@<TRIPOS>MOLECULE
FDBD02217
 37 36 0 0 0
SMALL
USER_CHARGES

@<TRIPOS>ATOM
      1 C           0.6686    2.0573   -0.6840 C.3     1   UNK        -0.0521
      2 C1          0.6723    0.5890   -0.2541 C.3     1   UNK         0.0020
      3 N           0.9777   -0.2599   -1.4134 N.3     1   UNK        -0.2392
      4 P           2.1081   -1.4413   -1.0148 P.3     1   UNK         0.2938
      5 S           3.6822   -0.6261   -0.4398 S.2     1   UNK         0.0222
      6 O           1.5224   -2.3685    0.1639 O.3     1   UNK        -0.3143
      7 C2          0.8659   -1.8389    1.3174 C.3     1   UNK         0.0455
      8 O1          2.4153   -2.3486   -2.3089 O.2     1   UNK        -0.4391
      9 C3          3.3811   -3.2809   -2.1873 C.2     1   UNK         0.1047
     10 C4          3.4265   -4.0639   -1.0943 C.2     1   UNK        -0.0024
     11 C5          4.5296   -4.9264   -0.8867 C.2     1   UNK         0.0203
     12 O2          5.4890   -4.8774   -1.6333 O.co2   1   UNK        -0.8007
     13 O3          4.5171   -5.8028    0.1391 O.2     1   UNK        -0.5095
     14 C6          5.6636   -6.6425    0.2890 C.3     1   UNK         0.0924
     15 C7          6.6858   -5.9530    1.1950 C.3     1   UNK        -0.0281
     16 C8          5.2427   -7.9734    0.9154 C.3     1   UNK        -0.0281
     17 C9          4.4102   -3.4461   -3.2758 C.3     1   UNK        -0.0065
     18 H           0.4461    2.6756    0.1604 H       1   UNK         0.0242
     19 H1         -0.0738    2.2057   -1.4401 H       1   UNK         0.0242
     20 H2          1.6308    2.3175   -1.0730 H       1   UNK         0.0242
     21 H3         -0.2899    0.3288    0.1349 H       1   UNK         0.0426
     22 H4          1.4147    0.4406    0.5020 H       1   UNK         0.0426
     23 H5          1.3529    0.3214   -2.1629 H       1   UNK         0.1320
     24 H6          0.5654   -2.6423    1.9571 H       1   UNK         0.0529
     25 H7          0.0034   -1.2834    1.0133 H       1   UNK         0.0529
     26 H8          1.5373   -1.1945    1.8455 H       1   UNK         0.0529
     27 H9          2.6571   -4.0358   -0.4071 H       1   UNK         0.0671
     28 H10         6.1016   -6.8227   -0.6705 H       1   UNK         0.0726
     29 H11         6.2478   -5.7728    2.1545 H       1   UNK         0.0265
     30 H12         6.9802   -5.0223    0.7569 H       1   UNK         0.0265
     31 H13         7.5443   -6.5817    1.3072 H       1   UNK         0.0265
     32 H14         4.8047   -7.7933    1.8749 H       1   UNK         0.0265
     33 H15         6.1012   -8.6021    1.0276 H       1   UNK         0.0265
     34 H16         4.5279   -8.4556    0.2818 H       1   UNK         0.0265
     35 H17         4.2167   -2.7434   -4.0592 H       1   UNK         0.0308
     36 H18         4.3583   -4.4404   -3.6677 H       1   UNK         0.0308
     37 H19         5.3862   -3.2718   -2.8733 H       1   UNK         0.0308
@<TRIPOS>BOND
     1     1     2    1
     2     2     3    1
     3     3     4    1
     4     4     5    2
     5     4     6    1
     6     4     8    1
     7     6     7    1
     8     8     9    2
     9     9    10    0
    10     9    17    1
    11    10    11    2
    12    11    12    0
    13    11    13    1
    14    13    14    1
    15    14    15    1
    16    14    16    1
    17     1    18    1
    18     1    19    1
    19     1    20    1
    20     2    21    1
    21     2    22    1
    22     3    23    1
    23     7    24    1
    24     7    25    1
    25     7    26    1
    26    10    27    1
    27    14    28    1
    28    15    29    1
    29    15    30    1
    30    15    31    1
    31    16    32    1
    32    16    33    1
    33    16    34    1
    34    17    35    1
    35    17    36    1
    36    17    37    1