REMARK  Name = BDB062438
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.460   0.296  -0.024  0.00  0.00    +0.108 A 
ATOM      2  C   LIG    1        1.276  -0.359  -0.352  0.00  0.00    +0.161 A 
ATOM      3  N   LIG    1        0.265   0.263   0.355  0.00  0.00    -0.227 N 
ATOM      4  N   LIG    1        0.798   1.082   1.309  0.00  0.00    -0.173 NA
ATOM      5  C   LIG    1        2.089   1.171   1.007  0.00  0.00    +0.150 A 
ENDROOT
BRANCH   3   6
ATOM      6  C   LIG    1       -1.157   0.212   0.224  0.00  0.00    +0.066 A 
ATOM      7  C   LIG    1       -1.950   0.664   1.294  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1       -3.345   0.646   1.206  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -3.962   0.192   0.045  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1       -3.187  -0.233  -1.031  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -1.790  -0.217  -0.948  0.00  0.00    +0.028 A 
ENDBRANCH   3   6
BRANCH   2  12
ATOM     12  C   LIG    1        1.083  -1.535  -1.215  0.00  0.00    +0.435 C 
ATOM     13  F   LIG    1        0.051  -2.316  -0.809  0.00  0.00    -0.164 F 
ATOM     14  F   LIG    1        2.169  -2.348  -1.209  0.00  0.00    -0.164 F 
ATOM     15  F   LIG    1        0.843  -1.190  -2.502  0.00  0.00    -0.164 F 
ENDBRANCH   2  12
BRANCH   1  17
ATOM     16  O   LIG    1        3.886  -0.338  -1.778  0.00  0.00    -0.245 OA
ATOM     17  C   LIG    1        3.755   0.076  -0.636  0.00  0.00    +0.340 C 
BRANCH  17  18
ATOM     18  O   LIG    1        4.821   0.373   0.146  0.00  0.00    -0.477 OA
ATOM     19  H   LIG    1        4.600   0.576   1.072  0.00  0.00    +0.295 HD
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 4