REMARK  Name = BDB060719
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.006  -1.337  -0.357  0.00  0.00    +0.140 A 
ATOM      2  C   LIG    1        0.537  -2.674  -0.377  0.00  0.00    +0.082 A 
ATOM      3  C   LIG    1       -0.849  -2.791  -0.208  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1       -1.431  -4.050  -0.199  0.00  0.00    +0.029 A 
ATOM      5  C   LIG    1       -0.680  -5.212  -0.358  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1        0.694  -5.124  -0.536  0.00  0.00    +0.046 A 
ATOM      7  N   LIG    1       -1.665  -1.748  -0.051  0.00  0.00    -0.214 NA
ATOM      8  C   LIG    1       -1.129  -0.529  -0.058  0.00  0.00    +0.218 A 
ATOM      9  C   LIG    1        1.312  -3.871  -0.548  0.00  0.00    +0.133 A 
ATOM     10  N   LIG    1        0.171  -0.290  -0.196  0.00  0.00    -0.199 NA
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1        2.394  -1.087  -0.450  0.00  0.00    -0.282 N 
ATOM     12  H   LIG    1        2.890  -1.881  -0.845  0.00  0.00    +0.155 HD
BRANCH  11  17
ATOM     13  C   LIG    1        3.775   2.145  -0.027  0.00  0.00    +0.038 A 
ATOM     14  N   LIG    1        4.776   1.356  -0.516  0.00  0.00    -0.280 N 
ATOM     15  H   LIG    1        5.732   1.618  -0.726  0.00  0.00    +0.189 HD
ATOM     16  N   LIG    1        4.408   0.084  -0.727  0.00  0.00    -0.158 NA
ATOM     17  C   LIG    1        3.118   0.046  -0.378  0.00  0.00    +0.146 A 
ATOM     18  C   LIG    1        2.682   1.312   0.077  0.00  0.00    +0.068 A 
BRANCH  13  20
ATOM     19  C   LIG    1        3.667   4.464  -0.918  0.00  0.00    +0.010 C 
ATOM     20  C   LIG    1        3.960   3.585   0.287  0.00  0.00    +0.051 C 
ENDBRANCH  13  20
ENDBRANCH  11  17
ENDBRANCH   1  11
BRANCH   8  21
ATOM     21  N   LIG    1       -1.931   0.586   0.086  0.00  0.00    -0.305 N 
ATOM     22  H   LIG    1       -1.330   1.374   0.303  0.00  0.00    +0.150 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -3.084   0.456   0.970  0.00  0.00    +0.119 C 
ATOM     24  C   LIG    1       -2.649   0.344   2.436  0.00  0.00    +0.034 C 
BRANCH  23  25
ATOM     25  C   LIG    1       -3.990   1.669   0.743  0.00  0.00    +0.061 A 
ATOM     26  N   LIG    1       -3.832   2.764   1.538  0.00  0.00    -0.255 NA
ATOM     27  C   LIG    1       -4.619   3.837   1.282  0.00  0.00    +0.149 A 
ATOM     28  C   LIG    1       -5.551   3.877   0.262  0.00  0.00    +0.141 A 
ATOM     29  F   LIG    1       -6.298   4.970   0.060  0.00  0.00    -0.204 F 
ATOM     30  C   LIG    1       -5.697   2.769  -0.555  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1       -4.903   1.649  -0.318  0.00  0.00    +0.028 A 
ENDBRANCH  23  25
ENDBRANCH  21  23
ENDBRANCH   8  21
BRANCH   9  32
ATOM     32  O   LIG    1        2.663  -3.701  -0.750  0.00  0.00    -0.494 OA
ATOM     33  C   LIG    1        3.489  -4.860  -0.755  0.00  0.00    +0.277 C 
ENDBRANCH   9  32
TORSDOF 7