REMARK  Name = BDB063474
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.841   0.387  -0.795  0.00  0.00    +0.204 A 
ATOM      2  N   LIG    1        0.140  -0.045   0.070  0.00  0.00    -0.187 NA
ATOM      3  C   LIG    1        1.251   0.205  -0.592  0.00  0.00    +0.260 A 
ATOM      4  O   LIG    1        1.013   0.766  -1.817  0.00  0.00    -0.332 OA
ATOM      5  N   LIG    1       -0.368   0.885  -1.948  0.00  0.00    -0.056 NA
ENDROOT
BRANCH   1   8
ATOM      6  C   LIG    1       -4.046  -0.299   1.040  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1       -2.684  -0.229   0.754  0.00  0.00    +0.014 A 
ATOM      8  C   LIG    1       -2.253   0.301  -0.467  0.00  0.00    +0.041 A 
ATOM      9  C   LIG    1       -3.236   0.740  -1.348  0.00  0.00    +0.122 A 
ATOM     10  N   LIG    1       -4.570   0.685  -1.097  0.00  0.00    -0.263 NA
ATOM     11  C   LIG    1       -4.942   0.167   0.092  0.00  0.00    +0.111 A 
ENDBRANCH   1   8
BRANCH   3  12
ATOM     12  C   LIG    1        2.676  -0.102  -0.049  0.00  0.00    +0.057 A 
ATOM     13  C   LIG    1        2.950  -0.666   1.178  0.00  0.00    +0.095 A 
ATOM     14  N   LIG    1        4.312  -0.776   1.292  0.00  0.00    -0.366 N 
ATOM     15  H   LIG    1        4.804  -1.157   2.091  0.00  0.00    +0.165 HD
ATOM     16  C   LIG    1        4.905  -0.290   0.154  0.00  0.00    +0.083 A 
ATOM     17  C   LIG    1        3.909   0.137  -0.699  0.00  0.00    +0.032 A 
ENDBRANCH   3  12
TORSDOF 2