REMARK  Name = BDB055895
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.412   0.198  -0.689  0.00  0.00    +0.054 C 
ATOM      2  C   LIG    1       -1.337   0.727   0.282  0.00  0.00    +0.027 C 
ATOM      3  C   LIG    1       -0.145   1.323  -0.495  0.00  0.00    +0.028 C 
ATOM      4  C   LIG    1        0.558   0.240  -1.384  0.00  0.00    +0.027 C 
ATOM      5  C   LIG    1       -0.404  -0.896  -1.808  0.00  0.00    +0.010 C 
ATOM      6  C   LIG    1       -1.831  -0.392  -1.989  0.00  0.00    +0.019 C 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1        0.811   2.183   0.323  0.00  0.00    -0.044 A 
ATOM      8  C   LIG    1        1.582   3.157  -0.337  0.00  0.00    +0.005 A 
ATOM      9  C   LIG    1        2.486   3.955   0.368  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.629   3.788   1.742  0.00  0.00    +0.041 A 
ATOM     11 CL   LIG    1        3.744   4.768   2.612  0.00  0.00    -0.084 Cl
ATOM     12  C   LIG    1        1.876   2.831   2.415  0.00  0.00    +0.020 A 
ATOM     13  C   LIG    1        0.971   2.033   1.709  0.00  0.00    +0.005 A 
ENDBRANCH   3   7
BRANCH   4  14
ATOM     14  C   LIG    1        1.852  -0.352  -0.833  0.00  0.00    -0.044 A 
ATOM     15  C   LIG    1        3.058  -0.144  -1.524  0.00  0.00    +0.005 A 
ATOM     16  C   LIG    1        4.260  -0.665  -1.039  0.00  0.00    +0.020 A 
ATOM     17  C   LIG    1        4.268  -1.402   0.141  0.00  0.00    +0.041 A 
ATOM     18 CL   LIG    1        5.748  -2.043   0.741  0.00  0.00    -0.084 Cl
ATOM     19  C   LIG    1        3.084  -1.623   0.839  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        1.883  -1.102   0.353  0.00  0.00    +0.005 A 
ENDBRANCH   4  14
BRANCH   1  21
ATOM     21  N   LIG    1       -3.450  -0.599  -0.017  0.00  0.00    -0.311 NA
ATOM     22  H   LIG    1       -4.310  -0.494  -0.558  0.00  0.00    +0.122 HD
BRANCH  21  24
ATOM     23  C   LIG    1       -4.586  -2.688   0.456  0.00  0.00    +0.023 C 
ATOM     24  C   LIG    1       -3.220  -2.035   0.195  0.00  0.00    +0.048 C 
ATOM     25  C   LIG    1       -2.304  -2.336   1.380  0.00  0.00    +0.023 C 
ENDBRANCH  21  24
ENDBRANCH   1  21
TORSDOF 4