REMARK  Name = BDB059793
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.371  -1.308  -0.727  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.464  -1.676  -1.670  0.00  0.00    +0.013 A 
ATOM      3  C   LIG    1       -0.904  -1.400  -1.485  0.00  0.00    +0.009 A 
ATOM      4  C   LIG    1       -1.344  -0.757  -0.354  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1       -0.396  -0.402   0.578  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        0.946  -0.668   0.407  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -2.721  -0.406  -0.081  0.00  0.00    -0.018 A 
ATOM      8  C   LIG    1       -3.189  -0.324   1.240  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1       -4.486   0.043   1.488  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1       -5.372   0.342   0.472  0.00  0.00    -0.018 A 
ATOM     11  C   LIG    1       -4.929   0.264  -0.828  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1       -3.609  -0.109  -1.093  0.00  0.00    +0.009 A 
BRANCH  10  13
ATOM     13  C   LIG    1       -6.726   0.752   0.825  0.00  0.00    -0.018 A 
ATOM     14  C   LIG    1       -7.345   0.255   1.954  0.00  0.00    +0.008 A 
ATOM     15  C   LIG    1       -8.614   0.637   2.329  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -9.328   1.546   1.577  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -8.740   2.062   0.442  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -7.447   1.664   0.074  0.00  0.00    +0.008 A 
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  21
ATOM     19  N   LIG    1        3.690  -0.634  -0.299  0.00  0.00    -0.281 N 
ATOM     20  H   LIG    1        3.262   0.171   0.292  0.00  0.00    +0.155 HD
ATOM     21  C   LIG    1        2.791  -1.529  -0.922  0.00  0.00    +0.248 C 
ATOM     22  O   LIG    1        3.147  -2.477  -1.620  0.00  0.00    -0.270 OA
BRANCH  19  25
ATOM     23  C   LIG    1        7.162   0.605  -0.122  0.00  0.00    +0.040 A 
ATOM     24  C   LIG    1        5.794   0.511  -0.064  0.00  0.00    +0.036 A 
ATOM     25  C   LIG    1        5.094  -0.663  -0.359  0.00  0.00    +0.034 A 
ATOM     26  C   LIG    1        5.829  -1.734  -0.712  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1        7.234  -1.684  -0.784  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1        7.877  -0.502  -0.484  0.00  0.00    +0.013 A 
BRANCH  23  30
ATOM     29  O   LIG    1        7.656   2.217   1.423  0.00  0.00    -0.268 OA
ATOM     30  C   LIG    1        7.847   1.906   0.194  0.00  0.00    +0.267 C 
ATOM     31  N   LIG    1        8.537   2.565  -0.768  0.00  0.00    -0.193 N 
ATOM     32  H   LIG    1        8.852   3.565   0.106  0.00  0.00    +0.183 HD
BRANCH  31  33
ATOM     33  O   LIG    1        9.178   3.178  -1.664  0.00  0.00    -0.295 OA
ATOM     34  H   LIG    1        9.579   2.592  -2.341  0.00  0.00    +0.241 HD
ENDBRANCH  31  33
ENDBRANCH  23  30
ENDBRANCH  19  25
ENDBRANCH   1  21
TORSDOF 6