REMARK  Name = BDB033451
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.301  -2.087   0.662  0.00  0.00    -0.212 N 
ATOM      2  H   LIG    1       -0.028  -3.045   0.806  0.00  0.00    +0.174 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -0.786  -1.165   0.534  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1       -0.725   0.096   1.130  0.00  0.00    +0.088 A 
ATOM      5  C   LIG    1       -1.724   1.050   0.978  0.00  0.00    +0.021 A 
ATOM      6  C   LIG    1       -1.268   2.160   1.723  0.00  0.00    +0.142 A 
ATOM      7  N   LIG    1       -0.089   1.939   2.311  0.00  0.00    -0.181 NA
ATOM      8  C   LIG    1       -2.852   0.745   0.196  0.00  0.00    +0.011 A 
ATOM      9  C   LIG    1       -2.931  -0.516  -0.409  0.00  0.00    +0.003 A 
ATOM     10  N   LIG    1        0.205   0.677   1.949  0.00  0.00    -0.275 N 
ATOM     11  H   LIG    1        1.062   0.261   2.296  0.00  0.00    +0.189 HD
ATOM     12  C   LIG    1       -1.912  -1.456  -0.244  0.00  0.00    +0.026 A 
ENDBRANCH   1   3
BRANCH   1  14
ATOM     13  O   LIG    1        0.542  -2.587  -1.837  0.00  0.00    -0.148 OA
ATOM     14  S   LIG    1        1.343  -2.166  -0.705  0.00  0.00    +0.096 S 
ATOM     15  O   LIG    1        2.483  -2.958  -0.286  0.00  0.00    -0.148 OA
BRANCH  14  16
ATOM     16  C   LIG    1        1.949  -0.528  -1.067  0.00  0.00    +0.236 A 
ATOM     17  S   LIG    1        3.229   0.076  -0.100  0.00  0.00    -0.055 S 
ATOM     18  C   LIG    1        3.137   1.567  -0.944  0.00  0.00    +0.068 A 
ATOM     19  C   LIG    1        2.139   1.505  -1.893  0.00  0.00    +0.120 A 
ATOM     20  N   LIG    1        1.453   0.308  -1.962  0.00  0.00    -0.229 NA
ENDBRANCH  14  16
ENDBRANCH   1  14
TORSDOF 3