REMARK  Name = BDB030604
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.744  -0.668   0.859  0.00  0.00    -0.329 N 
ATOM      2  C   LIG    1       -3.000  -1.639   0.249  0.00  0.00    +0.120 A 
ATOM      3  C   LIG    1       -1.676  -1.330   0.511  0.00  0.00    +0.143 A 
ATOM      4  N   LIG    1       -1.626  -0.174   1.276  0.00  0.00    -0.231 NA
ATOM      5  C   LIG    1       -2.873   0.191   1.465  0.00  0.00    +0.200 A 
ENDROOT
BRANCH   3   6
ATOM      6  C   LIG    1       -0.521  -2.125   0.057  0.00  0.00    +0.266 C 
ATOM      7  N   LIG    1        0.760  -1.662   0.316  0.00  0.00    -0.296 N 
ATOM      8  C   LIG    1        1.122  -0.441   1.028  0.00  0.00    +0.112 C 
ATOM      9  C   LIG    1        2.617  -0.409   0.971  0.00  0.00    +0.021 C 
ATOM     10  C   LIG    1        3.348  -0.299  -0.350  0.00  0.00    +0.047 C 
ATOM     11  C   LIG    1        3.095  -1.646   0.295  0.00  0.00    +0.021 C 
ATOM     12  C   LIG    1        1.904  -2.471  -0.065  0.00  0.00    +0.112 C 
ATOM     13  O   LIG    1       -0.692  -3.191  -0.541  0.00  0.00    -0.268 OA
BRANCH  10  14
ATOM     14  C   LIG    1        4.715   0.235  -0.397  0.00  0.00    +0.065 C 
ATOM     15  C   LIG    1        5.753  -0.373  -1.253  0.00  0.00    +0.104 C 
ATOM     16  C   LIG    1        6.770   0.753  -1.185  0.00  0.00    +0.138 C 
ATOM     17  C   LIG    1        6.659   1.712  -2.372  0.00  0.00    +0.058 C 
ATOM     18  C   LIG    1        8.195   0.225  -1.054  0.00  0.00    +0.058 C 
ATOM     19  O   LIG    1        6.443   1.478   0.018  0.00  0.00    -0.387 OA
ATOM     20  N   LIG    1        5.076   1.247   0.316  0.00  0.00    -0.093 NA
ENDBRANCH  10  14
ENDBRANCH   3   6
BRANCH   1  22
ATOM     21  C   LIG    1       -5.735  -0.905   2.301  0.00  0.00    +0.036 C 
ATOM     22  C   LIG    1       -5.207  -0.604   0.892  0.00  0.00    +0.116 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -5.702   0.703   0.270  0.00  0.00    -0.008 A 
ATOM     24  C   LIG    1       -5.844   0.839  -1.132  0.00  0.00    +0.057 A 
ATOM     25  C   LIG    1       -6.281   2.052  -1.687  0.00  0.00    +0.019 A 
ATOM     26  C   LIG    1       -6.576   3.140  -0.869  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -6.434   3.024   0.509  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -6.001   1.821   1.074  0.00  0.00    +0.007 A 
BRANCH  24  29
ATOM     29  C   LIG    1       -5.559  -0.242  -2.035  0.00  0.00    +0.099 C 
ATOM     30  N   LIG    1       -5.343  -1.125  -2.755  0.00  0.00    -0.191 NA
ENDBRANCH  24  29
ENDBRANCH  22  23
ENDBRANCH   1  22
TORSDOF 5