REMARK  Name = BDB001683
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.892  -0.837  -1.312  0.00  0.00    -0.229 N 
ATOM      2  C   LIG    1        2.284  -0.967  -1.288  0.00  0.00    +0.276 A 
ATOM      3  O   LIG    1        2.914  -1.674  -2.073  0.00  0.00    -0.266 OA
ATOM      4  C   LIG    1        2.975  -0.187  -0.250  0.00  0.00    +0.066 A 
ATOM      5  C   LIG    1        2.196   0.602   0.596  0.00  0.00    +0.078 A 
ATOM      6  C   LIG    1        2.834   1.350   1.587  0.00  0.00    +0.028 A 
ATOM      7  C   LIG    1        4.224   1.309   1.729  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        4.992   0.516   0.875  0.00  0.00    +0.001 A 
ATOM      9  N   LIG    1        0.800   0.674   0.493  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1        4.369  -0.236  -0.119  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1        0.201  -0.012  -0.433  0.00  0.00    +0.131 A 
ENDROOT
BRANCH  11  12
ATOM     12  C   LIG    1       -1.330   0.038  -0.533  0.00  0.00    +0.057 C 
ATOM     13  C   LIG    1       -1.938  -1.233   0.094  0.00  0.00    +0.011 C 
ATOM     14  C   LIG    1       -3.295  -1.003   0.764  0.00  0.00    +0.001 C 
ATOM     15  C   LIG    1       -4.123   0.024   0.005  0.00  0.00    +0.000 C 
ATOM     16  C   LIG    1       -3.429   1.385  -0.059  0.00  0.00    +0.001 C 
ATOM     17  C   LIG    1       -1.912   1.303   0.114  0.00  0.00    +0.011 C 
ENDBRANCH  11  12
BRANCH   1  18
ATOM     18  N   LIG    1        0.201  -1.572  -2.321  0.00  0.00    -0.238 N 
ATOM     19  H   LIG    1        0.369  -2.561  -2.112  0.00  0.00    +0.143 HD
ATOM     20  H   LIG    1        0.733  -1.426  -3.186  0.00  0.00    +0.143 HD
ENDBRANCH   1  18
TORSDOF 2