REMARK  Name = BDB064177
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.839   0.254  -0.177  0.00  0.00    -0.020 C 
ATOM      2  C   LIG    1       -1.293  -0.709  -1.304  0.00  0.00    +0.011 C 
ATOM      3  C   LIG    1       -2.822  -0.886  -1.286  0.00  0.00    -0.010 C 
ATOM      4  C   LIG    1       -3.495   0.477  -1.509  0.00  0.00    +0.007 C 
ATOM      5  C   LIG    1       -3.083   1.452  -0.395  0.00  0.00    -0.010 C 
ATOM      6  C   LIG    1       -3.517   0.884   0.964  0.00  0.00    +0.007 C 
ATOM      7  C   LIG    1       -2.845  -0.477   1.202  0.00  0.00    -0.010 C 
ATOM      8  C   LIG    1       -3.252  -1.447   0.080  0.00  0.00    +0.007 C 
ATOM      9  C   LIG    1       -1.555   1.618  -0.409  0.00  0.00    +0.011 C 
ATOM     10  C   LIG    1       -1.316  -0.299   1.190  0.00  0.00    +0.011 C 
ENDROOT
BRANCH   1  11
ATOM     11  C   LIG    1        0.687   0.507  -0.203  0.00  0.00    +0.103 C 
BRANCH  11  13
ATOM     12  O   LIG    1        1.199  -1.840   0.159  0.00  0.00    -0.276 OA
ATOM     13  C   LIG    1        1.608  -0.688   0.031  0.00  0.00    +0.216 C 
ATOM     14  N   LIG    1        2.956  -0.396   0.086  0.00  0.00    -0.301 N 
ATOM     15  C   LIG    1        3.942  -1.435   0.326  0.00  0.00    +0.108 C 
ATOM     16  C   LIG    1        5.225  -0.676   0.634  0.00  0.00    +0.020 C 
ATOM     17  C   LIG    1        5.071   0.598  -0.187  0.00  0.00    +0.020 C 
ATOM     18  C   LIG    1        3.585   0.907  -0.060  0.00  0.00    +0.108 C 
ENDBRANCH  11  13
ENDBRANCH   1  11
TORSDOF 2