REMARK  Name = BDB024081
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.637   0.723  -0.109  0.00  0.00    +0.121 A 
ATOM      2  N   LIG    1       -0.977   0.025   0.839  0.00  0.00    -0.238 NA
ATOM      3  C   LIG    1        0.361  -0.176   0.699  0.00  0.00    +0.136 A 
ATOM      4  C   LIG    1        1.115   0.305  -0.361  0.00  0.00    +0.052 A 
ATOM      5  C   LIG    1        0.434   1.040  -1.325  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1       -0.941   1.251  -1.196  0.00  0.00    +0.045 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -6.781  -0.746   0.725  0.00  0.00    +0.105 C 
ATOM      8  N   LIG    1       -5.920   0.344   0.275  0.00  0.00    -0.302 NA
ATOM      9  C   LIG    1       -5.084   0.872   1.378  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1       -3.586   0.494   1.314  0.00  0.00    +0.122 C 
ATOM     11  N   LIG    1       -3.002   0.945   0.040  0.00  0.00    -0.313 N 
ATOM     12  C   LIG    1       -3.871   0.823  -1.143  0.00  0.00    +0.122 C 
ATOM     13  C   LIG    1       -5.088  -0.092  -0.867  0.00  0.00    +0.103 C 
ENDBRANCH   1  11
BRANCH   4  14
ATOM     14  N   LIG    1        2.503   0.119  -0.532  0.00  0.00    -0.280 N 
ATOM     15  H   LIG    1        2.903   0.538  -1.365  0.00  0.00    +0.155 HD
ATOM     16  C   LIG    1        3.347  -0.606   0.283  0.00  0.00    +0.250 C 
ATOM     17  O   LIG    1        3.018  -1.196   1.307  0.00  0.00    -0.270 OA
BRANCH  16  18
ATOM     18  C   LIG    1        4.793  -0.621  -0.090  0.00  0.00    +0.057 A 
ATOM     19  C   LIG    1        5.290  -0.596  -1.402  0.00  0.00    +0.053 A 
ATOM     20 CL   LIG    1        4.287  -0.576  -2.809  0.00  0.00    -0.083 Cl
ATOM     21  C   LIG    1        6.674  -0.616  -1.625  0.00  0.00    +0.022 A 
ATOM     22  C   LIG    1        7.567  -0.669  -0.552  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1        7.085  -0.709   0.757  0.00  0.00    +0.053 A 
ATOM     24  C   LIG    1        5.705  -0.687   0.983  0.00  0.00    +0.033 A 
BRANCH  23  25
ATOM     25  C   LIG    1        7.999  -0.769   1.860  0.00  0.00    +0.099 C 
ATOM     26  N   LIG    1        8.748  -0.812   2.744  0.00  0.00    -0.191 NA
ENDBRANCH  23  25
ENDBRANCH  16  18
ENDBRANCH   4  14
TORSDOF 4