REMARK  Name = BDB029620
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.433  -1.611   0.335  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1  11
ATOM      2  C   LIG    1        5.825   0.377   0.419  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1        5.614  -0.607  -0.691  0.00  0.00    +0.252 A 
ATOM      4  O   LIG    1        6.529  -0.950  -1.434  0.00  0.00    -0.268 OA
ATOM      5  N   LIG    1        4.352  -1.113  -0.843  0.00  0.00    -0.322 N 
ATOM      6  H   LIG    1        4.228  -1.772  -1.600  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1        3.272  -0.771  -0.023  0.00  0.00    +0.049 A 
ATOM      8  C   LIG    1        3.468   0.139   1.021  0.00  0.00    -0.001 A 
ATOM      9  C   LIG    1        2.392   0.482   1.842  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1        1.131  -0.081   1.617  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1        0.931  -0.990   0.567  0.00  0.00    -0.031 A 
ATOM     12  C   LIG    1        2.018  -1.337  -0.250  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.800   0.708   1.225  0.00  0.00    +0.019 A 
BRANCH   2  15
ATOM     14  C   LIG    1        7.538   2.017  -0.411  0.00  0.00    +0.009 C 
ATOM     15  C   LIG    1        7.214   0.924   0.598  0.00  0.00    +0.037 C 
ENDBRANCH   2  15
ENDBRANCH   1  11
BRANCH   1  16
ATOM     16  N   LIG    1       -0.909  -1.465  -1.050  0.00  0.00    -0.295 NA
ATOM     17  C   LIG    1       -1.223  -0.060  -1.403  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1       -2.486   0.532  -0.734  0.00  0.00    +0.122 C 
ATOM     19  N   LIG    1       -3.657  -0.342  -0.955  0.00  0.00    -0.313 N 
ATOM     20  C   LIG    1       -3.409  -1.754  -0.591  0.00  0.00    +0.122 C 
ATOM     21  C   LIG    1       -2.127  -2.278  -1.281  0.00  0.00    +0.103 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -4.845   0.168  -0.404  0.00  0.00    +0.121 A 
ATOM     23  N   LIG    1       -5.519  -0.548   0.524  0.00  0.00    -0.239 NA
ATOM     24  C   LIG    1       -6.673  -0.041   1.026  0.00  0.00    +0.131 A 
ATOM     25  C   LIG    1       -7.215   1.172   0.643  0.00  0.00    +0.070 A 
ATOM     26  C   LIG    1       -6.533   1.905  -0.320  0.00  0.00    +0.024 A 
ATOM     27  C   LIG    1       -5.344   1.396  -0.848  0.00  0.00    +0.045 A 
BRANCH  25  28
ATOM     28  C   LIG    1       -8.434   1.641   1.217  0.00  0.00    +0.101 C 
ATOM     29  N   LIG    1       -9.424   2.023   1.687  0.00  0.00    -0.191 NA
ENDBRANCH  25  28
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 5