REMARK  Name = BDB031263
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.220   0.908  -0.215  0.00  0.00    -0.308 N 
ATOM      2  H   LIG    1        0.398   0.101   0.368  0.00  0.00    +0.149 HD
ATOM      3  C   LIG    1        1.136   1.212  -1.205  0.00  0.00    +0.246 C 
ATOM      4  O   LIG    1        0.886   1.939  -2.159  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        2.473   0.583  -1.092  0.00  0.00    +0.057 A 
ATOM      6  C   LIG    1        3.016   0.173   0.133  0.00  0.00    +0.044 A 
ATOM      7  C   LIG    1        4.269  -0.386   0.075  0.00  0.00    +0.087 A 
ATOM      8  C   LIG    1        4.939  -0.523  -1.137  0.00  0.00    +0.158 A 
ATOM      9  N   LIG    1        6.164  -1.112  -0.872  0.00  0.00    -0.291 N 
ATOM     10  H   LIG    1        6.864  -1.325  -1.562  0.00  0.00    +0.172 HD
ATOM     11  C   LIG    1        6.273  -1.342   0.501  0.00  0.00    +0.326 A 
ATOM     12  O   LIG    1        7.215  -1.841   1.088  0.00  0.00    -0.247 OA
ATOM     13  N   LIG    1        4.473  -0.141  -2.325  0.00  0.00    -0.235 NA
ATOM     14  N   LIG    1        5.081  -0.886   1.085  0.00  0.00    -0.305 N 
ATOM     15  H   LIG    1        4.896  -0.925   2.075  0.00  0.00    +0.170 HD
ATOM     16  C   LIG    1        3.231   0.420  -2.269  0.00  0.00    +0.126 A 
ENDBRANCH   3   5
BRANCH   1  22
ATOM     17  C   LIG    1       -5.078  -1.241   2.020  0.00  0.00    +0.109 C 
ATOM     18  C   LIG    1       -4.888  -0.660   0.642  0.00  0.00    +0.212 C 
ATOM     19  N   LIG    1       -3.689  -0.004   0.392  0.00  0.00    -0.302 N 
ATOM     20  C   LIG    1       -3.444   0.507  -0.956  0.00  0.00    +0.109 C 
ATOM     21  C   LIG    1       -1.959   0.504  -1.288  0.00  0.00    +0.041 C 
ATOM     22  C   LIG    1       -1.163   1.377  -0.308  0.00  0.00    +0.076 C 
ATOM     23  C   LIG    1       -1.808   1.455   1.083  0.00  0.00    +0.041 C 
ATOM     24  C   LIG    1       -2.654   0.227   1.399  0.00  0.00    +0.109 C 
ATOM     25  O   LIG    1       -5.773  -0.772  -0.206  0.00  0.00    -0.276 OA
ENDBRANCH   1  22
TORSDOF 2