REMARK  Name = BDB018857
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.445  -0.243  -0.141  0.00  0.00    +0.227 A 
ATOM      2  O   LIG    1        0.654  -0.351  -1.481  0.00  0.00    -0.339 OA
ATOM      3  N   LIG    1        2.003  -0.286  -1.759  0.00  0.00    -0.076 NA
ATOM      4  C   LIG    1        2.629  -0.123  -0.584  0.00  0.00    +0.115 A 
ATOM      5  C   LIG    1        1.672  -0.099   0.468  0.00  0.00    +0.097 A 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1        4.088  -0.004  -0.498  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        4.718   0.384   0.695  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1        6.112   0.491   0.766  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        6.889   0.211  -0.355  0.00  0.00    +0.041 A 
ATOM     10 CL   LIG    1        8.601   0.341  -0.263  0.00  0.00    -0.084 Cl
ATOM     11  C   LIG    1        6.285  -0.173  -1.548  0.00  0.00    +0.020 A 
ATOM     12  C   LIG    1        4.892  -0.279  -1.618  0.00  0.00    +0.011 A 
ENDBRANCH   4   6
BRANCH   1  14
ATOM     13  C   LIG    1       -0.987  -0.240   1.857  0.00  0.00    +0.141 C 
ATOM     14  N   LIG    1       -0.849  -0.300   0.398  0.00  0.00    -0.242 N 
ATOM     15  C   LIG    1       -1.933  -0.410  -0.495  0.00  0.00    +0.243 C 
ATOM     16  O   LIG    1       -1.817  -0.442  -1.723  0.00  0.00    -0.273 OA
BRANCH  15  17
ATOM     17  C   LIG    1       -3.348  -0.490   0.111  0.00  0.00    +0.170 C 
ATOM     18  N   LIG    1       -3.938   0.839   0.524  0.00  0.00    -0.258 N 
ATOM     19  C   LIG    1       -5.332   0.916   0.000  0.00  0.00    +0.117 C 
ATOM     20  C   LIG    1       -5.691  -0.513  -0.362  0.00  0.00    +0.022 C 
ATOM     21  C   LIG    1       -4.376  -1.049  -0.888  0.00  0.00    +0.034 C 
BRANCH  18  22
ATOM     22  C   LIG    1       -3.233   1.929   0.853  0.00  0.00    +0.170 C 
ATOM     23  N   LIG    1       -2.608   2.849   1.171  0.00  0.00    -0.174 NA
ENDBRANCH  18  22
ENDBRANCH  15  17
ENDBRANCH   1  14
TORSDOF 4