REMARK  Name = BDB003177
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.027  -0.621   0.055  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1       -0.936   0.778  -0.058  0.00  0.00    +0.164 A 
ATOM      3  C   LIG    1        0.324   1.388  -0.132  0.00  0.00    +0.077 A 
ATOM      4  C   LIG    1        1.498   0.648  -0.098  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1        1.398  -0.744   0.014  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1        2.606  -1.429   0.043  0.00  0.00    +0.124 A 
ATOM      7  N   LIG    1        3.809  -0.834  -0.030  0.00  0.00    -0.225 NA
ATOM      8  C   LIG    1        3.768   0.499  -0.134  0.00  0.00    +0.223 A 
ATOM      9 CL   LIG    1        5.272   1.300  -0.229  0.00  0.00    -0.041 Cl
ATOM     10  N   LIG    1        2.677   1.277  -0.173  0.00  0.00    -0.217 NA
ATOM     11  C   LIG    1        0.144  -1.380   0.090  0.00  0.00    +0.061 A 
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1       -2.429  -2.551   0.237  0.00  0.00    +0.277 C 
ATOM     13  O   LIG    1       -2.293  -1.142   0.123  0.00  0.00    -0.491 OA
ENDBRANCH   1  13
BRANCH   2  14
ATOM     14  O   LIG    1       -2.128   1.458  -0.086  0.00  0.00    -0.491 OA
ATOM     15  C   LIG    1       -2.081   2.874  -0.199  0.00  0.00    +0.277 C 
ENDBRANCH   2  14
TORSDOF 2