REMARK  Name = BDB062604
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  CA  LIG    1       -0.653  -1.864  -1.295  0.00  0.00    +0.195 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -1.514  -1.145  -0.343  0.00  0.00    -0.297 N 
ATOM      3  H   LIG    1       -2.406  -0.820  -0.704  0.00  0.00    +0.150 HD
ATOM      4  C   LIG    1       -1.220  -1.070   0.997  0.00  0.00    +0.245 C 
ATOM      5  O   LIG    1       -0.213  -1.573   1.482  0.00  0.00    -0.270 OA
BRANCH   4   6
ATOM      6  C   LIG    1       -2.192  -0.344   1.861  0.00  0.00    +0.037 A 
ATOM      7  C   LIG    1       -3.050   0.645   1.359  0.00  0.00    +0.013 A 
ATOM      8  C   LIG    1       -3.937   1.301   2.217  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -3.966   0.981   3.574  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1       -3.106   0.009   4.081  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1       -2.218  -0.649   3.228  0.00  0.00    +0.013 A 
ENDBRANCH   4   6
ENDBRANCH   1   2
BRANCH   1  13
ATOM     12  C   LIG    1        1.608  -1.887  -2.506  0.00  0.00    +0.021 C 
ATOM     13  C   LIG    1        0.643  -1.092  -1.626  0.00  0.00    +0.075 C 
BRANCH  13  14
ATOM     14  S   LIG    1        0.341   0.538  -2.442  0.00  0.00    -0.151 S 
BRANCH  14  15
ATOM     15  C   LIG    1        0.543   1.659  -1.019  0.00  0.00    +0.104 C 
BRANCH  15  16
ATOM     16  C   LIG    1        1.968   1.776  -0.543  0.00  0.00    -0.038 A 
ATOM     17  C   LIG    1        2.349   1.251   0.701  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        3.668   1.361   1.144  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        4.620   2.001   0.353  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        4.255   2.530  -0.883  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        2.937   2.420  -1.329  0.00  0.00    +0.004 A 
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH   1  13
BRANCH   1  22
ATOM     22  C   LIG    1       -1.518  -2.185  -2.514  0.00  0.00    +0.326 C 
ATOM     23  O   LIG    1       -2.583  -1.651  -2.796  0.00  0.00    -0.249 OA
BRANCH  22  24
ATOM     24  OXT LIG    1       -1.040  -3.188  -3.275  0.00  0.00    -0.479 OA
ATOM     25  HXT LIG    1       -1.697  -3.277  -3.998  0.00  0.00    +0.295 HD
ENDBRANCH  22  24
ENDBRANCH   1  22
TORSDOF 8