REMARK  Name = BDB034330
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.954   0.699   0.970  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -2.186  -0.047   0.703  0.00  0.00    -0.343 N 
ATOM      3  H   LIG    1       -2.122  -0.572  -0.164  0.00  0.00    +0.146 HD
BRANCH   2   4
ATOM      4  C   LIG    1       -3.466   0.492   0.909  0.00  0.00    +0.038 A 
ATOM      5  C   LIG    1       -4.624  -0.197   0.436  0.00  0.00    +0.021 A 
ATOM      6  C   LIG    1       -5.890   0.380   0.692  0.00  0.00    +0.073 A 
ATOM      7  C   LIG    1       -7.035  -0.249   0.223  0.00  0.00    +0.040 A 
ATOM      8  C   LIG    1       -6.992  -1.454  -0.495  0.00  0.00    +0.057 A 
ATOM      9  C   LIG    1       -5.751  -2.046  -0.725  0.00  0.00    +0.013 A 
ATOM     10  N   LIG    1       -6.053   1.514   1.383  0.00  0.00    -0.255 NA
ATOM     11  C   LIG    1       -4.952   2.108   1.876  0.00  0.00    +0.113 A 
ATOM     12  C   LIG    1       -4.586  -1.427  -0.268  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -3.667   1.638   1.681  0.00  0.00    +0.043 A 
BRANCH   8  14
ATOM     14  C   LIG    1       -8.267  -2.109  -0.958  0.00  0.00    +0.417 C 
ATOM     15  F   LIG    1       -8.086  -2.935  -2.027  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1       -9.220  -1.214  -1.342  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1       -8.839  -2.874   0.011  0.00  0.00    -0.166 F 
ENDBRANCH   8  14
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1       -0.695   1.744  -0.117  0.00  0.00    +0.034 C 
BRANCH  18  19
ATOM     19  C   LIG    1        0.554   2.584   0.161  0.00  0.00    +0.083 C 
BRANCH  19  20
ATOM     20  N   LIG    1        1.786   1.810   0.298  0.00  0.00    -0.312 NA
ATOM     21  H   LIG    1        2.529   2.419   0.645  0.00  0.00    +0.122 HD
BRANCH  20  22
ATOM     22  C   LIG    1        2.239   1.233  -0.970  0.00  0.00    +0.116 C 
BRANCH  22  28
ATOM     23  C   LIG    1        8.512  -1.224  -0.605  0.00  0.00    +0.149 C 
ATOM     24  N   LIG    1        7.152  -1.458  -0.175  0.00  0.00    -0.350 N 
ATOM     25  C   LIG    1        6.074  -0.656  -0.490  0.00  0.00    +0.049 A 
ATOM     26  C   LIG    1        4.954  -1.229   0.117  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        3.699  -0.608  -0.042  0.00  0.00    +0.015 A 
ATOM     28  C   LIG    1        3.586   0.570  -0.804  0.00  0.00    -0.033 A 
ATOM     29  C   LIG    1        4.731   1.120  -1.392  0.00  0.00    +0.007 A 
ATOM     30  C   LIG    1        5.394  -2.394   0.803  0.00  0.00    +0.027 A 
ATOM     31  C   LIG    1        5.987   0.520  -1.249  0.00  0.00    +0.027 A 
ATOM     32  C   LIG    1        6.751  -2.510   0.605  0.00  0.00    +0.086 A 
ENDBRANCH  22  28
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 8