REMARK  Name = BDB030608
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.654  -0.251  -1.014  0.00  0.00    +0.052 C 
ATOM      2  C   LIG    1       -1.390   1.016  -0.231  0.00  0.00    +0.021 C 
ATOM      3  C   LIG    1       -0.471   1.013   0.943  0.00  0.00    +0.112 C 
ATOM      4  N   LIG    1        0.828   0.657   0.396  0.00  0.00    -0.296 N 
ATOM      5  C   LIG    1        1.917   0.534   1.245  0.00  0.00    +0.266 C 
ATOM      6  O   LIG    1        1.780   0.673   2.464  0.00  0.00    -0.268 OA
ATOM      7  C   LIG    1        0.837   0.546  -1.060  0.00  0.00    +0.112 C 
ATOM      8  C   LIG    1       -0.593   0.731  -1.456  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -6.543  -0.529  -2.604  0.00  0.00    +0.090 C 
ATOM     10  C   LIG    1       -5.084  -0.466  -2.390  0.00  0.00    +0.142 A 
ATOM     11  C   LIG    1       -4.270  -0.309  -1.288  0.00  0.00    +0.047 A 
ATOM     12  C   LIG    1       -2.967  -0.367  -1.833  0.00  0.00    +0.095 A 
ATOM     13  N   LIG    1       -2.974  -0.543  -3.156  0.00  0.00    -0.082 NA
ATOM     14  O   LIG    1       -4.313  -0.599  -3.506  0.00  0.00    -0.359 OA
BRANCH  11  15
ATOM     15  C   LIG    1       -4.730  -0.146   0.073  0.00  0.00    -0.013 A 
ATOM     16  C   LIG    1       -5.588   0.907   0.414  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1       -6.012   1.071   1.734  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -5.580   0.186   2.721  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -4.724  -0.863   2.390  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -4.299  -1.029   1.071  0.00  0.00    +0.008 A 
ENDBRANCH  11  15
ENDBRANCH   1  12
BRANCH   5  21
ATOM     21  C   LIG    1        3.242   0.235   0.673  0.00  0.00    +0.143 A 
ATOM     22  N   LIG    1        3.542   0.086  -0.672  0.00  0.00    -0.231 NA
ATOM     23  C   LIG    1        4.829  -0.168  -0.732  0.00  0.00    +0.200 A 
ATOM     24  N   LIG    1        5.392  -0.193   0.511  0.00  0.00    -0.334 N 
ATOM     25  C   LIG    1        4.399   0.062   1.414  0.00  0.00    +0.120 A 
BRANCH  24  26
ATOM     26  C   LIG    1        6.791  -0.442   0.831  0.00  0.00    +0.082 C 
ATOM     27  C   LIG    1        7.226  -1.844   0.406  0.00  0.00    +0.030 C 
ATOM     28  C   LIG    1        7.705   0.630   0.237  0.00  0.00    +0.030 C 
ENDBRANCH  24  26
ENDBRANCH   5  21
TORSDOF 4