REMARK  Name = BDB001668
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.612   2.002  -1.246  0.00  0.00    +0.276 C 
ATOM      2  N   LIG    1       -1.918   1.675  -0.839  0.00  0.00    -0.176 N 
ATOM      3  C   LIG    1       -2.420   0.736   0.063  0.00  0.00    +0.098 A 
ATOM      4  C   LIG    1       -3.798   0.939   0.005  0.00  0.00    +0.113 A 
ATOM      5  C   LIG    1       -4.661   0.165   0.795  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1       -4.115  -0.811   1.633  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -2.738  -1.013   1.680  0.00  0.00    +0.002 A 
ATOM      8  N   LIG    1       -4.090   1.930  -0.880  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1       -1.862  -0.248   0.898  0.00  0.00    +0.030 A 
ATOM     10  N   LIG    1       -2.953   2.367  -1.395  0.00  0.00    -0.057 NA
ATOM     11  O   LIG    1       -0.406   2.845  -2.113  0.00  0.00    -0.266 OA
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1        0.964   1.886   0.722  0.00  0.00    +0.049 C 
ATOM     13  C   LIG    1        0.501   1.294  -0.572  0.00  0.00    +0.016 C 
ATOM     14  C   LIG    1        0.998   0.231  -1.230  0.00  0.00    +0.016 C 
BRANCH  14  15
ATOM     15  C   LIG    1        2.119  -0.587  -0.763  0.00  0.00    -0.025 A 
ATOM     16  C   LIG    1        3.406  -0.051  -0.647  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1        4.464  -0.850  -0.208  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        4.241  -2.189   0.111  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        2.963  -2.732  -0.013  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1        1.905  -1.935  -0.453  0.00  0.00    +0.008 A 
ENDBRANCH  14  15
ENDBRANCH   1  13
TORSDOF 2