REMARK  Name = BDB064396
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.376   0.033  -0.826  0.00  0.00    -0.304 N 
ATOM      2  H   LIG    1        0.238   0.442  -0.130  0.00  0.00    +0.149 HD
ATOM      3  C   LIG    1        0.204  -0.916  -1.646  0.00  0.00    +0.218 C 
ATOM      4  O   LIG    1       -0.462  -1.733  -2.280  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1       -4.868   0.383   2.227  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1       -4.011   0.200   1.369  0.00  0.00    +0.219 C 
ATOM      7  N   LIG    1       -3.141  -0.858   1.452  0.00  0.00    -0.255 N 
ATOM      8  H   LIG    1       -3.212  -1.387   2.311  0.00  0.00    +0.158 HD
ATOM      9  C   LIG    1       -1.910  -0.919   0.842  0.00  0.00    +0.240 C 
ATOM     10  O   LIG    1       -1.000  -1.583   1.335  0.00  0.00    -0.273 OA
ATOM     11  C   LIG    1       -1.777  -0.097  -0.451  0.00  0.00    +0.160 C 
ATOM     12  C   LIG    1       -2.405   1.272  -0.223  0.00  0.00    +0.041 C 
ATOM     13  C   LIG    1       -3.866   1.101   0.164  0.00  0.00    +0.098 C 
ENDBRANCH   1  11
BRANCH   3  14
ATOM     14  C   LIG    1        1.716  -0.833  -1.805  0.00  0.00    +0.130 C 
BRANCH  14  15
ATOM     15  C   LIG    1        2.476  -0.389  -0.577  0.00  0.00    -0.039 A 
ATOM     16  C   LIG    1        3.202   0.810  -0.583  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        3.889   1.226   0.559  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        3.858   0.448   1.715  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        3.143  -0.748   1.730  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        2.458  -1.167   0.590  0.00  0.00    +0.004 A 
ENDBRANCH  14  15
ENDBRANCH   3  14
TORSDOF 3