REMARK  Name = BDB030263
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.344   1.593   0.824  0.00  0.00    +0.267 C 
ATOM      2  N   LIG    1        0.870   1.161   1.347  0.00  0.00    -0.296 N 
ATOM      3  C   LIG    1        1.858   2.147   1.754  0.00  0.00    +0.112 C 
ATOM      4  C   LIG    1        3.024   1.344   2.236  0.00  0.00    +0.021 C 
ATOM      5  C   LIG    1        3.815   0.411   1.341  0.00  0.00    +0.047 C 
ATOM      6  C   LIG    1        2.657  -0.100   2.175  0.00  0.00    +0.021 C 
ATOM      7  C   LIG    1        1.249  -0.203   1.676  0.00  0.00    +0.112 C 
ATOM      8  O   LIG    1       -0.562   2.798   0.671  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   1  13
ATOM      9  C   LIG    1       -3.322  -0.241  -0.304  0.00  0.00    +0.039 A 
ATOM     10  N   LIG    1       -2.466  -1.205   0.147  0.00  0.00    -0.281 N 
ATOM     11  H   LIG    1       -2.617  -2.208   0.172  0.00  0.00    +0.189 HD
ATOM     12  N   LIG    1       -1.298  -0.729   0.605  0.00  0.00    -0.169 NA
ATOM     13  C   LIG    1       -1.388   0.607   0.453  0.00  0.00    +0.147 A 
ATOM     14  C   LIG    1       -2.651   0.946  -0.117  0.00  0.00    +0.057 A 
BRANCH   9  16
ATOM     15  C   LIG    1       -5.583  -1.188   0.182  0.00  0.00    +0.014 C 
ATOM     16  C   LIG    1       -4.680  -0.531  -0.862  0.00  0.00    +0.031 C 
ATOM     17  C   LIG    1       -4.593  -1.389  -2.125  0.00  0.00    +0.014 C 
ENDBRANCH   9  16
ENDBRANCH   1  13
BRANCH   5  18
ATOM     18  C   LIG    1        3.759   0.531  -0.118  0.00  0.00    +0.068 C 
ATOM     19  C   LIG    1        3.546  -0.605  -1.009  0.00  0.00    +0.084 C 
ATOM     20  C   LIG    1        3.544   0.056  -2.353  0.00  0.00    +0.214 C 
ATOM     21  O   LIG    1        3.895   1.446  -2.141  0.00  0.00    -0.390 OA
ATOM     22  C   LIG    1        4.578  -0.986  -2.039  0.00  0.00    +0.061 C 
ATOM     23  N   LIG    1        3.963   1.657  -0.726  0.00  0.00    -0.093 NA
ENDBRANCH   5  18
TORSDOF 3