REMARK  Name = BDB051354
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.949   0.737  -0.095  0.00  0.00    -0.031 A 
ATOM      2  C   LIG    1       -0.307  -0.316  -0.769  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1        1.058  -0.531  -0.594  0.00  0.00    +0.066 A 
ATOM      4  N   LIG    1        1.683  -1.592  -1.269  0.00  0.00    -0.318 N 
ATOM      5  H   LIG    1        1.151  -2.203  -1.875  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1        3.031  -1.888  -1.160  0.00  0.00    +0.292 A 
ATOM      7  C   LIG    1        3.772  -1.007  -0.284  0.00  0.00    +0.204 A 
ATOM      8  N   LIG    1        3.166   0.034   0.380  0.00  0.00    -0.294 N 
ATOM      9  C   LIG    1        4.134   0.664   1.118  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1        5.293  -0.033   0.862  0.00  0.00    +0.131 A 
ATOM     11  N   LIG    1        5.063  -1.067  -0.007  0.00  0.00    -0.231 NA
ATOM     12  O   LIG    1        3.493  -2.839  -1.788  0.00  0.00    -0.264 OA
ATOM     13  C   LIG    1        1.793   0.311   0.252  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1        1.175   1.365   0.925  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1       -0.196   1.574   0.746  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   1  16
ATOM     16  C   LIG    1       -2.432   0.981  -0.295  0.00  0.00    +0.119 C 
BRANCH  16  18
ATOM     17  C   LIG    1       -4.624   0.009  -0.500  0.00  0.00    +0.104 C 
ATOM     18  N   LIG    1       -3.257  -0.209  -0.021  0.00  0.00    -0.304 NA
ATOM     19  C   LIG    1       -3.280  -0.527   1.410  0.00  0.00    +0.104 C 
ENDBRANCH  16  18
ENDBRANCH   1  16
TORSDOF 2