REMARK  Name = BDB002892
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.712   0.357   0.189  0.00  0.00    +0.135 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.786   0.064   0.218  0.00  0.00    +0.022 A 
ATOM      3  C   LIG    1        1.347  -0.669   1.270  0.00  0.00    +0.148 A 
ATOM      4  C   LIG    1        2.702  -0.992   1.347  0.00  0.00    +0.114 A 
ATOM      5  C   LIG    1        3.564  -0.564   0.320  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1        4.925  -0.918   0.450  0.00  0.00    +0.013 A 
ATOM      7  C   LIG    1        5.364  -1.652   1.546  0.00  0.00    +0.020 A 
ATOM      8  C   LIG    1        4.431  -2.019   2.494  0.00  0.00    +0.111 A 
ATOM      9  C   LIG    1        3.016   0.181  -0.753  0.00  0.00    +0.051 A 
ATOM     10 CL   LIG    1        3.997   0.746  -2.064  0.00  0.00    -0.083 Cl
ATOM     11  N   LIG    1        3.120  -1.706   2.416  0.00  0.00    -0.251 NA
ATOM     12  C   LIG    1        1.653   0.487  -0.799  0.00  0.00    +0.030 A 
BRANCH   3  13
ATOM     13  O   LIG    1        0.534  -1.093   2.299  0.00  0.00    -0.504 OA
ATOM     14  H   LIG    1        1.141  -1.590   2.892  0.00  0.00    +0.292 HD
ENDBRANCH   3  13
ENDBRANCH   1   2
BRANCH   1  18
ATOM     15  C   LIG    1       -1.627  -2.840  -3.631  0.00  0.00    +0.044 C 
ATOM     16  C   LIG    1       -1.956  -2.358  -2.249  0.00  0.00    -0.050 A 
ATOM     17  C   LIG    1       -1.236  -1.302  -1.676  0.00  0.00    +0.009 A 
ATOM     18  C   LIG    1       -1.533  -0.810  -0.385  0.00  0.00    -0.020 A 
ATOM     19  C   LIG    1       -2.616  -1.384   0.320  0.00  0.00    -0.045 A 
ATOM     20  C   LIG    1       -3.031  -0.909   1.687  0.00  0.00    +0.044 C 
ATOM     21  C   LIG    1       -3.341  -2.435  -0.267  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -3.017  -2.915  -1.536  0.00  0.00    +0.003 A 
ENDBRANCH   1  18
BRANCH   1  23
ATOM     23  N   LIG    1       -1.021   1.557  -0.615  0.00  0.00    -0.332 N 
ATOM     24  H   LIG    1       -1.889   1.434  -1.133  0.00  0.00    +0.147 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -0.956   2.834  -0.046  0.00  0.00    +0.046 A 
ATOM     26  C   LIG    1       -0.219   3.184   1.087  0.00  0.00    +0.133 A 
ATOM     27  N   LIG    1       -0.106   4.441   1.590  0.00  0.00    -0.261 NA
ATOM     28  C   LIG    1       -0.733   5.421   0.911  0.00  0.00    +0.111 A 
ATOM     29  C   LIG    1       -1.457   5.203  -0.246  0.00  0.00    +0.021 A 
ATOM     30  C   LIG    1       -1.554   3.899  -0.729  0.00  0.00    +0.026 A 
ENDBRANCH  23  25
ENDBRANCH   1  23
TORSDOF 5