REMARK  Name = BDB057909
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.006   0.164   0.226  0.00  0.00    -0.248 N 
ATOM      2  N   LIG    1        0.994  -0.287  -1.038  0.00  0.00    -0.065 NA
ATOM      3  N   LIG    1        2.237  -0.215  -1.497  0.00  0.00    -0.128 NA
ATOM      4  C   LIG    1        3.040   0.273  -0.497  0.00  0.00    +0.131 A 
ATOM      5  C   LIG    1        2.265   0.515   0.619  0.00  0.00    +0.140 A 
ENDROOT
BRANCH   1  10
ATOM      6  C   LIG    1       -4.420   0.028  -0.129  0.00  0.00    +0.216 C 
ATOM      7  N   LIG    1       -3.077   0.029   0.245  0.00  0.00    -0.301 N 
ATOM      8  C   LIG    1       -2.545   1.224   0.896  0.00  0.00    +0.110 C 
ATOM      9  C   LIG    1       -1.074   1.437   0.568  0.00  0.00    +0.046 C 
ATOM     10  C   LIG    1       -0.225   0.234   1.003  0.00  0.00    +0.112 C 
ATOM     11  C   LIG    1       -1.002  -1.093   0.984  0.00  0.00    +0.046 C 
ATOM     12  C   LIG    1       -2.143  -1.067  -0.027  0.00  0.00    +0.110 C 
ATOM     13  O   LIG    1       -5.169   0.963   0.154  0.00  0.00    -0.276 OA
BRANCH   6  14
ATOM     14  C   LIG    1       -4.913  -1.187  -0.906  0.00  0.00    +0.096 C 
BRANCH  14  16
ATOM     15  C   LIG    1       -7.374  -1.299  -0.284  0.00  0.00    +0.004 C 
ATOM     16  C   LIG    1       -6.358  -1.062  -1.392  0.00  0.00    +0.006 C 
ENDBRANCH  14  16
ENDBRANCH   6  14
ENDBRANCH   1  10
BRANCH   4  17
ATOM     17  C   LIG    1        4.471   0.492  -0.637  0.00  0.00    +0.093 A 
ATOM     18  N   LIG    1        4.931   0.630  -1.905  0.00  0.00    -0.253 NA
ATOM     19  C   LIG    1        6.247   0.867  -2.091  0.00  0.00    +0.112 A 
ATOM     20  C   LIG    1        7.156   0.951  -1.058  0.00  0.00    +0.035 A 
ATOM     21  C   LIG    1        6.674   0.769   0.234  0.00  0.00    +0.062 A 
ATOM     22  C   LIG    1        5.314   0.553   0.463  0.00  0.00    +0.045 A 
BRANCH  21  23
ATOM     23  C   LIG    1        7.626   0.849   1.358  0.00  0.00    +0.337 C 
ATOM     24  O   LIG    1        8.477   1.714   1.446  0.00  0.00    -0.245 OA
BRANCH  23  25
ATOM     25  O   LIG    1        7.466  -0.152   2.247  0.00  0.00    -0.477 OA
ATOM     26  H   LIG    1        6.887  -0.880   1.952  0.00  0.00    +0.295 HD
ENDBRANCH  23  25
ENDBRANCH  21  23
ENDBRANCH   4  17
TORSDOF 6