REMARK  Name = BDB019737
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.483  -3.149   0.600  0.00  0.00    -0.027 A 
ATOM      2  C   LIG    1        1.493  -2.192   0.808  0.00  0.00    +0.013 A 
ATOM      3  C   LIG    1        2.642  -2.161  -0.001  0.00  0.00    +0.008 A 
ATOM      4  C   LIG    1        2.760  -3.097  -1.030  0.00  0.00    +0.163 A 
ATOM      5  F   LIG    1        3.845  -3.092  -1.820  0.00  0.00    -0.202 F 
ATOM      6  C   LIG    1        1.763  -4.042  -1.245  0.00  0.00    +0.159 A 
ATOM      7  F   LIG    1        1.887  -4.937  -2.235  0.00  0.00    -0.202 F 
ATOM      8  C   LIG    1        0.627  -4.074  -0.442  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1   9
ATOM      9  C   LIG    1       -0.753  -3.149   1.465  0.00  0.00    +0.140 C 
BRANCH   9  11
ATOM     10  C   LIG    1       -1.707  -0.888   1.650  0.00  0.00    +0.245 C 
ATOM     11  N   LIG    1       -1.680  -2.125   1.040  0.00  0.00    -0.307 N 
ATOM     12  H   LIG    1       -2.079  -2.220   0.117  0.00  0.00    +0.149 HD
ATOM     13  O   LIG    1       -1.016  -0.596   2.618  0.00  0.00    -0.270 OA
BRANCH  10  16
ATOM     14  C   LIG    1       -3.048   2.453   0.539  0.00  0.00    +0.124 A 
ATOM     15  C   LIG    1       -2.237   1.469   1.104  0.00  0.00    +0.059 A 
ATOM     16  C   LIG    1       -2.609   0.123   1.038  0.00  0.00    +0.044 A 
ATOM     17  C   LIG    1       -3.817  -0.245   0.430  0.00  0.00    +0.059 A 
ATOM     18  C   LIG    1       -4.633   0.736  -0.133  0.00  0.00    +0.124 A 
ATOM     19  C   LIG    1       -4.241   2.080  -0.082  0.00  0.00    +0.091 A 
BRANCH  14  21
ATOM     20  C   LIG    1       -3.349   4.769   0.085  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1       -2.568   3.728   0.659  0.00  0.00    -0.495 OA
ENDBRANCH  14  21
BRANCH  18  22
ATOM     22  O   LIG    1       -5.832   0.520  -0.757  0.00  0.00    -0.495 OA
ATOM     23  C   LIG    1       -6.320  -0.815  -0.785  0.00  0.00    +0.277 C 
ENDBRANCH  18  22
ENDBRANCH  10  16
ENDBRANCH   9  11
ENDBRANCH   1   9
BRANCH   3  24
ATOM     24  C   LIG    1        3.706  -1.117   0.204  0.00  0.00    +0.142 C 
BRANCH  24  25
ATOM     25  N   LIG    1        3.317   0.108  -0.467  0.00  0.00    -0.313 N 
ATOM     26  H   LIG    1        2.397   0.430  -0.181  0.00  0.00    +0.149 HD
BRANCH  25  27
ATOM     27  C   LIG    1        4.148   1.166  -0.565  0.00  0.00    +0.176 C 
ATOM     28  N   LIG    1        5.449   0.925  -0.871  0.00  0.00    -0.316 N 
ATOM     29  H   LIG    1        5.562   0.201  -1.570  0.00  0.00    +0.149 HD
ATOM     30  C   LIG    1        6.040   2.202  -1.214  0.00  0.00    +0.127 C 
ATOM     31  C   LIG    1        5.018   3.180  -0.629  0.00  0.00    +0.163 C 
ATOM     32  N   LIG    1        3.765   2.401  -0.427  0.00  0.00    -0.255 NA
ENDBRANCH  25  27
ENDBRANCH  24  25
ENDBRANCH   3  24
TORSDOF 8