REMARK  Name = BDB013015
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.036  -0.352   0.203  0.00  0.00    +0.045 A 
ATOM      2  C   LIG    1        2.291   0.857   0.307  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1        0.922   0.751   0.301  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1        0.455   2.019   0.481  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        1.460   2.862   0.527  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        0.248  -0.466   0.166  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1        0.928  -1.577   0.081  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        2.623   2.128   0.419  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        2.308  -1.487   0.091  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        7.326  -0.546   0.123  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1        6.609  -1.413   0.944  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        5.213  -1.354   0.974  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1        4.516  -0.431   0.178  0.00  0.00    -0.013 A 
ATOM     14  C   LIG    1        5.254   0.444  -0.632  0.00  0.00    +0.008 A 
ATOM     15  C   LIG    1        6.650   0.385  -0.662  0.00  0.00    +0.001 A 
ENDBRANCH   1  13
BRANCH   6  16
ATOM     16  N   LIG    1       -1.129  -0.511   0.143  0.00  0.00    -0.310 N 
ATOM     17  H   LIG    1       -1.403  -1.484   0.282  0.00  0.00    +0.149 HD
BRANCH  16  18
ATOM     18  C   LIG    1       -1.831  -0.024  -1.041  0.00  0.00    +0.140 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.296  -0.344  -0.921  0.00  0.00    -0.024 A 
ATOM     20  C   LIG    1       -4.136   0.350  -0.055  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1       -3.832   1.435   0.909  0.00  0.00    +0.080 C 
ATOM     22  C   LIG    1       -5.257   1.865   1.258  0.00  0.00    +0.234 C 
ATOM     23  O   LIG    1       -6.162   0.774   0.978  0.00  0.00    -0.491 OA
ATOM     24  C   LIG    1       -5.476   0.010   0.069  0.00  0.00    +0.124 A 
ATOM     25  C   LIG    1       -6.042  -1.022  -0.649  0.00  0.00    +0.046 A 
ATOM     26  C   LIG    1       -5.223  -1.730  -1.528  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -3.864  -1.396  -1.662  0.00  0.00    +0.005 A 
ENDBRANCH  18  19
ENDBRANCH  16  18
ENDBRANCH   6  16
TORSDOF 4