REMARK  Name = BDB051099
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.827  -0.120  -0.975  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -1.083  -1.435  -1.350  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -2.214  -1.763  -1.991  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.162  -2.438  -1.063  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        1.029  -2.120  -0.406  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        1.310  -0.793  -0.039  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        0.376   0.210  -0.341  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1       -1.421   1.827  -2.080  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -1.780   0.956  -1.292  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1       -3.000   0.973  -0.641  0.00  0.00    -0.297 N 
ATOM     11  C   LIG    1       -3.455   0.052   0.395  0.00  0.00    +0.115 C 
ATOM     12  C   LIG    1       -4.889   0.516   0.641  0.00  0.00    -0.012 C 
ATOM     13  C   LIG    1       -5.997  -0.349  -0.037  0.00  0.00    +0.008 C 
ATOM     14  C   LIG    1       -6.847  -0.144   1.232  0.00  0.00    +0.001 C 
ATOM     15  C   LIG    1       -5.535   0.118   1.997  0.00  0.00    +0.008 C 
ATOM     16  C   LIG    1       -4.911   1.997   0.264  0.00  0.00    +0.027 C 
ATOM     17  C   LIG    1       -3.955   2.033  -0.913  0.00  0.00    +0.108 C 
ENDBRANCH   1   9
BRANCH   6  18
ATOM     18  C   LIG    1        2.617  -0.445   0.638  0.00  0.00    +0.093 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.808  -0.256  -0.296  0.00  0.00    +0.074 A 
ATOM     20  C   LIG    1        5.102   0.179   0.294  0.00  0.00    +0.011 A 
ATOM     21  C   LIG    1        6.177   0.352  -0.576  0.00  0.00    +0.050 A 
ATOM     22  C   LIG    1        7.426   0.762  -0.093  0.00  0.00    +0.014 A 
ATOM     23  C   LIG    1        7.600   0.997   1.270  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        6.529   0.822   2.146  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        5.989   0.095  -2.012  0.00  0.00    +0.272 A 
ATOM     26  O   LIG    1        6.906   0.236  -2.812  0.00  0.00    -0.266 OA
ATOM     27  N   LIG    1        4.734  -0.314  -2.389  0.00  0.00    -0.242 N 
ATOM     28  H   LIG    1        4.577  -0.488  -3.377  0.00  0.00    +0.192 HD
ATOM     29  C   LIG    1        5.282   0.413   1.663  0.00  0.00    +0.010 A 
ATOM     30  N   LIG    1        3.666  -0.488  -1.568  0.00  0.00    -0.175 NA
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 3