@<TRIPOS>MOLECULE
FDBF02783
 22 21 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         4.4820    3.7470   -0.0890 C.3     1  FRG1        0.0211
      2  C1         4.1950    3.6750    1.4230 C.3     1  FRG1       -0.0570
      3  O1         2.7650    2.9800   -1.5120 O.2     1  FRG1       -0.2758
      4  C2         3.7000    2.6750   -0.7880 C.2     1  FRG1        0.2128
      5  N3         4.1030    1.4100   -0.5650 N.am    1  FRG1       -0.3129
      6  O1         3.7430   -1.9300   -2.1050 O.3     1  FRG1       -0.3905
      7  C2         4.4150   -0.8000   -1.5410 C.3     1  FRG1        0.0679
      8  C1         3.4020    0.3140   -1.2090 C.3     1  FRG1        0.0373
      9  C1         5.1880   -1.2200   -0.2760 C.3     1  FRG1       -0.0375
     10 H           4.1902    4.7057   -0.4639 H       1  FRG1        0.0356
     11 H           5.5276    3.6035   -0.2649 H       1  FRG1        0.0356
     12 H           3.1487    3.8189    1.5947 H       1  FRG1        0.0234
     13 H           4.7477    4.4396    1.9278 H       1  FRG1        0.0234
     14 H           4.4893    2.7165    1.7966 H       1  FRG1        0.0234
     15 H           4.8666    1.2297    0.0297 H       1  FRG1        0.1488
     16 H           3.2599   -1.6552   -2.9000 H       1  FRG1        0.2098
     17 H           5.1128   -0.4204   -2.2578 H       1  FRG1        0.0606
     18 H           2.6507   -0.0684   -0.5501 H       1  FRG1        0.0487
     19 H           2.9359    0.6600   -2.1079 H       1  FRG1        0.0487
     20 H           4.5020   -1.6021    0.4508 H       1  FRG1        0.0255
     21 H           5.6993   -0.3712    0.1278 H       1  FRG1        0.0255
     22 H           5.8996   -1.9783   -0.5281 H       1  FRG1        0.0255
@<TRIPOS>BOND
     1     6     7    1
     2     7     8    1
     3     7     9    1
     4     3     4    2
     5     8     5    1
     6     4     5   am
     7     4     1    1
     8     1     2    1
     9     1    10    1
    10     1    11    1
    11     2    12    1
    12     2    13    1
    13     2    14    1
    14     5    15    1
    15     6    16    1
    16     7    17    1
    17     8    18    1
    18     8    19    1
    19     9    20    1
    20     9    21    1
    21     9    22    1