REMARK  Name = BDB063000
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.558  -0.078  -0.138  0.00  0.00    +0.012 C 
ATOM      2  C   LIG    1        0.552  -1.159   0.205  0.00  0.00    +0.173 C 
ATOM      3  O   LIG    1        0.811  -2.343  -0.014  0.00  0.00    -0.291 OA
ATOM      4  C   LIG    1       -0.719  -0.723   0.932  0.00  0.00    +0.128 C 
ATOM      5  C   LIG    1       -1.158   0.599   0.350  0.00  0.00    +0.040 C 
ATOM      6  C   LIG    1       -2.465   0.534   0.042  0.00  0.00    +0.072 C 
ATOM      7  C   LIG    1       -2.952  -0.816   0.281  0.00  0.00    -0.034 C 
ATOM      8  C   LIG    1       -4.343  -1.256  -0.012  0.00  0.00    +0.045 C 
ATOM      9  N   LIG    1       -0.196   1.553   0.158  0.00  0.00    -0.319 N 
ATOM     10  H   LIG    1       -0.503   2.442  -0.238  0.00  0.00    +0.152 HD
ATOM     11  C   LIG    1       -1.945  -1.570   0.756  0.00  0.00    -0.005 C 
ATOM     12  C   LIG    1        1.125   1.207  -0.116  0.00  0.00    +0.011 C 
ATOM     13  C   LIG    1        2.028   2.378  -0.426  0.00  0.00    +0.061 C 
ENDROOT
BRANCH   1  15
ATOM     14  C   LIG    1        3.799  -0.854   0.680  0.00  0.00    +0.009 C 
ATOM     15  C   LIG    1        2.929  -0.560  -0.534  0.00  0.00    +0.037 C 
ENDBRANCH   1  15
BRANCH   6  16
ATOM     16  C   LIG    1       -3.222   1.573  -0.553  0.00  0.00    +0.101 C 
ATOM     17  N   LIG    1       -3.828   2.435  -1.039  0.00  0.00    -0.191 NA
ENDBRANCH   6  16
TORSDOF 2