REMARK  Name = BDB040511
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.268  -2.380   2.021  0.00  0.00    +0.139 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.087  -1.455   1.885  0.00  0.00    -0.028 A 
ATOM      3  C   LIG    1       -0.890  -1.687   0.914  0.00  0.00    +0.025 A 
ATOM      4  C   LIG    1       -1.984  -0.822   0.767  0.00  0.00    +0.047 A 
ATOM      5 CL   LIG    1       -3.092  -1.220  -0.504  0.00  0.00    -0.083 Cl
ATOM      6  C   LIG    1       -2.143   0.308   1.598  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -1.125   0.549   2.545  0.00  0.00    +0.047 A 
ATOM      8 CL   LIG    1       -1.127   1.936   3.584  0.00  0.00    -0.083 Cl
ATOM      9  C   LIG    1       -0.032  -0.318   2.686  0.00  0.00    +0.025 A 
BRANCH   6  10
ATOM     10  C   LIG    1       -3.345   1.245   1.491  0.00  0.00    +0.108 C 
ATOM     11  C   LIG    1       -4.690   0.524   1.556  0.00  0.00    +0.227 C 
ATOM     12  O   LIG    1       -4.899  -0.446   2.283  0.00  0.00    -0.275 OA
ATOM     13  N   LIG    1       -5.713   1.070   0.819  0.00  0.00    -0.256 N 
ATOM     14  H   LIG    1       -6.603   0.594   0.886  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1       -5.744   2.300   0.212  0.00  0.00    +0.219 C 
ATOM     16  O   LIG    1       -6.790   2.761  -0.234  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -4.455   3.084   0.213  0.00  0.00    +0.097 C 
ATOM     18  C   LIG    1       -3.248   2.161   0.266  0.00  0.00    +0.027 C 
ENDBRANCH   6  10
ENDBRANCH   1   2
BRANCH   1  20
ATOM     19  C   LIG    1        2.449  -2.470  -0.143  0.00  0.00    +0.225 C 
ATOM     20  N   LIG    1        2.335  -1.968   1.139  0.00  0.00    -0.310 N 
ATOM     21  H   LIG    1        2.815  -1.103   1.360  0.00  0.00    +0.149 HD
ATOM     22  O   LIG    1        1.738  -3.384  -0.556  0.00  0.00    -0.275 OA
BRANCH  19  24
ATOM     23  C   LIG    1        4.888  -1.936  -0.352  0.00  0.00    +0.027 C 
ATOM     24  C   LIG    1        3.508  -1.772  -1.024  0.00  0.00    +0.083 C 
ATOM     25  C   LIG    1        3.584  -2.459  -2.404  0.00  0.00    +0.027 C 
BRANCH  24  26
ATOM     26  C   LIG    1        3.116  -0.302  -1.210  0.00  0.00    +0.059 A 
ATOM     27  N   LIG    1        3.988   0.644  -0.797  0.00  0.00    -0.239 NA
ATOM     28  C   LIG    1        3.624   1.925  -0.957  0.00  0.00    +0.221 A 
ATOM     29  N   LIG    1        2.466   2.354  -1.474  0.00  0.00    -0.235 NA
ATOM     30  C   LIG    1        1.600   1.394  -1.878  0.00  0.00    +0.110 A 
ATOM     31  C   LIG    1        1.889   0.044  -1.757  0.00  0.00    +0.053 A 
BRANCH  30  32
ATOM     32  C   LIG    1        0.264   1.822  -2.441  0.00  0.00    +0.390 C 
ATOM     33  F   LIG    1       -0.746   1.693  -1.533  0.00  0.00    -0.202 F 
ATOM     34  F   LIG    1       -0.117   1.081  -3.521  0.00  0.00    -0.202 F 
ENDBRANCH  30  32
ENDBRANCH  24  26
ENDBRANCH  19  24
ENDBRANCH   1  20
TORSDOF 6