REMARK  Name = BDB003909
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.234   0.101  -2.882  0.00  0.00    +0.130 C 
ATOM      2  N   LIG    1        0.154   0.534  -1.480  0.00  0.00    -0.321 N 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1       -1.174   0.281  -0.826  0.00  0.00    +0.159 C 
ATOM      4  C   LIG    1       -1.351  -1.196  -0.372  0.00  0.00    +0.240 C 
ATOM      5  O   LIG    1       -1.060  -2.162  -1.080  0.00  0.00    -0.273 OA
ATOM      6  N   LIG    1       -1.892  -1.419   0.871  0.00  0.00    -0.255 N 
ATOM      7  H   LIG    1       -1.782  -2.388   1.147  0.00  0.00    +0.158 HD
ATOM      8  C   LIG    1       -3.164  -1.036   1.209  0.00  0.00    +0.219 C 
ATOM      9  O   LIG    1       -3.849  -1.767   1.922  0.00  0.00    -0.275 OA
ATOM     10  C   LIG    1       -3.734   0.214   0.583  0.00  0.00    +0.096 C 
ATOM     11  C   LIG    1       -2.861   1.450   0.732  0.00  0.00    +0.011 C 
ATOM     12  C   LIG    1       -1.398   1.290   0.314  0.00  0.00    +0.032 C 
ENDBRANCH   2   3
BRANCH   2  13
ATOM     13  C   LIG    1        1.292   0.226  -0.717  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        1.920  -1.029  -0.742  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1        3.056  -1.290   0.033  0.00  0.00    +0.034 A 
ATOM     16  C   LIG    1        3.584  -0.280   0.843  0.00  0.00    +0.126 A 
ATOM     17  C   LIG    1        2.985   0.982   0.878  0.00  0.00    +0.034 A 
ATOM     18  C   LIG    1        1.849   1.224   0.098  0.00  0.00    +0.025 A 
BRANCH  16  19
ATOM     19  N   LIG    1        4.776  -0.545   1.658  0.00  0.00    +0.056 N 
ATOM     20  O   LIG    1        5.285  -1.673   1.585  0.00  0.00    -0.126 OA
ATOM     21  O   LIG    1        5.200   0.373   2.374  0.00  0.00    -0.126 OA
ENDBRANCH  16  19
ENDBRANCH   2  13
TORSDOF 3