REMARK  Name = BDB062556
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.752  -0.089  -0.040  0.00  0.00    +0.202 A 
ATOM      2  N   LIG    1        1.496   1.042  -0.163  0.00  0.00    -0.042 N 
ATOM      3  O   LIG    1        1.247   2.268  -0.309  0.00  0.00    -0.144 OA
ATOM      4  N   LIG    1        2.880   0.553  -0.087  0.00  0.00    -0.204 N 
ATOM      5  C   LIG    1        2.832  -0.836   0.076  0.00  0.00    +0.158 A 
ATOM      6  C   LIG    1        4.076  -1.515   0.172  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1        5.225  -0.812   0.105  0.00  0.00    +0.005 A 
ATOM      8  C   LIG    1        5.232   0.636  -0.065  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        4.060   1.288  -0.157  0.00  0.00    +0.116 A 
ATOM     10  N   LIG    1        1.565  -1.254   0.108  0.00  0.00    -0.205 NA
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1       -3.524  -0.411  -0.056  0.00  0.00    +0.120 A 
ATOM     12  C   LIG    1       -2.925   0.836  -0.218  0.00  0.00    +0.046 A 
ATOM     13  C   LIG    1       -1.527   0.959  -0.215  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1       -0.703  -0.161  -0.050  0.00  0.00    +0.023 A 
ATOM     15  C   LIG    1       -1.319  -1.410   0.112  0.00  0.00    +0.015 A 
ATOM     16  C   LIG    1       -2.713  -1.532   0.109  0.00  0.00    +0.046 A 
BRANCH  11  18
ATOM     17  C   LIG    1       -5.734   0.449  -0.204  0.00  0.00    +0.277 C 
ATOM     18  O   LIG    1       -4.867  -0.666  -0.040  0.00  0.00    -0.495 OA
ENDBRANCH  11  18
ENDBRANCH   1  14
TORSDOF 2