REMARK  Name = BDB023902
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.857   3.398  -0.991  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1        3.807   2.534  -0.200  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1        3.326   1.311   0.252  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1        1.884   0.981   0.243  0.00  0.00    +0.146 C 
ATOM      5  C   LIG    1        1.681  -0.482   0.397  0.00  0.00    +0.018 A 
ATOM      6  C   LIG    1        0.523  -1.289   0.295  0.00  0.00    +0.100 A 
ATOM      7  N   LIG    1        0.807  -2.586   0.484  0.00  0.00    -0.171 NA
ATOM      8  N   LIG    1        2.135  -2.611   0.705  0.00  0.00    -0.270 N 
ATOM      9  C   LIG    1        2.782  -3.880   0.937  0.00  0.00    +0.172 C 
ATOM     10  C   LIG    1        2.696  -1.373   0.676  0.00  0.00    +0.046 A 
ATOM     11  C   LIG    1        4.119  -1.002   0.861  0.00  0.00    +0.074 C 
ATOM     12  C   LIG    1        4.198   0.513   1.140  0.00  0.00    +0.114 C 
ATOM     13  O   LIG    1        4.958   2.918   0.009  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   6  14
ATOM     14  C   LIG    1       -0.832  -0.799   0.016  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1       -1.823  -1.497  -0.739  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1       -2.967  -0.685  -0.776  0.00  0.00    +0.050 A 
ATOM     17  C   LIG    1       -4.132  -1.084  -1.456  0.00  0.00    +0.026 A 
ATOM     18  C   LIG    1       -4.134  -2.321  -2.108  0.00  0.00    +0.002 A 
ATOM     19  C   LIG    1       -3.014  -3.141  -2.087  0.00  0.00    +0.001 A 
ATOM     20  N   LIG    1       -2.676   0.457  -0.052  0.00  0.00    -0.343 N 
ATOM     21  C   LIG    1       -1.859  -2.740  -1.409  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1       -1.388   0.393   0.426  0.00  0.00    +0.097 A 
BRANCH  20  23
ATOM     23  C   LIG    1       -3.590   1.576   0.189  0.00  0.00    +0.081 C 
ATOM     24  C   LIG    1       -3.915   1.726   1.675  0.00  0.00    +0.030 C 
ATOM     25  C   LIG    1       -3.052   2.880  -0.402  0.00  0.00    +0.030 C 
ENDBRANCH  20  23
ENDBRANCH   6  14
TORSDOF 2