REMARK  Name = BDB057835
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.977   0.063  -0.968  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -1.657   0.106  -0.680  0.00  0.00    -0.210 NA
ATOM      3  C   LIG    1       -0.846  -0.748  -1.334  0.00  0.00    +0.158 A 
ATOM      4  C   LIG    1       -1.351  -1.642  -2.267  0.00  0.00    +0.181 A 
ATOM      5  F   LIG    1       -0.561  -2.499  -2.928  0.00  0.00    -0.200 F 
ATOM      6  C   LIG    1       -2.703  -1.602  -2.507  0.00  0.00    +0.155 A 
ATOM      7  N   LIG    1       -3.540  -0.756  -1.879  0.00  0.00    -0.233 NA
ENDROOT
BRANCH   1   9
ATOM      8  C   LIG    1       -5.048   0.681   0.392  0.00  0.00    -0.034 A 
ATOM      9  C   LIG    1       -3.846   1.032  -0.280  0.00  0.00    +0.023 A 
ATOM     10  C   LIG    1       -3.465   2.393  -0.298  0.00  0.00    +0.012 A 
ATOM     11  C   LIG    1       -4.247   3.386   0.291  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -5.437   3.042   0.913  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -5.834   1.706   0.962  0.00  0.00    +0.004 A 
BRANCH   8  15
ATOM     14  C   LIG    1       -5.872  -1.152   1.962  0.00  0.00    +0.012 C 
ATOM     15  C   LIG    1       -5.515  -0.769   0.519  0.00  0.00    +0.014 C 
ATOM     16  C   LIG    1       -6.693  -1.044  -0.418  0.00  0.00    +0.012 C 
ENDBRANCH   8  15
ENDBRANCH   1   9
BRANCH   3  17
ATOM     17  N   LIG    1        0.525  -0.793  -1.020  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1        1.077  -0.881  -1.870  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        0.994   0.287  -0.164  0.00  0.00    +0.138 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.492   0.165  -0.000  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1        3.360   1.067  -0.626  0.00  0.00    +0.006 A 
ATOM     22  C   LIG    1        4.745   0.940  -0.477  0.00  0.00    +0.009 A 
ATOM     23  C   LIG    1        5.302  -0.093   0.295  0.00  0.00    -0.016 A 
ATOM     24  C   LIG    1        4.423  -0.997   0.912  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        3.038  -0.872   0.767  0.00  0.00    +0.006 A 
BRANCH  23  26
ATOM     26  C   LIG    1        6.758  -0.225   0.449  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        7.559   0.846   0.848  0.00  0.00    +0.119 A 
ATOM     28  N   LIG    1        8.905   0.794   1.004  0.00  0.00    -0.263 NA
ATOM     29  C   LIG    1        9.495  -0.392   0.753  0.00  0.00    +0.111 A 
ATOM     30  C   LIG    1        8.805  -1.523   0.355  0.00  0.00    +0.020 A 
ATOM     31  C   LIG    1        7.422  -1.434   0.203  0.00  0.00    +0.011 A 
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   3  17
TORSDOF 6