REMARK  Name = BDB056600
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.295   0.071  -0.023  0.00  0.00    +0.125 A 
ATOM      2  N   LIG    1       -1.053   1.389  -0.204  0.00  0.00    -0.239 NA
ATOM      3  C   LIG    1        0.217   1.847  -0.336  0.00  0.00    +0.123 A 
ATOM      4  C   LIG    1        1.300   0.967  -0.276  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1        1.037  -0.386  -0.077  0.00  0.00    +0.052 A 
ATOM      6  N   LIG    1        2.248  -1.037  -0.047  0.00  0.00    -0.354 N 
ATOM      7  H   LIG    1        2.363  -2.031   0.089  0.00  0.00    +0.166 HD
ATOM      8  C   LIG    1        3.270  -0.142  -0.227  0.00  0.00    +0.050 A 
ATOM      9  C   LIG    1        2.712   1.109  -0.372  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1       -0.264  -0.869   0.057  0.00  0.00    +0.070 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        4.770  -0.505  -0.256  0.00  0.00    +0.036 A 
ATOM     12  C   LIG    1        5.811   0.374  -0.435  0.00  0.00    +0.118 A 
ATOM     13  N   LIG    1        6.947  -0.381  -0.390  0.00  0.00    -0.274 N 
ATOM     14  C   LIG    1        8.305   0.085  -0.527  0.00  0.00    +0.172 C 
ATOM     15  N   LIG    1        6.713  -1.694  -0.194  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        5.381  -1.764  -0.113  0.00  0.00    +0.144 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -2.615  -0.416   0.123  0.00  0.00    -0.297 N 
ATOM     18  H   LIG    1       -2.765  -1.225  -0.474  0.00  0.00    +0.154 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -5.021  -0.293  -0.249  0.00  0.00    +0.141 A 
ATOM     20  C   LIG    1       -3.828   0.315   0.210  0.00  0.00    +0.075 A 
ATOM     21  C   LIG    1       -3.905   1.569   0.826  0.00  0.00    +0.027 A 
ATOM     22  C   LIG    1       -5.127   2.233   0.947  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -6.292   1.639   0.470  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -6.242   0.377  -0.125  0.00  0.00    +0.047 A 
BRANCH  19  26
ATOM     25  C   LIG    1       -6.032  -2.196  -1.271  0.00  0.00    +0.277 C 
ATOM     26  O   LIG    1       -4.857  -1.540  -0.813  0.00  0.00    -0.493 OA
ENDBRANCH  19  26
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 4