REMARK  Name = BDB032318
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.620  -0.709   0.163  0.00  0.00    +0.122 A 
ATOM      2  N   LIG    1        1.083  -0.176   1.282  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -0.243  -0.338   1.505  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1       -1.101  -1.024   0.660  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1       -0.536  -1.590  -0.481  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        0.828  -1.433  -0.729  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1        6.779   0.924  -0.987  0.00  0.00    +0.238 A 
ATOM      8  N   LIG    1        5.581   0.469  -0.511  0.00  0.00    -0.305 N 
ATOM      9  C   LIG    1        5.242  -0.039   0.801  0.00  0.00    +0.144 C 
ATOM     10  C   LIG    1        3.731   0.041   1.052  0.00  0.00    +0.128 C 
ATOM     11  N   LIG    1        2.999  -0.556  -0.083  0.00  0.00    -0.306 N 
ATOM     12  C   LIG    1        3.268   0.111  -1.381  0.00  0.00    +0.182 C 
ATOM     13  C   LIG    1        4.691   0.533  -1.548  0.00  0.00    +0.151 A 
ATOM     14  N   LIG    1        5.301   1.025  -2.602  0.00  0.00    -0.132 NA
ATOM     15  N   LIG    1        6.611   1.271  -2.253  0.00  0.00    -0.125 NA
BRANCH   7  17
ATOM     16  F   LIG    1        8.272  -0.205   0.431  0.00  0.00    -0.163 F 
ATOM     17  C   LIG    1        8.010   0.989  -0.167  0.00  0.00    +0.452 C 
ATOM     18  F   LIG    1        7.886   1.894   0.842  0.00  0.00    -0.163 F 
ATOM     19  F   LIG    1        9.118   1.329  -0.870  0.00  0.00    -0.163 F 
ENDBRANCH   7  17
ENDBRANCH   1  11
BRANCH   4  20
ATOM     20  C   LIG    1       -2.561  -1.182   0.985  0.00  0.00    +0.138 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.370  -0.684  -0.125  0.00  0.00    -0.339 N 
ATOM     22  H   LIG    1       -3.019   0.204  -0.477  0.00  0.00    +0.146 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -4.756  -0.623   0.091  0.00  0.00    +0.040 A 
ATOM     24  C   LIG    1       -5.520   0.514  -0.260  0.00  0.00    +0.041 A 
ATOM     25  C   LIG    1       -6.895   0.479  -0.021  0.00  0.00    +0.141 A 
ATOM     26  N   LIG    1       -7.431   1.673  -0.422  0.00  0.00    -0.330 N 
ATOM     27  H   LIG    1       -8.409   1.909  -0.362  0.00  0.00    +0.168 HD
ATOM     28  C   LIG    1       -6.435   2.459  -0.908  0.00  0.00    +0.109 A 
ATOM     29 CL   LIG    1       -6.838   4.005  -1.476  0.00  0.00    -0.064 Cl
ATOM     30  N   LIG    1       -7.611  -0.528   0.505  0.00  0.00    -0.237 NA
ATOM     31  C   LIG    1       -6.853  -1.606   0.796  0.00  0.00    +0.115 A 
ATOM     32  C   LIG    1       -5.240   1.794  -0.832  0.00  0.00    +0.051 A 
ATOM     33  C   LIG    1       -5.478  -1.705   0.615  0.00  0.00    +0.043 A 
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH   4  20
TORSDOF 5