@<TRIPOS>MOLECULE
FDBF00380
 21 21 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         3.9410   -0.2380    0.9150 C.3     1  FRG1       -0.0216
      2  N1         4.1960   -2.7260    0.8600 N.4     1  FRG1        0.2350
      3  C2         3.7330   -1.5320    0.1390 C.3     1  FRG1       -0.0238
      4  C3         4.5720   -1.5680   -1.1410 C.3     1  FRG1       -0.0051
      5  C4         4.9440   -3.0330   -1.3380 C.3     1  FRG1       -0.0074
      6  C5         4.3110   -3.7660   -0.1660 C.3     1  FRG1       -0.0317
      7  C13        3.2990   -3.1340    1.9350 C.3     1  FRG1       -0.0429
      8 H           3.5838    0.5871    0.3349 H       1  FRG1        0.0284
      9 H           4.9835   -0.1070    1.1172 H       1  FRG1        0.0284
     10 H           3.4018   -0.2851    1.8380 H       1  FRG1        0.0284
     11 H           5.0815   -2.5419    1.3316 H       1  FRG1        0.2033
     12 H           2.6772   -1.5464   -0.0342 H       1  FRG1        0.0848
     13 H           4.0016   -1.2111   -1.9730 H       1  FRG1        0.0321
     14 H           5.4376   -0.9433   -1.0679 H       1  FRG1        0.0321
     15 H           6.0070   -3.1550   -1.3270 H       1  FRG1        0.0319
     16 H           4.6000   -3.4100   -2.2784 H       1  FRG1        0.0319
     17 H           4.9370   -4.5668    0.1684 H       1  FRG1        0.0814
     18 H           3.3724   -4.2170   -0.4120 H       1  FRG1        0.0814
     19 H           2.3325   -3.3506    1.5302 H       1  FRG1        0.0778
     20 H           3.2168   -2.3428    2.6506 H       1  FRG1        0.0778
     21 H           3.6895   -4.0080    2.4130 H       1  FRG1        0.0778
@<TRIPOS>BOND
     1     5     4    1
     2     5     6    1
     3     4     3    1
     4     6     2    1
     5     3     2    1
     6     3     1    1
     7     2     7    1
     8     1     8    1
     9     1     9    1
    10     1    10    1
    11     2    11    1
    12     3    12    1
    13     4    13    1
    14     4    14    1
    15     5    15    1
    16     5    16    1
    17     6    17    1
    18     6    18    1
    19     7    19    1
    20     7    20    1
    21     7    21    1