REMARK  Name = BDB014262
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.580  -1.098  -0.188  0.00  0.00    +0.059 A 
ATOM      2  N   LIG    1       -1.261  -0.083   0.446  0.00  0.00    -0.353 N 
ATOM      3  H   LIG    1       -0.826   0.703   0.917  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1       -2.618  -0.265   0.334  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1       -2.807  -1.432  -0.398  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1       -4.029  -1.925  -0.706  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -5.070  -1.197  -0.251  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1       -4.975  -0.025   0.482  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -3.710   0.475   0.795  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1       -1.531  -1.948  -0.724  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1        1.432  -2.076   0.891  0.00  0.00    +0.059 C 
ATOM     12  C   LIG    1        0.922  -1.159  -0.219  0.00  0.00    +0.217 C 
BRANCH  12  13
ATOM     13  O   LIG    1        1.378   0.179   0.004  0.00  0.00    -0.483 OA
BRANCH  13  14
ATOM     14  C   LIG    1        2.582   0.568  -0.512  0.00  0.00    +0.121 A 
ATOM     15  C   LIG    1        3.517  -0.249  -1.147  0.00  0.00    +0.045 A 
ATOM     16  C   LIG    1        4.717   0.292  -1.622  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        4.988   1.649  -1.463  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        4.061   2.469  -0.826  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        2.865   1.928  -0.352  0.00  0.00    +0.045 A 
ENDBRANCH  13  14
ENDBRANCH  12  13
ENDBRANCH   1  12
BRANCH   9  20
ATOM     20  C   LIG    1       -3.592   1.720   1.574  0.00  0.00    +0.339 C 
ATOM     21  O   LIG    1       -4.524   2.385   1.987  0.00  0.00    -0.245 OA
BRANCH  20  22
ATOM     22  O   LIG    1       -2.317   2.084   1.809  0.00  0.00    -0.477 OA
ATOM     23  H   LIG    1       -2.411   2.913   2.326  0.00  0.00    +0.295 HD
ENDBRANCH  20  22
ENDBRANCH   9  20
TORSDOF 5