REMARK  Name = BDB002582
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.103   0.704  -0.344  0.00  0.00    -0.342 N 
ATOM      2  C   LIG    1       -1.159   0.134  -0.354  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -1.830  -0.321  -1.612  0.00  0.00    +0.064 C 
ATOM      4  C   LIG    1       -1.595   0.044   0.968  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1       -0.548   0.576   1.798  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1        0.465   1.013   0.950  0.00  0.00    +0.027 A 
ATOM      7  C   LIG    1        1.751   1.699   1.294  0.00  0.00    +0.064 C 
ENDROOT
BRANCH   4   8
ATOM      8  C   LIG    1       -2.859  -0.538   1.438  0.00  0.00    +0.162 C 
ATOM      9  O   LIG    1       -2.919  -1.123   2.519  0.00  0.00    -0.292 OA
ATOM     10  C   LIG    1       -4.101  -0.412   0.593  0.00  0.00    +0.091 C 
ENDBRANCH   4   8
BRANCH   5  11
ATOM     11  C   LIG    1       -0.497   0.687   3.264  0.00  0.00    +0.162 C 
ATOM     12  O   LIG    1        0.548   0.470   3.881  0.00  0.00    -0.292 OA
ATOM     13  C   LIG    1       -1.728   1.119   4.018  0.00  0.00    +0.091 C 
ENDBRANCH   5  11
BRANCH   1  14
ATOM     14  C   LIG    1        0.926   0.942  -1.529  0.00  0.00    +0.183 C 
BRANCH  14  15
ATOM     15  C   LIG    1        1.709  -0.303  -1.974  0.00  0.00    +0.269 C 
BRANCH  15  17
ATOM     16  C   LIG    1        2.632  -1.281  -3.928  0.00  0.00    +0.197 C 
ATOM     17  O   LIG    1        1.989  -0.142  -3.372  0.00  0.00    -0.353 OA
ENDBRANCH  15  17
BRANCH  15  18
ATOM     18  O   LIG    1        2.931  -0.388  -1.238  0.00  0.00    -0.353 OA
ATOM     19  C   LIG    1        2.964  -1.512  -0.368  0.00  0.00    +0.197 C 
ENDBRANCH  15  18
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 6