REMARK  Name = BDB027624
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.300  -1.365   0.006  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        0.503  -2.443  -0.416  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.855  -2.156  -0.601  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.652  -3.207  -1.032  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.238  -4.477  -1.279  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.934  -4.726  -1.076  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.380  -0.945  -0.379  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.547   0.007   0.067  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.040  -3.761  -0.652  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.227  -0.160   0.267  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.128   1.331   0.353  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.369   1.715  -0.175  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        3.876   2.972   0.119  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        3.243   3.872   0.897  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        2.055   3.494   1.409  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        1.470   2.260   1.171  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.681  -1.591   0.173  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1       -1.996  -1.973  -0.723  0.00  0.00    +0.148 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -2.923   0.459  -0.643  0.00  0.00    +0.135 C 
ATOM     20  C   LIG    1       -2.636  -0.525   0.513  0.00  0.00    +0.100 C 
ATOM     21  C   LIG    1       -2.317   0.325   1.746  0.00  0.00    +0.025 C 
ATOM     22  C   LIG    1       -2.523   1.775   1.302  0.00  0.00    +0.004 C 
ATOM     23  C   LIG    1       -2.291   1.771  -0.202  0.00  0.00    +0.033 C 
BRANCH  19  24
ATOM     24  O   LIG    1       -2.466  -0.007  -1.905  0.00  0.00    -0.390 OA
ATOM     25  H   LIG    1       -2.284   0.773  -2.458  0.00  0.00    +0.210 HD
ENDBRANCH  19  24
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 4