REMARK  Name = BDB028552
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.307  -0.131  -0.288  0.00  0.00    +0.166 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1       -0.138  -1.270   0.571  0.00  0.00    -0.387 OA
ATOM      3  H   LIG    1        0.803  -1.240   0.841  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1       -1.525  -0.337  -1.192  0.00  0.00    +0.266 C 
BRANCH   4   5
ATOM      5  O   LIG    1       -2.717  -0.260  -0.394  0.00  0.00    -0.448 OA
BRANCH   5   7
ATOM      6  O   LIG    1       -3.925  -0.514  -2.315  0.00  0.00    -0.226 OA
ATOM      7  C   LIG    1       -3.871  -0.392  -1.097  0.00  0.00    +0.403 C 
ATOM      8  N   LIG    1       -4.971  -0.361  -0.282  0.00  0.00    -0.267 N 
ATOM      9  C   LIG    1       -6.320  -0.472  -0.793  0.00  0.00    +0.111 C 
ATOM     10  C   LIG    1       -7.198  -0.110   0.396  0.00  0.00    +0.021 C 
ATOM     11  C   LIG    1       -6.373  -0.588   1.586  0.00  0.00    +0.021 C 
ATOM     12  C   LIG    1       -4.945  -0.267   1.165  0.00  0.00    +0.111 C 
ENDBRANCH   5   7
ENDBRANCH   4   5
ENDBRANCH   1   4
BRANCH   1  13
ATOM     13  C   LIG    1        0.979   0.044  -1.124  0.00  0.00    +0.119 C 
BRANCH  13  14
ATOM     14  N   LIG    1        2.188   0.052  -0.268  0.00  0.00    -0.295 NA
ATOM     15  C   LIG    1        3.387  -0.184  -1.103  0.00  0.00    +0.120 C 
ATOM     16  C   LIG    1        4.693  -0.044  -0.351  0.00  0.00    -0.030 A 
ATOM     17  C   LIG    1        4.760   0.682   0.850  0.00  0.00    -0.042 A 
ATOM     18  C   LIG    1        5.987   0.824   1.512  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        7.147   0.269   0.971  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        7.088  -0.434  -0.230  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.503   1.250   1.455  0.00  0.00    +0.051 C 
ATOM     22  C   LIG    1        5.869  -0.589  -0.890  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1        2.348   1.332   0.447  0.00  0.00    +0.089 C 
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 6