REMARK  Name = BDB034315
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.946  -0.688   0.030  0.00  0.00    -0.298 NA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.328  -1.789  -0.864  0.00  0.00    +0.084 C 
BRANCH   2   4
ATOM      3  C   LIG    1        0.037  -3.565   0.359  0.00  0.00    +0.005 C 
ATOM      4  C   LIG    1       -1.322  -3.177  -0.206  0.00  0.00    +0.012 C 
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1   5
ATOM      5  C   LIG    1       -1.872  -0.444   1.157  0.00  0.00    +0.123 C 
BRANCH   5   6
ATOM      6  C   LIG    1       -3.280   0.034   0.828  0.00  0.00    +0.009 A 
ATOM      7  C   LIG    1       -3.635   1.397   0.858  0.00  0.00    +0.125 A 
ATOM      8  C   LIG    1       -4.946   1.780   0.550  0.00  0.00    +0.046 A 
ATOM      9  C   LIG    1       -5.910   0.824   0.219  0.00  0.00    +0.016 A 
ATOM     10  C   LIG    1       -5.584  -0.535   0.191  0.00  0.00    +0.055 A 
ATOM     11  C   LIG    1       -4.272  -0.916   0.510  0.00  0.00    +0.021 A 
BRANCH  10  12
ATOM     12  C   LIG    1       -6.627  -1.575  -0.135  0.00  0.00    +0.417 C 
ATOM     13  F   LIG    1       -7.251  -2.048   0.979  0.00  0.00    -0.166 F 
ATOM     14  F   LIG    1       -7.615  -1.106  -0.947  0.00  0.00    -0.166 F 
ATOM     15  F   LIG    1       -6.113  -2.666  -0.769  0.00  0.00    -0.166 F 
ENDBRANCH  10  12
BRANCH   7  16
ATOM     16  O   LIG    1       -2.645   2.274   1.214  0.00  0.00    -0.495 OA
ATOM     17  C   LIG    1       -2.955   3.661   1.215  0.00  0.00    +0.277 C 
ENDBRANCH   7  16
ENDBRANCH   5   6
ENDBRANCH   1   5
BRANCH   1  18
ATOM     18  C   LIG    1       -0.603   0.525  -0.733  0.00  0.00    +0.086 C 
BRANCH  18  19
ATOM     19  C   LIG    1        0.340   1.479   0.016  0.00  0.00    +0.034 C 
BRANCH  19  20
ATOM     20  C   LIG    1        1.719   0.873   0.285  0.00  0.00    +0.103 C 
BRANCH  20  21
ATOM     21  N   LIG    1        2.496   0.822  -0.963  0.00  0.00    -0.343 N 
ATOM     22  H   LIG    1        2.699   1.757  -1.304  0.00  0.00    +0.146 HD
BRANCH  21  23
ATOM     23  C   LIG    1        3.678   0.051  -0.836  0.00  0.00    +0.038 A 
ATOM     24  C   LIG    1        4.961   0.625  -0.639  0.00  0.00    +0.021 A 
ATOM     25  C   LIG    1        6.052  -0.266  -0.490  0.00  0.00    +0.074 A 
ATOM     26  C   LIG    1        7.327   0.246  -0.304  0.00  0.00    +0.048 A 
ATOM     27  C   LIG    1        7.556   1.618  -0.253  0.00  0.00    +0.043 A 
ATOM     28  C   LIG    1        6.503   2.511  -0.386  0.00  0.00    +0.021 A 
ATOM     29 CL   LIG    1        9.154   2.213  -0.018  0.00  0.00    -0.083 Cl
ATOM     30  N   LIG    1        5.916  -1.600  -0.513  0.00  0.00    -0.255 NA
ATOM     31  C   LIG    1        4.680  -2.110  -0.678  0.00  0.00    +0.113 A 
ATOM     32  C   LIG    1        5.212   2.019  -0.576  0.00  0.00    +0.013 A 
ATOM     33  C   LIG    1        3.548  -1.338  -0.833  0.00  0.00    +0.043 A 
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 11