@<TRIPOS>MOLECULE
FDBF00379
 16 17 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  O1        -0.1140   -0.6060    1.6320 O.2     1  FRG1       -0.4698
      2  C2        -0.0690   -0.2350    0.2170 C.ar    1  FRG1        0.0994
      3  C3         1.3870   -0.3360   -0.1350 C.ar    1  FRG1        0.0199
      4  C4         2.0970   -0.8280    0.9510 C.ar    1  FRG1        0.0211
      5  C5         1.1730   -1.0950    2.0760 C.ar    1  FRG1        0.0994
      6  C8         3.4660   -1.0240    0.8880 C.ar    1  FRG1       -0.0336
      7  C9         4.1250   -0.7110   -0.3020 C.ar    1  FRG1        0.0525
      8  C10        3.4110   -0.2160   -1.4030 C.ar    1  FRG1       -0.0437
      9  C11        2.0300   -0.0270   -1.3250 C.ar    1  FRG1       -0.0498
     10  N17        6.6870   -1.0530   -0.4820 N.1     1  FRG1       -0.1909
     11  C18        5.5390   -0.9000   -0.4010 C.1     1  FRG1        0.0992
     12 H          -0.8548    0.0334   -0.3958 H       1  FRG1        0.1035
     13 H           1.3983   -1.5351    2.9818 H       1  FRG1        0.1035
     14 H           3.9859   -1.3920    1.6999 H       1  FRG1        0.0637
     15 H           3.9103    0.0102   -2.2774 H       1  FRG1        0.0631
     16 H           1.4999    0.3341   -2.1335 H       1  FRG1        0.0625
@<TRIPOS>BOND
     1     1     2   ar
     2     1     5   ar
     3     2     3   ar
     4     3     4   ar
     5     3     9   ar
     6     4     5   ar
     7     4     6   ar
     8     6     7   ar
     9     7     8   ar
    10     7    11    1
    11     8     9   ar
    12    10    11    3
    13     2    12    1
    14     5    13    1
    15     6    14    1
    16     8    15    1
    17     9    16    1