REMARK  Name = BDB034436
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.671  -0.098  -0.130  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -3.867  -1.391  -0.644  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1       -2.862  -2.113  -1.277  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1       -1.584  -1.529  -1.421  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1       -0.589  -2.299  -2.080  0.00  0.00    +0.038 A 
ATOM      6  C   LIG    1       -0.896  -3.590  -2.507  0.00  0.00    +0.043 A 
ATOM      7  C   LIG    1       -2.178  -4.059  -2.315  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1       -1.375  -0.230  -0.901  0.00  0.00    +0.012 A 
ATOM      9  N   LIG    1       -3.155  -3.348  -1.718  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1       -2.403   0.471  -0.267  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1       -6.875   2.031   1.804  0.00  0.00    +0.120 A 
ATOM     12  C   LIG    1       -5.639   1.883   2.433  0.00  0.00    +0.046 A 
ATOM     13  C   LIG    1       -4.597   1.192   1.808  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1       -4.766   0.630   0.534  0.00  0.00    -0.018 A 
ATOM     15  C   LIG    1       -6.015   0.787  -0.088  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1       -7.060   1.480   0.537  0.00  0.00    +0.046 A 
BRANCH  11  18
ATOM     17  C   LIG    1       -9.093   2.873   1.937  0.00  0.00    +0.277 C 
ATOM     18  O   LIG    1       -7.806   2.728   2.523  0.00  0.00    -0.495 OA
ENDBRANCH  11  18
ENDBRANCH   1  14
BRANCH   5  19
ATOM     19  N   LIG    1        0.752  -1.854  -2.252  0.00  0.00    -0.343 N 
ATOM     20  H   LIG    1        0.747  -0.840  -2.360  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1        1.579  -2.196  -1.085  0.00  0.00    +0.103 C 
BRANCH  21  22
ATOM     22  C   LIG    1        3.042  -1.820  -1.328  0.00  0.00    +0.034 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.293  -0.335  -1.617  0.00  0.00    +0.083 C 
BRANCH  23  24
ATOM     24  N   LIG    1        2.676   0.604  -0.676  0.00  0.00    -0.312 NA
ATOM     25  H   LIG    1        2.783   1.549  -1.046  0.00  0.00    +0.122 HD
BRANCH  24  26
ATOM     26  C   LIG    1        3.267   0.569   0.669  0.00  0.00    +0.120 C 
BRANCH  26  27
ATOM     27  C   LIG    1        4.643   1.196   0.748  0.00  0.00    +0.011 A 
ATOM     28  C   LIG    1        5.809   0.423   0.928  0.00  0.00    +0.125 A 
ATOM     29  C   LIG    1        7.058   1.056   0.986  0.00  0.00    +0.049 A 
ATOM     30  C   LIG    1        7.155   2.445   0.869  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1        6.006   3.200   0.693  0.00  0.00    +0.124 A 
ATOM     32  F   LIG    1        6.100   4.531   0.581  0.00  0.00    -0.205 F 
ATOM     33  C   LIG    1        4.758   2.594   0.633  0.00  0.00    +0.046 A 
BRANCH  28  34
ATOM     34  O   LIG    1        5.623  -0.930   1.035  0.00  0.00    -0.495 OA
ATOM     35  C   LIG    1        6.774  -1.744   1.216  0.00  0.00    +0.277 C 
ENDBRANCH  28  34
ENDBRANCH  26  27
ENDBRANCH  24  26
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   5  19
TORSDOF 10