REMARK  Name = BDB001698
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.386  -0.250   1.848  0.00  0.00    +0.233 C 
ATOM      2  O   LIG    1        0.082   0.358   2.804  0.00  0.00    -0.283 OA
ENDROOT
BRANCH   1   7
ATOM      3  C   LIG    1       -5.418   1.429  -0.493  0.00  0.00    +0.045 C 
ATOM      4  C   LIG    1       -4.133   0.932   0.113  0.00  0.00    -0.030 A 
ATOM      5  C   LIG    1       -3.465  -0.194  -0.401  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1       -2.221  -0.556   0.140  0.00  0.00    +0.034 A 
ATOM      7  C   LIG    1       -1.692   0.120   1.245  0.00  0.00    +0.027 A 
ATOM      8  C   LIG    1       -2.396   1.195   1.794  0.00  0.00    +0.012 A 
ATOM      9  C   LIG    1       -3.603   1.603   1.226  0.00  0.00    +0.006 A 
BRANCH   5  10
ATOM     10  N   LIG    1       -3.898  -0.831  -1.574  0.00  0.00    -0.358 N 
ATOM     11  H   LIG    1       -4.899  -0.778  -1.729  0.00  0.00    +0.142 HD
ATOM     12  H   LIG    1       -3.554  -1.782  -1.677  0.00  0.00    +0.142 HD
ENDBRANCH   5  10
ENDBRANCH   1   7
BRANCH   1  13
ATOM     13  C   LIG    1        0.419  -1.385   1.259  0.00  0.00    +0.233 C 
ATOM     14  O   LIG    1       -0.036  -2.521   1.335  0.00  0.00    -0.283 OA
BRANCH  13  15
ATOM     15  C   LIG    1        1.712  -1.102   0.584  0.00  0.00    +0.027 A 
ATOM     16  C   LIG    1        2.228   0.195   0.474  0.00  0.00    +0.034 A 
ATOM     17  C   LIG    1        3.458   0.432  -0.157  0.00  0.00    +0.028 A 
ATOM     18  C   LIG    1        4.126  -0.638  -0.780  0.00  0.00    -0.030 A 
ATOM     19  C   LIG    1        5.395  -0.427  -1.560  0.00  0.00    +0.045 C 
ATOM     20  C   LIG    1        3.609  -1.938  -0.662  0.00  0.00    +0.006 A 
ATOM     21  C   LIG    1        2.416  -2.170   0.022  0.00  0.00    +0.012 A 
BRANCH  17  22
ATOM     22  N   LIG    1        3.877   1.760  -0.335  0.00  0.00    -0.358 N 
ATOM     23  H   LIG    1        3.540   2.397   0.381  0.00  0.00    +0.142 HD
ATOM     24  H   LIG    1        4.875   1.863  -0.487  0.00  0.00    +0.142 HD
ENDBRANCH  17  22
ENDBRANCH  13  15
ENDBRANCH   1  13
TORSDOF 5