REMARK  Name = BDB050475
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.289   0.177  -0.755  0.00  0.00    +0.089 A 
ATOM      2  C   LIG    1       -0.534   1.545  -0.612  0.00  0.00    +0.235 A 
ATOM      3  F   LIG    1       -1.671   1.928  -0.007  0.00  0.00    -0.182 F 
ATOM      4  N   LIG    1        0.286   2.526  -1.047  0.00  0.00    -0.226 NA
ATOM      5  C   LIG    1        1.422   2.129  -1.661  0.00  0.00    +0.119 A 
ATOM      6  C   LIG    1        1.787   0.797  -1.846  0.00  0.00    -0.008 A 
ATOM      7  C   LIG    1        0.897  -0.187  -1.391  0.00  0.00    +0.034 A 
ENDROOT
BRANCH   1  10
ATOM      8  O   LIG    1       -0.306  -2.784  -0.815  0.00  0.00    -0.275 OA
ATOM      9  C   LIG    1       -1.228  -2.115  -0.350  0.00  0.00    +0.222 C 
ATOM     10  N   LIG    1       -1.251  -0.738  -0.269  0.00  0.00    -0.282 N 
ATOM     11  H   LIG    1       -2.087  -0.313   0.144  0.00  0.00    +0.155 HD
BRANCH   9  12
ATOM     12  C   LIG    1       -2.438  -2.822   0.260  0.00  0.00    +0.094 C 
ATOM     13  C   LIG    1       -3.754  -2.120  -0.054  0.00  0.00    +0.118 C 
ATOM     14  N   LIG    1       -3.841  -1.105   1.001  0.00  0.00    -0.329 N 
ATOM     15  C   LIG    1       -3.116  -1.543   2.204  0.00  0.00    +0.106 C 
ATOM     16  C   LIG    1       -2.392  -2.823   1.784  0.00  0.00    +0.033 C 
BRANCH  14  17
ATOM     17  C   LIG    1       -4.886  -0.200   1.081  0.00  0.00    +0.030 A 
ATOM     18  C   LIG    1       -5.822  -0.046   0.043  0.00  0.00    +0.023 A 
ATOM     19  C   LIG    1       -6.869   0.882   0.118  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1       -7.002   1.694   1.238  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -6.080   1.585   2.272  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -5.037   0.654   2.188  0.00  0.00    +0.023 A 
ENDBRANCH  14  17
ENDBRANCH   9  12
ENDBRANCH   1  10
BRANCH   6  23
ATOM     23  C   LIG    1        3.064   0.420  -2.559  0.00  0.00    +0.163 C 
BRANCH  23  24
ATOM     24  N   LIG    1        4.269   0.990  -1.951  0.00  0.00    -0.289 N 
ATOM     25  C   LIG    1        4.861   0.406  -0.788  0.00  0.00    +0.059 A 
ATOM     26  C   LIG    1        6.001   0.996  -0.226  0.00  0.00    +0.063 A 
ATOM     27  C   LIG    1        6.616   0.467   0.918  0.00  0.00    +0.015 A 
ATOM     28  C   LIG    1        6.094  -0.673   1.520  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        4.965  -1.278   0.976  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1        6.569   2.200  -0.853  0.00  0.00    +0.262 A 
ATOM     31  O   LIG    1        7.554   2.768  -0.396  0.00  0.00    -0.267 OA
ATOM     32  N   LIG    1        5.931   2.648  -1.975  0.00  0.00    -0.274 N 
ATOM     33  H   LIG    1        6.301   3.483  -2.404  0.00  0.00    +0.173 HD
ATOM     34  C   LIG    1        4.354  -0.745  -0.167  0.00  0.00    +0.027 A 
ATOM     35  C   LIG    1        4.803   2.128  -2.539  0.00  0.00    +0.330 A 
ATOM     36  O   LIG    1        4.308   2.688  -3.517  0.00  0.00    -0.246 OA
ENDBRANCH  23  24
ENDBRANCH   6  23
TORSDOF 5