REMARK  Name = BDB034968
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.866  -2.156  -0.839  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -3.357  -0.775  -0.536  0.00  0.00    -0.020 A 
ATOM      3  C   LIG    1       -2.088  -0.598   0.016  0.00  0.00    +0.092 A 
ATOM      4  C   LIG    1       -1.690   0.735   0.254  0.00  0.00    +0.092 A 
ATOM      5  C   LIG    1       -0.428   0.925   0.799  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1        0.411  -0.152   1.101  0.00  0.00    -0.023 A 
ATOM      7  C   LIG    1       -0.080  -1.419   0.827  0.00  0.00    +0.115 A 
ATOM      8  N   LIG    1       -2.456   1.811  -0.014  0.00  0.00    -0.231 NA
ATOM      9  C   LIG    1       -3.669   1.604  -0.539  0.00  0.00    +0.117 A 
ATOM     10  N   LIG    1       -1.299  -1.659   0.299  0.00  0.00    -0.253 NA
ATOM     11  C   LIG    1       -4.154   0.340  -0.821  0.00  0.00    +0.048 A 
ENDROOT
BRANCH   9  12
ATOM     12  N   LIG    1       -4.424   2.736  -0.830  0.00  0.00    -0.343 N 
ATOM     13  H   LIG    1       -3.890   3.540  -0.509  0.00  0.00    +0.144 HD
ATOM     14  H   LIG    1       -5.341   2.697  -0.401  0.00  0.00    +0.144 HD
ENDBRANCH   9  12
BRANCH   6  15
ATOM     15  C   LIG    1        1.782   0.048   1.687  0.00  0.00    +0.073 C 
BRANCH  15  16
ATOM     16  C   LIG    1        2.906  -0.120   0.682  0.00  0.00    -0.026 A 
ATOM     17  C   LIG    1        3.366   0.940  -0.126  0.00  0.00    +0.055 A 
ATOM     18  C   LIG    1        4.391   0.719  -1.058  0.00  0.00    +0.019 A 
ATOM     19  C   LIG    1        4.963  -0.545  -1.195  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1        4.518  -1.596  -0.400  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.499  -1.388   0.530  0.00  0.00    +0.005 A 
BRANCH  17  22
ATOM     22  C   LIG    1        2.826   2.266  -0.014  0.00  0.00    +0.099 C 
ATOM     23  N   LIG    1        2.398   3.339   0.096  0.00  0.00    -0.191 NA
ENDBRANCH  17  22
ENDBRANCH  15  16
ENDBRANCH   6  15
TORSDOF 4