REMARK  Name = BDB036924
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.724   0.095  -0.220  0.00  0.00    -0.239 N 
ATOM      2  N   LIG    1       -0.352   0.603  -1.407  0.00  0.00    -0.064 NA
ATOM      3  N   LIG    1        0.973   0.630  -1.430  0.00  0.00    -0.129 NA
ATOM      4  C   LIG    1        1.438   0.134  -0.236  0.00  0.00    +0.113 A 
ATOM      5  C   LIG    1        0.361  -0.225   0.545  0.00  0.00    +0.139 A 
ENDROOT
BRANCH   1  12
ATOM      6  O   LIG    1       -6.169   0.641  -0.324  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -4.960   0.434  -0.307  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1       -4.083   1.382   0.159  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -4.509   2.236   0.495  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -2.773   1.185   0.536  0.00  0.00    +0.244 C 
ATOM     11  O   LIG    1       -2.225   1.995   1.282  0.00  0.00    -0.273 OA
ATOM     12  C   LIG    1       -2.126  -0.116   0.093  0.00  0.00    +0.195 C 
ATOM     13  C   LIG    1       -2.898  -0.752  -1.067  0.00  0.00    +0.045 C 
ATOM     14  C   LIG    1       -4.363  -0.899  -0.690  0.00  0.00    +0.099 C 
ENDBRANCH   1  12
BRANCH   4  15
ATOM     15  C   LIG    1        2.849   0.016   0.093  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        3.814   0.337  -0.873  0.00  0.00    +0.010 A 
ATOM     17  C   LIG    1        5.178   0.232  -0.587  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        5.596  -0.194   0.671  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        4.651  -0.514   1.643  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1        3.285  -0.410   1.357  0.00  0.00    +0.010 A 
ENDBRANCH   4  15
TORSDOF 2