REMARK  Name = BDB030234
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.657   0.736  -1.891  0.00  0.00    +0.266 C 
ATOM      2  N   LIG    1       -0.356   0.797  -1.414  0.00  0.00    -0.296 N 
ATOM      3  C   LIG    1        0.722   1.170  -2.316  0.00  0.00    +0.112 C 
ATOM      4  C   LIG    1        1.956   1.107  -1.479  0.00  0.00    +0.021 C 
ATOM      5  C   LIG    1        2.428  -0.197  -0.872  0.00  0.00    +0.047 C 
ATOM      6  C   LIG    1        1.565   0.766  -0.084  0.00  0.00    +0.021 C 
ATOM      7  C   LIG    1        0.076   0.610  -0.035  0.00  0.00    +0.112 C 
ATOM      8  O   LIG    1       -1.901   0.948  -3.081  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   5   9
ATOM      9  C   LIG    1        3.840  -0.370  -0.511  0.00  0.00    +0.065 C 
ATOM     10  C   LIG    1        4.245  -1.008   0.758  0.00  0.00    +0.104 C 
ATOM     11  C   LIG    1        5.704  -0.587   0.746  0.00  0.00    +0.138 C 
ATOM     12  C   LIG    1        6.621  -1.703   1.237  0.00  0.00    +0.058 C 
ATOM     13  C   LIG    1        5.948   0.699   1.539  0.00  0.00    +0.058 C 
ATOM     14  O   LIG    1        6.004  -0.331  -0.641  0.00  0.00    -0.387 OA
ATOM     15  N   LIG    1        4.792  -0.013  -1.304  0.00  0.00    -0.093 NA
ENDBRANCH   5   9
BRANCH   1  18
ATOM     16  N   LIG    1       -4.755   0.002  -0.158  0.00  0.00    -0.334 N 
ATOM     17  C   LIG    1       -4.083   0.307  -1.306  0.00  0.00    +0.120 A 
ATOM     18  C   LIG    1       -2.748   0.413  -0.953  0.00  0.00    +0.143 A 
ATOM     19  N   LIG    1       -2.621   0.171   0.407  0.00  0.00    -0.231 NA
ATOM     20  C   LIG    1       -3.835  -0.070   0.847  0.00  0.00    +0.200 A 
BRANCH  16  22
ATOM     21  C   LIG    1       -6.523  -1.629   0.407  0.00  0.00    +0.030 C 
ATOM     22  C   LIG    1       -6.193  -0.206  -0.042  0.00  0.00    +0.082 C 
ATOM     23  C   LIG    1       -6.841   0.832   0.874  0.00  0.00    +0.030 C 
ENDBRANCH  16  22
ENDBRANCH   1  18
TORSDOF 3