REMARK  Name = BDB042484
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.238   0.197  -1.499  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.664   0.202  -0.029  0.00  0.00    +0.054 C 
BRANCH   2  10
ATOM      3  C   LIG    1       -6.191   2.721   1.283  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1       -6.474   1.267   1.021  0.00  0.00    -0.040 A 
ATOM      5  C   LIG    1       -5.462   0.353   0.652  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -5.808  -0.995   0.423  0.00  0.00    +0.049 A 
ATOM      7  C   LIG    1       -4.750  -1.962   0.037  0.00  0.00    +0.257 A 
ATOM      8  N   LIG    1       -3.475  -1.460  -0.077  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1       -2.768  -2.138  -0.339  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1       -3.123  -0.149   0.136  0.00  0.00    +0.020 A 
ATOM     11  O   LIG    1       -5.000  -3.144  -0.170  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -7.125  -1.441   0.554  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1       -8.104  -0.533   0.916  0.00  0.00    +0.124 A 
ATOM     14  F   LIG    1       -9.372  -0.945   1.045  0.00  0.00    -0.205 F 
ATOM     15  C   LIG    1       -4.054   0.750   0.495  0.00  0.00    +0.030 A 
ATOM     16  C   LIG    1       -7.795   0.803   1.149  0.00  0.00    +0.042 A 
ENDBRANCH   2  10
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1        0.203   0.663  -1.753  0.00  0.00    +0.085 C 
BRANCH  17  18
ATOM     18  N   LIG    1        1.199  -0.246  -1.174  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1        1.657   0.160   0.175  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        3.083   0.758   0.268  0.00  0.00    +0.120 C 
ATOM     21  N   LIG    1        4.081  -0.143  -0.327  0.00  0.00    -0.327 N 
ATOM     22  C   LIG    1        3.602  -1.024  -1.405  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        2.351  -0.424  -2.086  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        5.409  -0.129   0.062  0.00  0.00    +0.030 A 
ATOM     25  C   LIG    1        5.971   0.962   0.747  0.00  0.00    +0.024 A 
ATOM     26  C   LIG    1        7.316   0.980   1.143  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        8.143  -0.105   0.863  0.00  0.00    +0.052 A 
ATOM     28  C   LIG    1        7.615  -1.203   0.187  0.00  0.00    +0.020 A 
ATOM     29  C   LIG    1        6.269  -1.208  -0.204  0.00  0.00    +0.024 A 
BRANCH  27  30
ATOM     30  C   LIG    1        9.518  -0.092   1.266  0.00  0.00    +0.099 C 
ATOM     31  N   LIG    1       10.632  -0.080   1.592  0.00  0.00    -0.191 NA
ENDBRANCH  27  30
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 6