REMARK  Name = BDB002663
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.919  -1.418  -0.260  0.00  0.00    -0.271 N 
ATOM      2  C   LIG    1       -1.621  -0.232  -0.102  0.00  0.00    +0.025 C 
ATOM      3  C   LIG    1       -3.113  -0.207  -0.087  0.00  0.00    +0.062 C 
ATOM      4  C   LIG    1       -0.756   0.789   0.054  0.00  0.00    +0.088 C 
ATOM      5  C   LIG    1        0.605   0.265   0.007  0.00  0.00    +0.056 C 
ATOM      6  C   LIG    1        1.733   0.983   0.119  0.00  0.00    +0.060 C 
ATOM      7  C   LIG    1        0.465  -1.223  -0.169  0.00  0.00    +0.252 C 
ATOM      8  O   LIG    1        1.329  -2.078  -0.178  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1        3.042   0.450  -0.012  0.00  0.00    +0.128 A 
ATOM     10  O   LIG    1        3.420  -0.432  -0.997  0.00  0.00    -0.464 OA
ATOM     11  C   LIG    1        4.736  -0.712  -0.842  0.00  0.00    +0.195 A 
ATOM     12  C   LIG    1        5.254  -0.001   0.209  0.00  0.00    +0.042 A 
ATOM     13  C   LIG    1        4.177   0.753   0.731  0.00  0.00    +0.049 A 
ENDBRANCH   6   9
BRANCH   1  15
ATOM     14  C   LIG    1       -1.659  -3.425   0.964  0.00  0.00    +0.025 C 
ATOM     15  C   LIG    1       -1.492  -2.744  -0.385  0.00  0.00    +0.110 C 
ENDBRANCH   1  15
BRANCH   4  16
ATOM     16  C   LIG    1       -1.102   2.207   0.241  0.00  0.00    +0.341 C 
ATOM     17  O   LIG    1       -0.577   2.933   1.072  0.00  0.00    -0.245 OA
BRANCH  16  18
ATOM     18  O   LIG    1       -2.031   2.585  -0.673  0.00  0.00    -0.464 OA
ATOM     19  C   LIG    1       -2.394   3.964  -0.594  0.00  0.00    +0.280 C 
ENDBRANCH  16  18
ENDBRANCH   4  16
TORSDOF 4