0.0425
     10 H          -2.6551    1.0412   -1.0362 H       1  FRG1        0.0425
     11 H          -2.4981    2.7775   -1.1518 H       1  FRG1        0.0425
     12 H          -2.5013    2.0780    1.5423 H       1  FRG1        0.1457
     13 H          -0.4283    1.6964   -1.3750 H       1  FRG1        0.0636
     14 H           1.9884    1.4849   -1.3212 H       1  FRG1        0.0618
     15 H           3.1627    1.5190    0.8016 H       1  FRG1        0.0618
     16 H           1.9204    1.7678    2.8720 H       1  FRG1        0.0618
     17 H          -0.4964    1.9825    2.8180 H       1  FRG1        0.0636
@<TRIPOS>BOND
     1     1     2    1
     2     4     5   ar
     3     4     3   ar
     4     5     6   ar
     5     2     3    1
     6     3     8   ar
     7     6     7   ar
     8     8     7   ar
     9     1     9    1
    10     1    10    1
    11     1    11    1
    12     2    12    1
    13     4    13    1
    14     5    14    1
    15     6    15    1
    16     7    16    1
    17     8    17    1