REMARK  Name = BDB004393
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.635   2.685  -0.116  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1        0.138   1.760  -1.043  0.00  0.00    +0.071 A 
ATOM      3  C   LIG    1       -0.069   0.442  -0.620  0.00  0.00    +0.051 A 
ATOM      4  N   LIG    1       -0.540  -0.649  -1.311  0.00  0.00    -0.353 N 
ATOM      5  H   LIG    1       -0.816  -0.632  -2.282  0.00  0.00    +0.166 HD
ATOM      6  C   LIG    1       -0.585  -1.764  -0.505  0.00  0.00    +0.069 A 
ATOM      7  C   LIG    1       -0.125  -1.373   0.752  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1       -0.071  -2.334   1.771  0.00  0.00    +0.030 A 
ATOM      9  C   LIG    1       -0.485  -3.613   1.438  0.00  0.00    +0.112 A 
ATOM     10  N   LIG    1       -0.930  -3.986   0.219  0.00  0.00    -0.258 NA
ATOM     11  C   LIG    1       -0.993  -3.073  -0.787  0.00  0.00    +0.062 A 
ATOM     12  C   LIG    1       -1.492  -3.532  -2.120  0.00  0.00    +0.068 C 
ATOM     13  C   LIG    1        0.200   0.018   0.678  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        0.701   0.961   1.599  0.00  0.00    +0.014 A 
ATOM     15  C   LIG    1        0.914   2.287   1.190  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1  17
ATOM     16  C   LIG    1        1.307   4.936   0.267  0.00  0.00    +0.277 C 
ATOM     17  O   LIG    1        0.804   3.947  -0.622  0.00  0.00    -0.495 OA
ENDBRANCH   1  17
TORSDOF 1