REMARK  Name = BDB014408
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.125   0.290  -0.039  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        0.772   0.425   1.079  0.00  0.00    -0.389 OA
ATOM      3  H   LIG    1        0.369  -0.054   1.818  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1        0.579   0.830  -1.290  0.00  0.00    +0.136 C 
BRANCH   4   7
ATOM      5  O   LIG    1        2.117   1.118  -3.602  0.00  0.00    -0.276 OA
ATOM      6  C   LIG    1        2.522   0.378  -2.711  0.00  0.00    +0.213 C 
ATOM      7  N   LIG    1        1.803   0.096  -1.574  0.00  0.00    -0.313 N 
ATOM      8  H   LIG    1        2.325  -0.219  -0.760  0.00  0.00    +0.149 HD
BRANCH   6   9
ATOM      9  C   LIG    1        3.878  -0.290  -2.784  0.00  0.00    +0.100 C 
BRANCH   9  10
ATOM     10  C   LIG    1        4.923   0.441  -1.941  0.00  0.00    +0.044 C 
BRANCH  10  11
ATOM     11  C   LIG    1        5.005  -0.069  -0.520  0.00  0.00    -0.047 A 
ATOM     12  C   LIG    1        4.441   0.656   0.537  0.00  0.00    +0.003 A 
ATOM     13  C   LIG    1        4.500   0.164   1.840  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1        5.132  -1.049   2.101  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        5.706  -1.774   1.059  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        5.641  -1.288  -0.246  0.00  0.00    +0.003 A 
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   4   7
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  C   LIG    1       -1.427   1.065   0.260  0.00  0.00    +0.117 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -2.474   0.883  -0.757  0.00  0.00    -0.295 NA
ATOM     19  C   LIG    1       -3.173  -0.411  -0.637  0.00  0.00    +0.120 C 
ATOM     20  C   LIG    1       -4.187  -0.488   0.486  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1       -4.768   0.679   1.015  0.00  0.00    -0.042 A 
ATOM     22  C   LIG    1       -5.739   0.579   2.020  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -6.146  -0.671   2.484  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -5.582  -1.829   1.954  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -4.305   2.035   0.550  0.00  0.00    +0.051 C 
ATOM     26  C   LIG    1       -4.612  -1.741   0.957  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -3.471   1.967  -0.737  0.00  0.00    +0.089 C 
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8