REMARK  Name = BDB025575
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.534  -0.747  -0.091  0.00  0.00    +0.164 C 
ATOM      2  N   LIG    1        0.827  -0.119  -1.213  0.00  0.00    -0.286 N 
ATOM      3  C   LIG    1       -0.455   0.399  -1.274  0.00  0.00    +0.241 C 
ATOM      4  O   LIG    1       -0.875   0.846  -2.345  0.00  0.00    -0.273 OA
ATOM      5  C   LIG    1        1.667  -0.090  -2.401  0.00  0.00    +0.140 C 
ATOM      6  C   LIG    1        3.037  -0.587  -1.942  0.00  0.00    +0.134 C 
ATOM      7  C   LIG    1        2.689  -1.489  -0.761  0.00  0.00    +0.065 C 
ENDROOT
BRANCH   1  11
ATOM      8  C   LIG    1        3.255   0.554   3.059  0.00  0.00    +0.128 C 
ATOM      9  N   LIG    1        2.637  -0.277   2.054  0.00  0.00    -0.317 N 
ATOM     10  H   LIG    1        2.851  -1.267   2.068  0.00  0.00    +0.148 HD
ATOM     11  C   LIG    1        2.072   0.282   0.925  0.00  0.00    +0.233 C 
ATOM     12  O   LIG    1        1.979   1.495   0.759  0.00  0.00    -0.274 OA
ENDBRANCH   1  11
BRANCH   6  13
ATOM     13  O   LIG    1        3.721  -1.337  -2.930  0.00  0.00    -0.390 OA
ATOM     14  H   LIG    1        3.862  -0.753  -3.698  0.00  0.00    +0.210 HD
ENDBRANCH   6  13
BRANCH   3  15
ATOM     15  C   LIG    1       -1.333   0.381  -0.013  0.00  0.00    +0.200 C 
BRANCH  15  16
ATOM     16  N   LIG    1       -1.775   1.744   0.274  0.00  0.00    -0.239 N 
ATOM     17  N   LIG    1       -2.906   2.264  -0.237  0.00  0.00    -0.065 NA
ATOM     18  N   LIG    1       -3.054   3.487   0.253  0.00  0.00    -0.138 NA
ATOM     19  C   LIG    1       -2.001   3.739   1.079  0.00  0.00    +0.156 A 
ATOM     20  C   LIG    1       -1.180   2.639   1.122  0.00  0.00    +0.131 A 
ENDBRANCH  15  16
BRANCH  15  21
ATOM     21  C   LIG    1       -2.451  -0.732  -0.039  0.00  0.00    -0.007 C 
ATOM     22  C   LIG    1       -3.322  -0.646   1.235  0.00  0.00    +0.013 C 
ATOM     23  C   LIG    1       -3.373  -0.669  -1.273  0.00  0.00    +0.013 C 
ATOM     24  C   LIG    1       -1.794  -2.132  -0.037  0.00  0.00    +0.013 C 
ENDBRANCH  15  21
ENDBRANCH   3  15
TORSDOF 5