REMARK  Name = BDB064123
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.021  -0.651   0.287  0.00  0.00    +0.136 A 
ATOM      2  C   LIG    1       -2.152  -0.351   1.062  0.00  0.00    +0.078 A 
ATOM      3  C   LIG    1       -2.551  -0.432   2.413  0.00  0.00    +0.148 A 
ATOM      4  N   LIG    1       -3.797   0.012   2.620  0.00  0.00    -0.177 NA
ATOM      5  N   LIG    1       -4.208   0.358   1.378  0.00  0.00    -0.249 N 
ATOM      6  C   LIG    1       -5.540   0.877   1.192  0.00  0.00    +0.174 C 
ATOM      7  C   LIG    1       -3.262   0.154   0.410  0.00  0.00    +0.163 A 
ATOM      8  N   LIG    1       -3.383   0.389  -0.906  0.00  0.00    -0.213 NA
ATOM      9  C   LIG    1       -2.264   0.065  -1.579  0.00  0.00    +0.130 A 
ATOM     10  C   LIG    1       -2.296   0.243  -3.067  0.00  0.00    +0.088 C 
ATOM     11  N   LIG    1       -1.124  -0.442  -1.054  0.00  0.00    -0.217 NA
ENDROOT
BRANCH   1  16
ATOM     12  C   LIG    1        4.081   0.583   0.283  0.00  0.00    +0.239 C 
ATOM     13  N   LIG    1        2.882  -0.091   0.423  0.00  0.00    -0.295 N 
ATOM     14  C   LIG    1        2.333  -0.277   1.771  0.00  0.00    +0.127 C 
ATOM     15  C   LIG    1        0.795  -0.203   1.784  0.00  0.00    +0.125 C 
ATOM     16  N   LIG    1        0.171  -1.159   0.833  0.00  0.00    -0.312 N 
ATOM     17  C   LIG    1        1.093  -1.746  -0.161  0.00  0.00    +0.125 C 
ATOM     18  C   LIG    1        2.124  -0.723  -0.669  0.00  0.00    +0.127 C 
ATOM     19  O   LIG    1        4.744   0.969   1.243  0.00  0.00    -0.271 OA
BRANCH  12  21
ATOM     20  C   LIG    1        5.805   1.240  -1.339  0.00  0.00    +0.013 C 
ATOM     21  C   LIG    1        4.547   0.844  -1.108  0.00  0.00    +0.060 C 
ENDBRANCH  12  21
ENDBRANCH   1  16
TORSDOF 2