REMARK  Name = BDB027674
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.016  -1.664  -0.286  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        1.780  -2.845  -0.256  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        3.057  -2.722   0.292  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        3.816  -3.883   0.338  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        3.431  -5.109  -0.106  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        2.204  -5.188  -0.646  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.547  -1.563   0.752  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        2.756  -0.484   0.656  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        1.352  -4.103  -0.743  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        1.510  -0.499   0.152  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        3.286   0.803   1.145  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        2.517   1.976   1.115  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        3.059   3.161   1.588  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.306   3.269   2.087  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        5.042   2.140   2.114  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        4.586   0.911   1.665  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -0.287  -1.712  -0.807  0.00  0.00    -0.322 N 
ATOM     18  H   LIG    1       -0.801  -2.440  -0.317  0.00  0.00    +0.148 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -0.430   0.489  -1.943  0.00  0.00    +0.032 C 
ATOM     20  C   LIG    1       -1.128  -0.493  -0.984  0.00  0.00    +0.040 C 
ATOM     21  C   LIG    1       -2.396  -1.011  -1.698  0.00  0.00    +0.032 C 
BRANCH  20  22
ATOM     22  C   LIG    1       -1.482   0.134   0.420  0.00  0.00    +0.109 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -2.534   1.135   0.649  0.00  0.00    -0.296 NA
ATOM     24  C   LIG    1       -3.895   0.602   0.784  0.00  0.00    +0.112 C 
ATOM     25  C   LIG    1       -4.870   1.705   1.235  0.00  0.00    +0.175 C 
ATOM     26  O   LIG    1       -4.849   2.820   0.332  0.00  0.00    -0.377 OA
ATOM     27  C   LIG    1       -3.525   3.366   0.258  0.00  0.00    +0.175 C 
ATOM     28  C   LIG    1       -2.517   2.309  -0.227  0.00  0.00    +0.112 C 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 5