REMARK  Name = BDB030293
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.246  -1.268   1.049  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1       -0.693  -0.437   0.014  0.00  0.00    +0.039 A 
ATOM      3  C   LIG    1       -1.942   0.180   0.118  0.00  0.00    +0.051 A 
ATOM      4  N   LIG    1       -2.381   1.016  -0.931  0.00  0.00    -0.322 N 
ATOM      5  H   LIG    1       -1.798   1.168  -1.742  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -3.592   1.682  -0.955  0.00  0.00    +0.257 A 
ATOM      7  C   LIG    1       -4.452   1.485   0.206  0.00  0.00    +0.054 A 
ATOM      8  C   LIG    1       -4.049   0.670   1.248  0.00  0.00    +0.034 A 
ATOM      9  S   LIG    1       -5.211   0.591   2.489  0.00  0.00    -0.096 S 
ATOM     10  C   LIG    1       -6.269   1.643   1.651  0.00  0.00    +0.046 A 
ATOM     11  C   LIG    1       -5.744   2.048   0.443  0.00  0.00    +0.021 A 
ATOM     12  O   LIG    1       -3.904   2.392  -1.907  0.00  0.00    -0.267 OA
ATOM     13  C   LIG    1       -2.762  -0.028   1.249  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1       -2.313  -0.870   2.270  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -1.063  -1.489   2.167  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  17
ATOM     16  O   LIG    1        1.258  -2.982   1.643  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1        1.074  -1.959   0.994  0.00  0.00    +0.244 C 
ATOM     18  N   LIG    1        2.046  -1.367   0.213  0.00  0.00    -0.311 N 
ATOM     19  H   LIG    1        1.927  -0.389  -0.020  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1        3.420  -1.845   0.254  0.00  0.00    +0.110 C 
BRANCH  20  21
ATOM     21  C   LIG    1        4.182  -1.549  -1.041  0.00  0.00    +0.073 C 
BRANCH  21  22
ATOM     22  C   LIG    1        4.219  -0.097  -1.387  0.00  0.00    +0.037 A 
ATOM     23  N   LIG    1        3.941   0.378  -2.646  0.00  0.00    -0.348 N 
ATOM     24  H   LIG    1        3.704  -0.173  -3.460  0.00  0.00    +0.166 HD
ATOM     25  C   LIG    1        4.044   1.738  -2.607  0.00  0.00    +0.196 A 
ATOM     26  N   LIG    1        4.378   2.160  -1.410  0.00  0.00    -0.244 NA
ATOM     27  C   LIG    1        4.514   1.030  -0.649  0.00  0.00    +0.133 A 
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   1  17
TORSDOF 4