REMARK  Name = BDB018267
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.902  -3.245  -0.012  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -4.042  -2.075   0.061  0.00  0.00    -0.318 N 
ATOM      3  C   LIG    1       -4.602  -0.819  -0.086  0.00  0.00    +0.253 A 
ATOM      4  O   LIG    1       -5.795  -0.591  -0.258  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1       -3.655   0.318  -0.000  0.00  0.00    +0.097 A 
ATOM      6  C   LIG    1       -2.322   0.158   0.169  0.00  0.00    +0.060 A 
ATOM      7  C   LIG    1       -1.794  -1.234   0.156  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1       -2.675  -2.257   0.134  0.00  0.00    +0.099 A 
ENDROOT
BRANCH   6   9
ATOM      9  N   LIG    1       -1.501   1.305   0.381  0.00  0.00    -0.322 N 
ATOM     10  C   LIG    1       -1.783   2.610  -0.018  0.00  0.00    +0.091 A 
ATOM     11  C   LIG    1       -0.753   3.451   0.340  0.00  0.00    +0.019 A 
ATOM     12  C   LIG    1        0.195   2.672   1.022  0.00  0.00    +0.019 A 
ATOM     13  C   LIG    1       -0.294   1.386   1.063  0.00  0.00    +0.091 A 
ENDBRANCH   6   9
BRANCH   7  14
ATOM     14  C   LIG    1       -0.398  -1.545   0.045  0.00  0.00    +0.023 A 
ATOM     15  C   LIG    1        0.474  -1.056  -0.901  0.00  0.00    +0.117 A 
ATOM     16  N   LIG    1        1.701  -1.573  -0.587  0.00  0.00    -0.267 N 
ATOM     17  N   LIG    1        1.659  -2.456   0.437  0.00  0.00    -0.179 NA
ATOM     18  C   LIG    1        0.382  -2.422   0.829  0.00  0.00    +0.143 A 
BRANCH  16  19
ATOM     19  C   LIG    1        2.965  -1.263  -1.240  0.00  0.00    +0.178 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.482   0.089  -0.814  0.00  0.00    -0.026 A 
ATOM     21  C   LIG    1        3.411   1.190  -1.680  0.00  0.00    +0.005 A 
ATOM     22  C   LIG    1        3.873   2.442  -1.272  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        4.408   2.608   0.004  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        4.482   1.523   0.875  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        4.021   0.270   0.469  0.00  0.00    +0.005 A 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   7  14
TORSDOF 4