REMARK  Name = BDB040526
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.251  -1.237  -1.240  0.00  0.00    +0.139 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.170  -0.816  -0.988  0.00  0.00    -0.028 A 
ATOM      3  C   LIG    1       -1.948  -0.261  -2.005  0.00  0.00    +0.025 A 
ATOM      4  C   LIG    1       -3.261   0.163  -1.756  0.00  0.00    +0.047 A 
ATOM      5 CL   LIG    1       -4.123   0.792  -3.120  0.00  0.00    -0.083 Cl
ATOM      6  C   LIG    1       -3.839   0.063  -0.472  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -3.041  -0.512   0.542  0.00  0.00    +0.047 A 
ATOM      8 CL   LIG    1       -3.606  -0.756   2.162  0.00  0.00    -0.083 Cl
ATOM      9  C   LIG    1       -1.729  -0.936   0.286  0.00  0.00    +0.025 A 
BRANCH   6  10
ATOM     10  C   LIG    1       -5.263   0.553  -0.216  0.00  0.00    +0.108 C 
ATOM     11  C   LIG    1       -5.367   1.539   0.946  0.00  0.00    +0.227 C 
ATOM     12  O   LIG    1       -4.507   2.383   1.191  0.00  0.00    -0.275 OA
ATOM     13  N   LIG    1       -6.531   1.502   1.675  0.00  0.00    -0.256 N 
ATOM     14  H   LIG    1       -6.596   2.169   2.432  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1       -7.691   0.834   1.373  0.00  0.00    +0.219 C 
ATOM     16  O   LIG    1       -8.721   1.034   2.009  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -7.650  -0.076   0.170  0.00  0.00    +0.097 C 
ATOM     18  C   LIG    1       -6.248  -0.612  -0.070  0.00  0.00    +0.027 C 
ENDBRANCH   6  10
ENDBRANCH   1   2
BRANCH   1  20
ATOM     19  C   LIG    1        2.534  -0.493  -0.729  0.00  0.00    +0.226 C 
ATOM     20  N   LIG    1        1.172  -0.241  -0.746  0.00  0.00    -0.310 N 
ATOM     21  H   LIG    1        0.832   0.703  -0.625  0.00  0.00    +0.149 HD
ATOM     22  O   LIG    1        2.970  -1.586  -1.087  0.00  0.00    -0.275 OA
BRANCH  19  24
ATOM     23  C   LIG    1        2.958   1.156   1.137  0.00  0.00    +0.029 C 
ATOM     24  C   LIG    1        3.418   0.680  -0.257  0.00  0.00    +0.101 C 
ATOM     25  C   LIG    1        3.269   1.855  -1.245  0.00  0.00    +0.029 C 
BRANCH  24  26
ATOM     26  C   LIG    1        4.872   0.217  -0.186  0.00  0.00    +0.144 A 
ATOM     27  N   LIG    1        5.284  -0.418   0.931  0.00  0.00    -0.227 NA
ATOM     28  C   LIG    1        6.565  -0.872   0.971  0.00  0.00    +0.147 A 
ATOM     29  C   LIG    1        7.440  -0.671  -0.081  0.00  0.00    +0.052 A 
ATOM     30  C   LIG    1        6.940   0.004  -1.167  0.00  0.00    +0.115 A 
ATOM     31  N   LIG    1        5.677   0.458  -1.240  0.00  0.00    -0.239 NA
BRANCH  28  32
ATOM     32  C   LIG    1        7.063  -1.600   2.208  0.00  0.00    +0.434 C 
ATOM     33  F   LIG    1        6.091  -1.911   3.111  0.00  0.00    -0.164 F 
ATOM     34  F   LIG    1        7.991  -0.872   2.897  0.00  0.00    -0.164 F 
ATOM     35  F   LIG    1        7.682  -2.780   1.908  0.00  0.00    -0.164 F 
ENDBRANCH  28  32
ENDBRANCH  24  26
ENDBRANCH  19  24
ENDBRANCH   1  20
TORSDOF 6