REMARK  Name = BDB055093
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.186   1.928   1.153  0.00  0.00    +0.077 A 
ATOM      2  C   LIG    1        2.118   0.978   0.727  0.00  0.00    +0.108 A 
ATOM      3  C   LIG    1        3.490   1.155   0.792  0.00  0.00    +0.180 A 
ATOM      4  N   LIG    1        4.157   0.064   0.313  0.00  0.00    -0.207 NA
ATOM      5  C   LIG    1        3.218  -0.786  -0.059  0.00  0.00    +0.161 A 
ATOM      6  N   LIG    1        4.066   2.276   1.275  0.00  0.00    -0.233 NA
ATOM      7  C   LIG    1        3.178   3.214   1.680  0.00  0.00    +0.135 A 
ATOM      8  N   LIG    1        1.972  -0.266   0.175  0.00  0.00    -0.334 N 
ATOM      9  H   LIG    1        1.087  -0.705  -0.025  0.00  0.00    +0.168 HD
ATOM     10  C   LIG    1        1.785   3.104   1.644  0.00  0.00    +0.082 A 
ATOM     11 CL   LIG    1        0.862   4.452   2.209  0.00  0.00    -0.080 Cl
ENDROOT
BRANCH   1  15
ATOM     12  N   LIG    1       -3.083   2.129   1.421  0.00  0.00    -0.294 NA
ATOM     13  C   LIG    1       -2.334   1.038   2.062  0.00  0.00    +0.103 C 
ATOM     14  C   LIG    1       -0.857   1.399   2.334  0.00  0.00    +0.120 C 
ATOM     15  N   LIG    1       -0.166   1.630   1.050  0.00  0.00    -0.325 N 
ATOM     16  C   LIG    1       -0.930   2.421   0.052  0.00  0.00    +0.120 C 
ATOM     17  C   LIG    1       -2.229   3.034   0.630  0.00  0.00    +0.103 C 
BRANCH  12  18
ATOM     18  C   LIG    1       -4.323   1.714   0.753  0.00  0.00    +0.143 C 
BRANCH  18  23
ATOM     19  C   LIG    1       -3.929  -2.022  -2.724  0.00  0.00    +0.089 C 
ATOM     20  C   LIG    1       -3.984  -0.800  -1.905  0.00  0.00    +0.135 A 
ATOM     21  O   LIG    1       -3.745   0.371  -2.552  0.00  0.00    -0.360 OA
ATOM     22  N   LIG    1       -3.846   1.421  -1.658  0.00  0.00    -0.082 NA
ATOM     23  C   LIG    1       -4.124   0.867  -0.468  0.00  0.00    +0.098 A 
ATOM     24  C   LIG    1       -4.234  -0.541  -0.581  0.00  0.00    +0.072 A 
ENDBRANCH  18  23
ENDBRANCH  12  18
ENDBRANCH   1  15
BRANCH   5  25
ATOM     25  C   LIG    1        3.465  -2.203  -0.688  0.00  0.00    +0.128 A 
ATOM     26  N   LIG    1        4.690  -2.694  -0.906  0.00  0.00    -0.168 NA
ATOM     27  N   LIG    1        4.472  -3.903  -1.444  0.00  0.00    -0.274 N 
ATOM     28  C   LIG    1        5.598  -4.726  -1.814  0.00  0.00    +0.172 C 
ATOM     29  C   LIG    1        3.149  -4.207  -1.578  0.00  0.00    +0.108 A 
ATOM     30  C   LIG    1        2.463  -3.117  -1.094  0.00  0.00    +0.052 A 
ENDBRANCH   5  25
TORSDOF 4