REMARK  Name = BDB018675
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.765   0.510   0.487  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -0.018   0.666  -0.669  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1       -1.411   0.707  -0.583  0.00  0.00    +0.037 A 
ATOM      4  N   LIG    1       -2.170   0.881  -1.744  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1       -1.712   1.141  -2.610  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1       -3.540   0.831  -1.782  0.00  0.00    +0.225 C 
ATOM      7  C   LIG    1       -4.224   0.237  -0.559  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1       -5.726   0.533  -0.559  0.00  0.00    +0.132 C 
ATOM      9  N   LIG    1       -6.331  -0.579   0.232  0.00  0.00    -0.268 N 
ATOM     10  C   LIG    1       -5.390  -1.729   0.232  0.00  0.00    +0.117 C 
ATOM     11  C   LIG    1       -3.551   0.758   0.721  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1       -4.222  -1.296  -0.647  0.00  0.00    +0.037 C 
ATOM     13  O   LIG    1       -4.143   1.166  -2.800  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -2.054   0.611   0.653  0.00  0.00    -0.025 A 
ATOM     15  C   LIG    1       -1.287   0.469   1.811  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1        0.107   0.411   1.725  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  20
ATOM     17  C   LIG    1        5.065   0.353   0.231  0.00  0.00    +0.033 A 
ATOM     18  C   LIG    1        4.277  -0.515  -0.523  0.00  0.00    +0.024 A 
ATOM     19  C   LIG    1        2.878  -0.462  -0.437  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1        2.233   0.456   0.404  0.00  0.00    -0.018 A 
ATOM     21  C   LIG    1        3.036   1.323   1.159  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1        4.433   1.272   1.074  0.00  0.00    +0.024 A 
BRANCH  17  25
ATOM     23  C   LIG    1        8.767  -0.125  -0.320  0.00  0.00    +0.109 C 
ATOM     24  C   LIG    1        7.309  -0.433  -0.559  0.00  0.00    +0.214 C 
ATOM     25  N   LIG    1        6.475   0.366   0.203  0.00  0.00    -0.286 N 
ATOM     26  H   LIG    1        6.922   1.047   0.803  0.00  0.00    +0.155 HD
ATOM     27  O   LIG    1        6.975  -1.289  -1.370  0.00  0.00    -0.276 OA
ENDBRANCH  17  25
ENDBRANCH   1  20
BRANCH   9  28
ATOM     28  C   LIG    1       -7.636  -0.677   0.513  0.00  0.00    +0.169 C 
ATOM     29  N   LIG    1       -8.764  -0.764   0.759  0.00  0.00    -0.174 NA
ENDBRANCH   9  28
TORSDOF 3