REMARK  Name = BDB015417
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.126   0.711  -0.683  0.00  0.00    +0.253 C 
ATOM      2  N   LIG    1        1.572  -0.527  -1.012  0.00  0.00    -0.238 N 
ATOM      3  C   LIG    1        0.306  -0.834  -1.540  0.00  0.00    +0.188 C 
ATOM      4  N   LIG    1        0.193  -2.064  -1.967  0.00  0.00    -0.254 NA
ATOM      5  C   LIG    1        1.512  -2.693  -1.813  0.00  0.00    +0.164 C 
ATOM      6  C   LIG    1        2.292  -1.769  -0.910  0.00  0.00    +0.140 C 
ATOM      7  O   LIG    1        1.767   1.798  -1.125  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  12
ATOM      8  C   LIG    1        6.765   0.817   2.770  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1        5.569   0.761   1.865  0.00  0.00    -0.050 A 
ATOM     10  C   LIG    1        4.381   0.158   2.302  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1        3.254   0.133   1.478  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1        3.314   0.712   0.206  0.00  0.00    +0.037 A 
ATOM     13  C   LIG    1        4.480   1.351  -0.224  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1        5.605   1.372   0.604  0.00  0.00    +0.004 A 
ENDBRANCH   1  12
BRANCH   3  15
ATOM     15  N   LIG    1       -0.753   0.048  -1.598  0.00  0.00    -0.301 N 
ATOM     16  C   LIG    1       -0.997   1.022  -0.515  0.00  0.00    +0.123 C 
ATOM     17  C   LIG    1       -2.504   1.263  -0.246  0.00  0.00    +0.103 C 
ATOM     18  N   LIG    1       -3.283   0.012  -0.111  0.00  0.00    -0.296 NA
ATOM     19  C   LIG    1       -3.021  -0.888  -1.268  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1       -1.984  -0.368  -2.287  0.00  0.00    +0.123 C 
BRANCH  18  21
ATOM     21  C   LIG    1       -4.718   0.324  -0.024  0.00  0.00    +0.057 C 
ATOM     22  C   LIG    1       -5.049   0.934   1.366  0.00  0.00    +0.019 C 
ATOM     23  C   LIG    1       -6.293   0.019   1.380  0.00  0.00    +0.003 C 
ATOM     24  C   LIG    1       -5.503  -0.930   0.453  0.00  0.00    +0.019 C 
ENDBRANCH  18  21
ENDBRANCH   3  15
TORSDOF 3