REMARK  Name = BDB065022
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.746   0.363   0.067  0.00  0.00    -0.018 A 
ATOM      2  C   LIG    1        1.887   0.244  -1.034  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1        0.508   0.063  -0.865  0.00  0.00    +0.027 A 
ATOM      4  C   LIG    1       -0.048  -0.001   0.419  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1        0.802   0.119   1.527  0.00  0.00    +0.027 A 
ATOM      6  C   LIG    1        2.180   0.298   1.348  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  12
ATOM      7  C   LIG    1        9.399   1.661  -1.076  0.00  0.00    +0.068 C 
ATOM      8  C   LIG    1        8.382   0.786  -0.444  0.00  0.00    +0.068 A 
ATOM      9  C   LIG    1        6.969   0.929  -0.483  0.00  0.00    +0.023 A 
ATOM     10  C   LIG    1        6.480  -0.139   0.261  0.00  0.00    +0.069 A 
ATOM     11  C   LIG    1        5.107  -0.354   0.462  0.00  0.00    +0.036 A 
ATOM     12  C   LIG    1        4.194   0.550  -0.115  0.00  0.00    -0.016 A 
ATOM     13  C   LIG    1        4.686   1.631  -0.866  0.00  0.00    +0.009 A 
ATOM     14  N   LIG    1        7.594  -0.825   0.676  0.00  0.00    -0.266 N 
ATOM     15  C   LIG    1        7.613  -2.023   1.481  0.00  0.00    +0.173 C 
ATOM     16  C   LIG    1        6.061   1.834  -1.058  0.00  0.00    +0.012 A 
ATOM     17  N   LIG    1        8.757  -0.287   0.263  0.00  0.00    -0.176 NA
ENDBRANCH   1  12
BRANCH   4  18
ATOM     18  N   LIG    1       -1.451  -0.185   0.596  0.00  0.00    -0.304 N 
ATOM     19  C   LIG    1       -2.412  -0.320  -0.388  0.00  0.00    +0.136 A 
ATOM     20  C   LIG    1       -3.611  -0.476   0.268  0.00  0.00    +0.143 A 
ATOM     21  N   LIG    1       -3.432  -0.442   1.610  0.00  0.00    -0.221 NA
ATOM     22  C   LIG    1       -2.141  -0.268   1.785  0.00  0.00    +0.206 A 
BRANCH  20  23
ATOM     23  N   LIG    1       -4.823  -0.637  -0.358  0.00  0.00    -0.269 N 
ATOM     24  H   LIG    1       -4.800  -0.646  -1.366  0.00  0.00    +0.156 HD
ATOM     25  C   LIG    1       -6.027  -0.819   0.303  0.00  0.00    +0.223 C 
ATOM     26  O   LIG    1       -6.195  -0.908   1.514  0.00  0.00    -0.275 OA
BRANCH  25  27
ATOM     27  C   LIG    1       -7.202  -0.927  -0.667  0.00  0.00    +0.095 C 
ATOM     28  C   LIG    1       -7.507   0.421  -1.319  0.00  0.00    +0.129 C 
ATOM     29  N   LIG    1       -8.683   0.980  -0.595  0.00  0.00    -0.269 N 
ATOM     30  C   LIG    1       -9.053   0.040   0.495  0.00  0.00    +0.117 C 
ATOM     31  C   LIG    1       -8.511  -1.298   0.019  0.00  0.00    +0.034 C 
BRANCH  29  32
ATOM     32  C   LIG    1       -9.029   2.274  -0.614  0.00  0.00    +0.169 C 
ATOM     33  N   LIG    1       -9.319   3.393  -0.646  0.00  0.00    -0.174 NA
ENDBRANCH  29  32
ENDBRANCH  25  27
ENDBRANCH  20  23
ENDBRANCH   4  18
TORSDOF 5