REMARK  Name = BDB019007
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.164   0.406   2.197  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1        0.831   0.245   1.184  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1        2.173   0.582   1.475  0.00  0.00    -0.014 A 
ATOM      4  C   LIG    1        3.164   0.437   0.492  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        2.821  -0.046  -0.764  0.00  0.00    +0.075 A 
ATOM      6  N   LIG    1        1.555  -0.390  -1.077  0.00  0.00    -0.254 NA
ATOM      7  C   LIG    1        2.515   1.058   2.749  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1        1.550   1.203   3.739  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        0.610  -0.243  -0.116  0.00  0.00    +0.120 A 
ATOM     10  C   LIG    1        0.224   0.881   3.465  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  15
ATOM     11  C   LIG    1       -4.741  -0.398   0.480  0.00  0.00    +0.066 A 
ATOM     12  C   LIG    1       -3.552  -0.229   1.210  0.00  0.00    +0.122 A 
ATOM     13  C   LIG    1       -3.585  -0.414   2.583  0.00  0.00    +0.156 A 
ATOM     14  O   LIG    1       -2.331  -0.195   3.068  0.00  0.00    -0.435 OA
ATOM     15  C   LIG    1       -1.582   0.114   1.958  0.00  0.00    +0.229 A 
ATOM     16  C   LIG    1       -4.713  -0.762   3.316  0.00  0.00    +0.048 A 
ATOM     17  C   LIG    1       -5.890  -0.928   2.581  0.00  0.00    +0.004 A 
ATOM     18  N   LIG    1       -2.267   0.109   0.829  0.00  0.00    -0.208 NA
ATOM     19  C   LIG    1       -5.907  -0.750   1.192  0.00  0.00    +0.015 A 
BRANCH  11  23
ATOM     20  C   LIG    1       -3.584   0.385  -3.042  0.00  0.00    +0.128 C 
ATOM     21  N   LIG    1       -3.630   0.104  -1.631  0.00  0.00    -0.314 N 
ATOM     22  H   LIG    1       -2.805   0.300  -1.068  0.00  0.00    +0.149 HD
ATOM     23  C   LIG    1       -4.805  -0.219  -0.991  0.00  0.00    +0.246 C 
ATOM     24  O   LIG    1       -5.875  -0.354  -1.575  0.00  0.00    -0.270 OA
ENDBRANCH  11  23
ENDBRANCH   1  15
BRANCH   5  25
ATOM     25  C   LIG    1        3.790  -0.222  -1.832  0.00  0.00    +0.038 A 
ATOM     26  C   LIG    1        5.140   0.065  -1.790  0.00  0.00    +0.118 A 
ATOM     27  N   LIG    1        5.640  -0.260  -3.020  0.00  0.00    -0.274 N 
ATOM     28  C   LIG    1        7.008  -0.138  -3.463  0.00  0.00    +0.172 C 
ATOM     29  N   LIG    1        4.714  -0.739  -3.866  0.00  0.00    -0.179 NA
ATOM     30  C   LIG    1        3.590  -0.715  -3.143  0.00  0.00    +0.144 A 
ENDBRANCH   5  25
TORSDOF 3