REMARK  Name = BDB027869
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.142  -1.590   0.033  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        0.856  -2.580   0.732  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.027  -2.149   1.353  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.735  -3.114   2.056  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.394  -4.424   2.183  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.267  -4.808   1.560  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.467  -0.885   1.286  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.734  -0.018   0.572  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.474  -3.939   0.833  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.586  -0.327  -0.058  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.231   1.367   0.465  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        1.641   2.297  -0.402  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        2.146   3.586  -0.469  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        3.193   4.020   0.259  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        3.760   3.123   1.090  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        3.324   1.814   1.223  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.073  -1.948  -0.596  0.00  0.00    -0.314 N 
ATOM     18  H   LIG    1       -1.663  -2.328   0.149  0.00  0.00    +0.149 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.846  -0.892  -1.315  0.00  0.00    +0.125 C 
ATOM     20  C   LIG    1       -3.143  -1.573  -1.806  0.00  0.00    +0.043 C 
ATOM     21  C   LIG    1       -1.088  -0.394  -2.553  0.00  0.00    +0.043 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -2.304   0.221  -0.341  0.00  0.00    +0.330 C 
ATOM     23  O   LIG    1       -2.593   0.011   0.835  0.00  0.00    -0.248 OA
BRANCH  22  24
ATOM     24  O   LIG    1       -2.451   1.422  -0.971  0.00  0.00    -0.463 OA
BRANCH  24  26
ATOM     25  C   LIG    1       -1.880   3.206   0.570  0.00  0.00    +0.048 C 
ATOM     26  C   LIG    1       -2.990   2.484  -0.169  0.00  0.00    +0.229 C 
ENDBRANCH  24  26
ENDBRANCH  22  24
ENDBRANCH  19  22
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 6