REMARK  Name = BDB034271
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.983  -0.446   1.749  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        3.082   0.272   1.100  0.00  0.00    -0.343 N 
ATOM      3  H   LIG    1        2.736   0.959   0.437  0.00  0.00    +0.146 HD
BRANCH   2   4
ATOM      4  C   LIG    1        4.251  -0.364   0.650  0.00  0.00    +0.038 A 
ATOM      5  C   LIG    1        5.193   0.344  -0.154  0.00  0.00    +0.021 A 
ATOM      6  C   LIG    1        6.367  -0.338  -0.561  0.00  0.00    +0.074 A 
ATOM      7  C   LIG    1        7.294   0.309  -1.364  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1        7.105   1.626  -1.770  0.00  0.00    +0.043 A 
ATOM      9  C   LIG    1        5.978   2.326  -1.370  0.00  0.00    +0.021 A 
ATOM     10 CL   LIG    1        8.280   2.394  -2.765  0.00  0.00    -0.083 Cl
ATOM     11  N   LIG    1        6.643  -1.597  -0.197  0.00  0.00    -0.255 NA
ATOM     12  C   LIG    1        5.771  -2.219   0.616  0.00  0.00    +0.113 A 
ATOM     13  C   LIG    1        5.031   1.692  -0.566  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1        4.595  -1.651   1.067  0.00  0.00    +0.043 A 
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1        1.162  -1.239   0.730  0.00  0.00    +0.034 C 
BRANCH  15  16
ATOM     16  C   LIG    1        0.041  -2.052   1.381  0.00  0.00    +0.082 C 
BRANCH  16  17
ATOM     17  N   LIG    1       -0.918  -1.274   2.165  0.00  0.00    -0.316 NA
ATOM     18  H   LIG    1       -1.554  -1.916   2.641  0.00  0.00    +0.122 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.714  -0.309   1.402  0.00  0.00    +0.081 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.688  -0.955   0.412  0.00  0.00    +0.015 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -3.573   0.100  -0.258  0.00  0.00    +0.002 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.546  -0.542  -1.252  0.00  0.00    +0.011 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -5.440   0.487  -1.944  0.00  0.00    +0.120 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -6.506   1.056  -1.034  0.00  0.00    +0.307 C 
ATOM     25  O   LIG    1       -6.805   0.621   0.069  0.00  0.00    -0.251 OA
BRANCH  24  27
ATOM     26  C   LIG    1       -8.138   2.727  -0.872  0.00  0.00    +0.280 C 
ATOM     27  O   LIG    1       -7.101   2.120  -1.644  0.00  0.00    -0.468 OA
ENDBRANCH  24  27
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 12