REMARK  Name = BDB027611
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.622   0.813  -0.156  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1       -0.288   2.177  -0.178  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.052   2.470   0.073  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        1.393   3.814   0.067  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        0.549   4.854  -0.166  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.731   4.535  -0.422  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        1.976   1.525   0.306  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.567   0.247   0.277  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -1.194   3.233  -0.440  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.301  -0.140   0.054  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.575  -0.803   0.513  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.915  -0.489   0.788  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.826  -1.511   1.005  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.506  -2.820   0.969  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        3.219  -3.118   0.703  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        2.239  -2.165   0.473  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.963   0.428  -0.384  0.00  0.00    -0.328 N 
ATOM     18  H   LIG    1       -2.554   0.915   0.285  0.00  0.00    +0.147 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -2.204  -1.014  -0.357  0.00  0.00    +0.102 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -3.990  -2.766  -0.663  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1       -3.678  -1.279  -0.665  0.00  0.00    +0.015 C 
ENDBRANCH  19  21
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 4