REMARK  Name = BDB026644
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.527  -1.500   0.540  0.00  0.00    -0.284 N 
ATOM      2  H   LIG    1        1.198  -0.757   0.704  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        0.931  -2.797   0.812  0.00  0.00    +0.237 C 
ATOM      4  O   LIG    1        0.248  -3.808   0.657  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   1   8
ATOM      5  C   LIG    1       -3.113  -0.043  -1.131  0.00  0.00    +0.019 A 
ATOM      6  C   LIG    1       -2.933  -1.418  -0.899  0.00  0.00    +0.013 A 
ATOM      7  C   LIG    1       -1.749  -1.929  -0.347  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1       -0.701  -1.077  -0.011  0.00  0.00    +0.033 A 
ATOM      9  C   LIG    1       -0.859   0.294  -0.231  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -2.045   0.801  -0.780  0.00  0.00    +0.013 A 
BRANCH   5  14
ATOM     11  C   LIG    1       -5.752   3.789  -2.513  0.00  0.00    +0.066 C 
ATOM     12  C   LIG    1       -5.621   2.303  -2.378  0.00  0.00    +0.042 A 
ATOM     13  N   LIG    1       -4.480   1.829  -1.837  0.00  0.00    -0.233 NA
ATOM     14  C   LIG    1       -4.360   0.489  -1.718  0.00  0.00    +0.160 A 
ATOM     15  N   LIG    1       -5.305  -0.392  -2.103  0.00  0.00    -0.236 NA
ATOM     16  C   LIG    1       -6.425   0.125  -2.636  0.00  0.00    +0.115 A 
ATOM     17  C   LIG    1       -6.640   1.473  -2.797  0.00  0.00    +0.043 A 
ENDBRANCH   5  14
ENDBRANCH   1   8
BRANCH   3  18
ATOM     18  C   LIG    1        2.315  -2.930   1.429  0.00  0.00    +0.219 C 
BRANCH  18  19
ATOM     19  N   LIG    1        3.275  -1.954   0.952  0.00  0.00    -0.325 N 
ATOM     20  C   LIG    1        3.808  -0.901   1.642  0.00  0.00    +0.042 A 
ATOM     21  C   LIG    1        3.594  -0.501   3.056  0.00  0.00    +0.055 C 
ATOM     22  C   LIG    1        4.646   0.556   3.460  0.00  0.00    +0.006 C 
ATOM     23  C   LIG    1        4.885   1.613   2.361  0.00  0.00    +0.007 C 
ATOM     24  C   LIG    1        5.374   0.988   1.038  0.00  0.00    +0.057 C 
ATOM     25  C   LIG    1        4.589  -0.232   0.726  0.00  0.00    +0.062 A 
ATOM     26  N   LIG    1        4.560  -0.852  -0.489  0.00  0.00    -0.240 NA
ATOM     27  C   LIG    1        3.775  -1.895  -0.323  0.00  0.00    +0.200 A 
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 4