REMARK  Name = BDB006134
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.919  -1.916  -1.828  0.00  0.00    -0.263 N 
ATOM      2  C   LIG    1        1.915  -0.994  -0.780  0.00  0.00    +0.048 A 
ATOM      3  C   LIG    1        0.597  -0.959  -0.374  0.00  0.00    +0.031 A 
ATOM      4  C   LIG    1       -0.355  -0.342   0.594  0.00  0.00    +0.146 C 
ATOM      5  N   LIG    1       -1.576  -1.171   0.355  0.00  0.00    -0.254 N 
ATOM      6  C   LIG    1       -1.457  -2.033  -0.758  0.00  0.00    +0.272 C 
ATOM      7  O   LIG    1       -2.309  -2.741  -1.273  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -0.068  -1.914  -1.145  0.00  0.00    +0.153 A 
ATOM      9  N   LIG    1        0.710  -2.504  -2.042  0.00  0.00    -0.166 NA
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1       -2.811  -0.864   0.978  0.00  0.00    +0.042 A 
ATOM     11  C   LIG    1       -2.943  -0.788   2.380  0.00  0.00    -0.029 A 
ATOM     12  C   LIG    1       -1.866  -1.218   3.337  0.00  0.00    +0.045 C 
ATOM     13  C   LIG    1       -4.168  -0.366   2.930  0.00  0.00    +0.006 A 
ATOM     14  C   LIG    1       -5.260  -0.079   2.113  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -5.141  -0.222   0.736  0.00  0.00    +0.043 A 
ATOM     16 CL   LIG    1       -6.493   0.117  -0.274  0.00  0.00    -0.083 Cl
ATOM     17  C   LIG    1       -3.932  -0.618   0.169  0.00  0.00    +0.043 A 
ENDBRANCH   5  10
BRANCH   4  18
ATOM     18  C   LIG    1       -0.531   1.122   0.183  0.00  0.00    -0.019 A 
ATOM     19  C   LIG    1       -0.282   2.191   1.079  0.00  0.00    -0.044 A 
ATOM     20  C   LIG    1        0.167   1.992   2.501  0.00  0.00    +0.044 C 
ATOM     21  C   LIG    1       -0.504   3.519   0.660  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -0.949   3.802  -0.628  0.00  0.00    +0.041 A 
ATOM     23 CL   LIG    1       -1.200   5.433  -1.111  0.00  0.00    -0.084 Cl
ATOM     24  C   LIG    1       -1.193   2.770  -1.520  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1       -0.992   1.448  -1.117  0.00  0.00    +0.007 A 
ENDBRANCH   4  18
BRANCH   2  26
ATOM     26  C   LIG    1        3.146  -0.278  -0.296  0.00  0.00    +0.032 C 
ATOM     27  C   LIG    1        3.406  -0.568   1.182  0.00  0.00    +0.014 C 
ATOM     28  C   LIG    1        3.071   1.224  -0.559  0.00  0.00    +0.014 C 
ENDBRANCH   2  26
BRANCH   1  29
ATOM     29  C   LIG    1        3.047  -2.343  -2.656  0.00  0.00    +0.170 C 
BRANCH  29  31
ATOM     30  C   LIG    1        3.358  -1.611  -5.043  0.00  0.00    +0.006 C 
ATOM     31  C   LIG    1        3.381  -1.345  -3.730  0.00  0.00    -0.012 C 
ENDBRANCH  29  31
ENDBRANCH   1  29
TORSDOF 5