REMARK  Name = BDB001675
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.327   0.184   0.141  0.00  0.00    -0.213 N 
ATOM      2  H   LIG    1       -0.377  -0.616  -0.493  0.00  0.00    +0.177 HD
ENDROOT
BRANCH   1  10
ATOM      3  C   LIG    1       -3.714  -1.191  -1.209  0.00  0.00    +0.126 C 
ATOM      4  C   LIG    1       -4.678  -0.273  -0.603  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1       -3.922   0.613   0.139  0.00  0.00    +0.031 A 
ATOM      6  C   LIG    1       -4.490   1.640   0.864  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -5.882   1.754   0.816  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -6.657   0.853   0.054  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -2.542   0.200  -0.050  0.00  0.00    +0.180 C 
ATOM     10  N   LIG    1       -1.512   0.773   0.482  0.00  0.00    -0.160 NA
ATOM     11  C   LIG    1       -6.053  -0.180  -0.672  0.00  0.00    +0.012 A 
ATOM     12  N   LIG    1       -2.486  -0.910  -0.884  0.00  0.00    -0.211 NA
BRANCH   3  13
ATOM     13  N   LIG    1       -4.066  -2.228  -2.014  0.00  0.00    -0.343 N 
ATOM     14  H   LIG    1       -4.955  -2.678  -1.833  0.00  0.00    +0.144 HD
ATOM     15  H   LIG    1       -3.310  -2.891  -2.161  0.00  0.00    +0.144 HD
ENDBRANCH   3  13
ENDBRANCH   1  10
BRANCH   1  16
ATOM     16  C   LIG    1        0.905   0.568   0.549  0.00  0.00    +0.178 A 
ATOM     17  S   LIG    1        1.178   1.901   1.611  0.00  0.00    -0.059 S 
ATOM     18  C   LIG    1        2.865   1.617   1.538  0.00  0.00    +0.077 A 
ATOM     19  C   LIG    1        3.129   0.532   0.728  0.00  0.00    +0.080 A 
ATOM     20  N   LIG    1        2.002  -0.050   0.164  0.00  0.00    -0.224 NA
BRANCH  19  21
ATOM     21  C   LIG    1        4.464   0.012   0.437  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        4.647  -0.825  -0.676  0.00  0.00    +0.011 A 
ATOM     23  C   LIG    1        5.908  -1.343  -0.987  0.00  0.00    +0.020 A 
ATOM     24  C   LIG    1        6.999  -1.031  -0.183  0.00  0.00    +0.041 A 
ATOM     25 CL   LIG    1        8.552  -1.667  -0.561  0.00  0.00    -0.084 Cl
ATOM     26  C   LIG    1        6.839  -0.209   0.929  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        5.576   0.310   1.240  0.00  0.00    +0.011 A 
ENDBRANCH  19  21
ENDBRANCH   1  16
TORSDOF 4