REMARK  Name = BDB049179
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.193  -1.114  -0.104  0.00  0.00    -0.312 N 
ATOM      2  H   LIG    1       -0.418  -1.987   0.375  0.00  0.00    +0.152 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.172  -0.868  -0.151  0.00  0.00    +0.075 A 
ATOM      4  C   LIG    1        2.141  -1.593   0.425  0.00  0.00    +0.129 A 
ATOM      5 CL   LIG    1        1.749  -2.971   1.402  0.00  0.00    -0.076 Cl
ATOM      6  C   LIG    1        3.584  -1.245   0.292  0.00  0.00    +0.287 A 
ATOM      7  O   LIG    1        4.455  -1.929   0.828  0.00  0.00    -0.265 OA
ATOM      8  N   LIG    1        3.859  -0.105  -0.458  0.00  0.00    -0.231 N 
ATOM      9  C   LIG    1        5.235   0.303  -0.674  0.00  0.00    +0.176 C 
ATOM     10  N   LIG    1        2.911   0.594  -1.161  0.00  0.00    -0.175 NA
ATOM     11  C   LIG    1        1.681   0.225  -1.018  0.00  0.00    +0.157 A 
ENDBRANCH   1   3
BRANCH   1  15
ATOM     12  C   LIG    1       -5.030  -0.158  -0.223  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1       -3.624   0.312   0.007  0.00  0.00    -0.049 A 
ATOM     14  C   LIG    1       -2.546  -0.574  -0.140  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -1.224  -0.166   0.097  0.00  0.00    +0.032 A 
ATOM     16  C   LIG    1       -0.999   1.157   0.493  0.00  0.00    +0.023 A 
ATOM     17  C   LIG    1       -2.066   2.043   0.659  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1       -3.373   1.622   0.422  0.00  0.00    +0.003 A 
ENDBRANCH   1  15
TORSDOF 2