REMARK  Name = BDB055106
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.516   0.369  -0.836  0.00  0.00    +0.144 A 
ATOM      2  N   LIG    1       -2.202   0.345  -0.451  0.00  0.00    -0.335 N 
ATOM      3  H   LIG    1       -1.772  -0.319   0.175  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1       -1.554   1.383  -1.065  0.00  0.00    +0.108 A 
ATOM      5  C   LIG    1       -2.546   1.996  -1.814  0.00  0.00    +0.180 A 
ATOM      6  N   LIG    1       -2.325   3.080  -2.587  0.00  0.00    -0.233 NA
ATOM      7  C   LIG    1       -1.044   3.514  -2.562  0.00  0.00    +0.135 A 
ATOM      8  C   LIG    1        0.007   2.949  -1.833  0.00  0.00    +0.082 A 
ATOM      9 CL   LIG    1        1.560   3.694  -1.968  0.00  0.00    -0.080 Cl
ATOM     10  C   LIG    1       -0.225   1.816  -1.028  0.00  0.00    +0.077 A 
ATOM     11  N   LIG    1       -3.749   1.365  -1.665  0.00  0.00    -0.208 NA
ENDROOT
BRANCH   1  14
ATOM     12  C   LIG    1       -6.708   0.217  -1.611  0.00  0.00    +0.068 C 
ATOM     13  C   LIG    1       -5.958  -0.689  -0.706  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1       -4.588  -0.641  -0.359  0.00  0.00    +0.058 A 
ATOM     15  C   LIG    1       -4.391  -1.693   0.504  0.00  0.00    +0.119 A 
ATOM     16  N   LIG    1       -5.610  -2.297   0.627  0.00  0.00    -0.274 N 
ATOM     17  C   LIG    1       -5.930  -3.454   1.427  0.00  0.00    +0.172 C 
ATOM     18  N   LIG    1       -6.579  -1.710  -0.095  0.00  0.00    -0.176 NA
ENDBRANCH   1  14
BRANCH  10  19
ATOM     19  N   LIG    1        0.683   1.123  -0.234  0.00  0.00    -0.325 N 
ATOM     20  C   LIG    1        1.076   1.835   1.001  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1        2.029   0.936   1.819  0.00  0.00    +0.103 C 
ATOM     22  N   LIG    1        3.295   0.608   1.127  0.00  0.00    -0.294 NA
ATOM     23  C   LIG    1        3.183   0.778  -0.335  0.00  0.00    +0.103 C 
ATOM     24  C   LIG    1        1.798   0.458  -0.949  0.00  0.00    +0.120 C 
BRANCH  22  25
ATOM     25  C   LIG    1        3.786  -0.717   1.544  0.00  0.00    +0.141 C 
BRANCH  25  26
ATOM     26  C   LIG    1        5.250  -0.970   1.243  0.00  0.00    +0.073 A 
ATOM     27  N   LIG    1        6.186  -0.341   2.003  0.00  0.00    -0.256 NA
ATOM     28  C   LIG    1        7.476  -0.600   1.689  0.00  0.00    +0.131 A 
ATOM     29  C   LIG    1        7.832  -1.462   0.667  0.00  0.00    +0.130 A 
ATOM     30  N   LIG    1        6.915  -2.105  -0.090  0.00  0.00    -0.260 NA
ATOM     31  C   LIG    1        5.624  -1.839   0.221  0.00  0.00    +0.135 A 
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH  10  19
TORSDOF 4