REMARK  Name = BDB061793
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.236  -1.213  -0.959  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.223  -0.268  -1.980  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.362   0.264  -2.444  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.984   0.149  -2.532  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.187  -0.393  -2.069  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        2.192  -1.363  -1.054  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1        0.964  -1.773  -0.506  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  16
ATOM      8  C   LIG    1       -4.780  -0.288   0.767  0.00  0.00    +0.093 C 
ATOM      9  N   LIG    1       -4.350   1.054   1.230  0.00  0.00    -0.296 N 
ATOM     10  C   LIG    1       -5.196   1.977   1.836  0.00  0.00    +0.213 C 
ATOM     11  O   LIG    1       -4.888   3.160   1.984  0.00  0.00    -0.276 OA
ATOM     12  C   LIG    1       -6.519   1.474   2.357  0.00  0.00    +0.109 C 
ATOM     13  C   LIG    1       -3.068   1.550   0.719  0.00  0.00    +0.127 C 
ATOM     14  C   LIG    1       -1.956   0.499   0.761  0.00  0.00    +0.127 C 
ATOM     15  N   LIG    1       -2.382  -0.784   0.196  0.00  0.00    -0.294 N 
ATOM     16  C   LIG    1       -1.508  -1.694  -0.394  0.00  0.00    +0.249 C 
ATOM     17  O   LIG    1       -1.737  -2.899  -0.479  0.00  0.00    -0.270 OA
ATOM     18  C   LIG    1       -3.622  -1.311   0.764  0.00  0.00    +0.130 C 
BRANCH   8  20
ATOM     19  C   LIG    1       -4.756  -0.147  -1.850  0.00  0.00    +0.006 C 
ATOM     20  C   LIG    1       -5.567  -0.240  -0.566  0.00  0.00    +0.021 C 
ENDBRANCH   8  20
ENDBRANCH   1  16
BRANCH   6  21
ATOM     21  C   LIG    1        3.486  -1.962  -0.536  0.00  0.00    +0.162 C 
BRANCH  21  22
ATOM     22  N   LIG    1        4.236  -1.038   0.314  0.00  0.00    -0.289 N 
ATOM     23  C   LIG    1        5.329  -0.263  -0.184  0.00  0.00    +0.059 A 
ATOM     24  C   LIG    1        5.977   0.639   0.670  0.00  0.00    +0.063 A 
ATOM     25  C   LIG    1        7.050   1.429   0.233  0.00  0.00    +0.015 A 
ATOM     26  C   LIG    1        7.498   1.322  -1.079  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        6.875   0.428  -1.944  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        5.525   0.760   2.064  0.00  0.00    +0.262 A 
ATOM     29  O   LIG    1        6.042   1.545   2.850  0.00  0.00    -0.267 OA
ATOM     30  N   LIG    1        4.494  -0.057   2.431  0.00  0.00    -0.274 N 
ATOM     31  H   LIG    1        4.176   0.014   3.385  0.00  0.00    +0.173 HD
ATOM     32  C   LIG    1        5.803  -0.357  -1.502  0.00  0.00    +0.027 A 
ATOM     33  C   LIG    1        3.821  -0.938   1.636  0.00  0.00    +0.330 A 
ATOM     34  O   LIG    1        2.895  -1.590   2.119  0.00  0.00    -0.246 OA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 4