REMARK  Name = BDB051774
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.878   0.260  -0.292  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.852  -0.001  -1.658  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.110   0.509  -2.440  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.826  -0.808  -2.235  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.849  -1.337  -1.443  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        2.914  -1.048  -0.070  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        1.911  -0.251   0.503  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  13
ATOM      8  N   LIG    1       -5.041   0.455  -0.271  0.00  0.00    -0.297 NA
ATOM      9  C   LIG    1       -4.256  -0.042   0.898  0.00  0.00    +0.025 C 
ATOM     10  C   LIG    1       -3.136  -1.069   0.624  0.00  0.00    +0.041 C 
ATOM     11  C   LIG    1       -1.982  -0.481  -0.187  0.00  0.00    +0.110 C 
ATOM     12  N   LIG    1       -1.448   0.737   0.422  0.00  0.00    -0.297 N 
ATOM     13  C   LIG    1       -0.117   1.147   0.332  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1        0.310   2.203   0.796  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1       -2.439   1.747   0.785  0.00  0.00    +0.110 C 
ATOM     16  C   LIG    1       -3.575   1.157   1.615  0.00  0.00    +0.041 C 
ATOM     17  C   LIG    1       -5.338  -0.654   1.800  0.00  0.00    +0.024 C 
ATOM     18  C   LIG    1       -6.557   0.229   1.597  0.00  0.00    +0.017 C 
ATOM     19  C   LIG    1       -6.292   0.995   0.308  0.00  0.00    +0.085 C 
BRANCH   8  21
ATOM     20  C   LIG    1       -5.870   0.083  -2.588  0.00  0.00    +0.020 C 
ATOM     21  C   LIG    1       -5.339  -0.553  -1.304  0.00  0.00    +0.081 C 
ENDBRANCH   8  21
ENDBRANCH   1  13
BRANCH   6  22
ATOM     22  C   LIG    1        4.028  -1.603   0.787  0.00  0.00    +0.092 C 
BRANCH  22  23
ATOM     23  C   LIG    1        5.424  -1.298   0.245  0.00  0.00    +0.069 A 
ATOM     24  C   LIG    1        5.995   0.088   0.375  0.00  0.00    -0.019 A 
ATOM     25  C   LIG    1        5.207   1.132   1.108  0.00  0.00    +0.046 C 
ATOM     26  C   LIG    1        7.208   0.289  -0.179  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        7.961   1.588  -0.227  0.00  0.00    +0.050 C 
ATOM     28  C   LIG    1        7.918  -0.846  -0.835  0.00  0.00    +0.268 A 
ATOM     29  O   LIG    1        9.031  -0.713  -1.334  0.00  0.00    -0.266 OA
ATOM     30  N   LIG    1        7.267  -2.047  -0.842  0.00  0.00    -0.243 N 
ATOM     31  H   LIG    1        7.741  -2.827  -1.285  0.00  0.00    +0.192 HD
ATOM     32  N   LIG    1        6.037  -2.290  -0.329  0.00  0.00    -0.175 NA
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 4