REMARK  Name = BDB003625
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.901   0.003   0.132  0.00  0.00    +0.093 A 
ATOM      2  N   LIG    1        1.153   0.708  -0.787  0.00  0.00    -0.209 NA
ATOM      3  C   LIG    1       -0.108   0.446  -0.517  0.00  0.00    +0.252 A 
ATOM      4  N   LIG    1       -0.195  -0.419   0.567  0.00  0.00    -0.203 N 
ATOM      5  N   LIG    1       -1.332  -0.892   1.143  0.00  0.00    -0.167 NA
ATOM      6  C   LIG    1       -2.407  -0.458   0.553  0.00  0.00    +0.083 A 
ATOM      7  C   LIG    1       -3.751  -0.820   1.134  0.00  0.00    +0.059 C 
ATOM      8  C   LIG    1       -4.900  -0.673   0.155  0.00  0.00    +0.007 C 
ATOM      9  C   LIG    1       -4.867   0.702  -0.492  0.00  0.00    +0.007 C 
ATOM     10  C   LIG    1       -3.634   0.842  -1.364  0.00  0.00    +0.057 C 
ATOM     11  C   LIG    1       -2.351   0.470  -0.665  0.00  0.00    +0.068 A 
ATOM     12  N   LIG    1       -1.224   0.891  -1.153  0.00  0.00    -0.214 NA
ATOM     13  C   LIG    1        1.076  -0.702   0.979  0.00  0.00    +0.144 A 
ENDROOT
BRANCH   1  18
ATOM     14 CL   LIG    1        7.883   0.217   0.143  0.00  0.00    -0.084 Cl
ATOM     15  C   LIG    1        6.165   0.150   0.147  0.00  0.00    +0.041 A 
ATOM     16  C   LIG    1        5.504  -0.629   1.094  0.00  0.00    +0.020 A 
ATOM     17  C   LIG    1        4.105  -0.685   1.100  0.00  0.00    +0.011 A 
ATOM     18  C   LIG    1        3.357   0.037   0.158  0.00  0.00    +0.002 A 
ATOM     19  C   LIG    1        4.043   0.815  -0.788  0.00  0.00    +0.011 A 
ATOM     20  C   LIG    1        5.440   0.873  -0.795  0.00  0.00    +0.020 A 
ENDBRANCH   1  18
TORSDOF 1