REMARK  Name = BDB057230
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.363   0.203  -0.108  0.00  0.00    +0.121 A 
ATOM      2  C   LIG    1       -0.592   1.296  -0.505  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        0.805   1.225  -0.494  0.00  0.00    +0.013 A 
ATOM      4  C   LIG    1        1.461   0.057  -0.086  0.00  0.00    +0.002 A 
ATOM      5  C   LIG    1        0.680  -1.037   0.311  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1       -0.721  -0.966   0.300  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.918   0.017  -0.085  0.00  0.00    +0.089 A 
ATOM      8  N   LIG    1        3.700   1.103  -0.475  0.00  0.00    -0.232 NA
ATOM      9  C   LIG    1        4.928   0.683  -0.337  0.00  0.00    +0.110 A 
ATOM     10  C   LIG    1        6.284   1.229  -0.531  0.00  0.00    +0.076 C 
ATOM     11  C   LIG    1        7.146   0.192   0.235  0.00  0.00    +0.029 C 
ATOM     12  C   LIG    1        6.311  -1.102   0.286  0.00  0.00    +0.123 C 
ATOM     13  N   LIG    1        4.968  -0.599   0.109  0.00  0.00    -0.334 N 
ATOM     14  C   LIG    1        3.717  -1.058   0.287  0.00  0.00    +0.115 A 
ENDBRANCH   4   7
BRANCH   1  15
ATOM     15  O   LIG    1       -2.713   0.406  -0.166  0.00  0.00    -0.487 OA
BRANCH  15  16
ATOM     16  C   LIG    1       -3.552  -0.677   0.233  0.00  0.00    +0.264 C 
BRANCH  16  20
ATOM     17  C   LIG    1       -7.687   0.548   0.028  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1       -7.266  -0.598  -0.644  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -5.928  -0.993  -0.585  0.00  0.00    +0.007 A 
ATOM     20  C   LIG    1       -4.996  -0.241   0.144  0.00  0.00    -0.010 A 
ATOM     21  C   LIG    1       -5.433   0.908   0.819  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1       -6.771   1.302   0.759  0.00  0.00    +0.000 A 
ENDBRANCH  16  20
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 4