REMARK  Name = BDB032301
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.529  -0.727  -1.431  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1        1.665  -1.264  -0.774  0.00  0.00    +0.119 A 
ATOM      3  N   LIG    1        1.198  -0.072  -1.196  0.00  0.00    -0.240 NA
ATOM      4  C   LIG    1       -0.135   0.064  -1.386  0.00  0.00    +0.118 A 
ATOM      5  C   LIG    1       -1.063  -0.948  -1.181  0.00  0.00    -0.012 A 
ATOM      6  C   LIG    1       -0.565  -2.182  -0.765  0.00  0.00    +0.010 A 
ATOM      7  C   LIG    1        0.806  -2.341  -0.565  0.00  0.00    +0.044 A 
BRANCH   2   8
ATOM      8  N   LIG    1        3.038  -1.475  -0.598  0.00  0.00    -0.329 N 
ATOM      9  H   LIG    1        3.211  -1.963   0.274  0.00  0.00    +0.147 HD
BRANCH   8  10
ATOM     10  C   LIG    1        3.915  -0.315  -0.777  0.00  0.00    +0.106 C 
BRANCH  10  15
ATOM     11  C   LIG    1        8.114   1.267   0.561  0.00  0.00    +0.104 C 
ATOM     12  N   LIG    1        6.696   0.930   0.470  0.00  0.00    -0.305 NA
ATOM     13  C   LIG    1        5.952   1.970  -0.257  0.00  0.00    +0.084 C 
ATOM     14  C   LIG    1        4.457   2.003   0.088  0.00  0.00    +0.020 C 
ATOM     15  C   LIG    1        3.907   0.619   0.454  0.00  0.00    +0.008 C 
ATOM     16  C   LIG    1        4.723   0.032   1.628  0.00  0.00    +0.020 C 
ATOM     17  C   LIG    1        6.115   0.661   1.783  0.00  0.00    +0.084 C 
ENDBRANCH  10  15
ENDBRANCH   8  10
ENDBRANCH   2   8
ENDBRANCH   1   5
BRANCH   1  18
ATOM     18  N   LIG    1       -3.285  -1.029  -0.217  0.00  0.00    -0.339 N 
ATOM     19  H   LIG    1       -2.835  -0.631   0.605  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -4.652  -0.700  -0.241  0.00  0.00    +0.037 A 
ATOM     21  C   LIG    1       -5.263   0.027   0.814  0.00  0.00    +0.022 A 
ATOM     22  C   LIG    1       -6.633   0.312   0.755  0.00  0.00    +0.050 A 
ATOM     23  N   LIG    1       -6.954   1.024   1.891  0.00  0.00    -0.345 N 
ATOM     24  H   LIG    1       -7.874   1.367   2.130  0.00  0.00    +0.167 HD
ATOM     25  C   LIG    1       -5.840   1.190   2.648  0.00  0.00    +0.108 A 
ATOM     26 CL   LIG    1       -5.981   2.041   4.107  0.00  0.00    -0.064 Cl
ATOM     27  C   LIG    1       -7.449  -0.097  -0.304  0.00  0.00    +0.038 A 
ATOM     28  C   LIG    1       -6.857  -0.831  -1.341  0.00  0.00    +0.059 A 
ATOM     29  C   LIG    1       -4.774   0.597   2.033  0.00  0.00    +0.050 A 
ATOM     30  C   LIG    1       -5.485  -1.129  -1.293  0.00  0.00    +0.036 A 
BRANCH  28  31
ATOM     31  C   LIG    1       -7.691  -1.340  -2.492  0.00  0.00    +0.418 C 
ATOM     32  F   LIG    1       -8.008  -2.658  -2.362  0.00  0.00    -0.166 F 
ATOM     33  F   LIG    1       -7.060  -1.223  -3.694  0.00  0.00    -0.166 F 
ATOM     34  F   LIG    1       -8.877  -0.683  -2.632  0.00  0.00    -0.166 F 
ENDBRANCH  28  31
ENDBRANCH  18  20
ENDBRANCH   1  18
TORSDOF 7