REMARK  Name = BDB018926
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.193   0.823   0.112  0.00  0.00    -0.006 A 
ATOM      2  C   LIG    1        2.266   0.315  -0.809  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1        0.889   0.417  -0.511  0.00  0.00    +0.033 A 
ATOM      4  C   LIG    1        0.406   1.018   0.667  0.00  0.00    +0.038 A 
ATOM      5  N   LIG    1       -0.991   1.102   0.911  0.00  0.00    -0.300 N 
ATOM      6  C   LIG    1       -1.385   1.592   2.249  0.00  0.00    +0.111 C 
ATOM      7  C   LIG    1       -0.519   2.764   2.682  0.00  0.00    +0.024 C 
ATOM      8  C   LIG    1        0.923   2.302   2.791  0.00  0.00    +0.038 C 
ATOM      9  C   LIG    1        1.350   1.588   1.537  0.00  0.00    -0.025 A 
ATOM     10  C   LIG    1        2.725   1.466   1.268  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -1.963   0.182   0.423  0.00  0.00    +0.037 A 
ATOM     12  C   LIG    1       -3.153   0.671  -0.132  0.00  0.00    +0.051 A 
ATOM     13  C   LIG    1       -4.080  -0.245  -0.591  0.00  0.00    +0.073 A 
ATOM     14  N   LIG    1       -5.327  -0.013  -1.184  0.00  0.00    -0.295 N 
ATOM     15  C   LIG    1       -5.928  -1.247  -1.494  0.00  0.00    +0.330 A 
ATOM     16  N   LIG    1       -5.019  -2.243  -1.074  0.00  0.00    -0.294 N 
ATOM     17  C   LIG    1       -5.253  -3.651  -1.212  0.00  0.00    +0.154 C 
ATOM     18  O   LIG    1       -7.016  -1.419  -2.020  0.00  0.00    -0.246 OA
ATOM     19  C   LIG    1       -5.897   1.278  -1.444  0.00  0.00    +0.154 C 
ATOM     20  C   LIG    1       -3.877  -1.629  -0.517  0.00  0.00    +0.088 A 
ATOM     21  C   LIG    1       -2.710  -2.130   0.033  0.00  0.00    +0.068 A 
ATOM     22 CL   LIG    1       -2.360  -3.807   0.177  0.00  0.00    -0.081 Cl
ATOM     23  C   LIG    1       -1.756  -1.216   0.503  0.00  0.00    +0.045 A 
ENDBRANCH   5  11
BRANCH   1  28
ATOM     24  C   LIG    1        7.765  -0.974  -0.532  0.00  0.00    +0.172 C 
ATOM     25  N   LIG    1        6.643  -0.091  -0.331  0.00  0.00    -0.274 N 
ATOM     26  N   LIG    1        6.853   1.235  -0.226  0.00  0.00    -0.179 NA
ATOM     27  C   LIG    1        5.622   1.733  -0.076  0.00  0.00    +0.142 A 
ATOM     28  C   LIG    1        4.627   0.730  -0.073  0.00  0.00    +0.020 A 
ATOM     29  C   LIG    1        5.330  -0.446  -0.212  0.00  0.00    +0.116 A 
ENDBRANCH   1  28
BRANCH   2  30
ATOM     30  C   LIG    1        2.670  -0.346  -2.103  0.00  0.00    +0.372 C 
ATOM     31  F   LIG    1        3.100  -1.628  -1.930  0.00  0.00    -0.204 F 
ATOM     32  F   LIG    1        3.660   0.304  -2.776  0.00  0.00    -0.204 F 
ENDBRANCH   2  30
TORSDOF 3