REMARK  Name = BDB034304
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.972   0.238   2.366  0.00  0.00    -0.343 N 
ATOM      2  H   LIG    1        0.400   0.542   1.576  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        2.335   0.527   2.082  0.00  0.00    +0.038 A 
ATOM      4  C   LIG    1        2.888   0.469   0.775  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        4.269   0.739   0.647  0.00  0.00    +0.073 A 
ATOM      6  C   LIG    1        4.850   0.704  -0.613  0.00  0.00    +0.040 A 
ATOM      7  C   LIG    1        4.118   0.396  -1.772  0.00  0.00    +0.057 A 
ATOM      8  C   LIG    1        2.755   0.126  -1.648  0.00  0.00    +0.013 A 
ATOM      9  N   LIG    1        5.061   1.023   1.693  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1        4.505   1.042   2.922  0.00  0.00    +0.113 A 
ATOM     11  C   LIG    1        2.149   0.158  -0.392  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1        3.171   0.793   3.165  0.00  0.00    +0.043 A 
BRANCH   7  13
ATOM     13  C   LIG    1        4.794   0.391  -3.118  0.00  0.00    +0.417 C 
ATOM     14  F   LIG    1        6.075  -0.068  -3.073  0.00  0.00    -0.166 F 
ATOM     15  F   LIG    1        4.859   1.634  -3.669  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1        4.154  -0.389  -4.035  0.00  0.00    -0.166 F 
ENDBRANCH   7  13
ENDBRANCH   1   3
BRANCH   1  17
ATOM     17  C   LIG    1        0.755  -1.203   2.553  0.00  0.00    +0.103 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.683  -1.483   2.991  0.00  0.00    +0.034 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.775  -0.898   2.080  0.00  0.00    +0.086 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -1.558  -1.102   0.630  0.00  0.00    -0.302 NA
BRANCH  20  21
ATOM     21  C   LIG    1       -1.747  -2.522   0.264  0.00  0.00    +0.084 C 
BRANCH  21  23
ATOM     22  C   LIG    1       -1.166  -4.339  -1.387  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -1.016  -2.864  -1.041  0.00  0.00    +0.012 C 
ENDBRANCH  21  23
ENDBRANCH  20  21
BRANCH  20  24
ATOM     24  C   LIG    1       -2.485  -0.241  -0.146  0.00  0.00    +0.085 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -1.943   1.194  -0.277  0.00  0.00    +0.021 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -2.844   2.183  -1.067  0.00  0.00    -0.037 C 
ATOM     27  C   LIG    1       -3.081   1.701  -2.508  0.00  0.00    +0.010 C 
ATOM     28  C   LIG    1       -4.199   2.377  -0.367  0.00  0.00    +0.010 C 
ATOM     29  C   LIG    1       -2.123   3.546  -1.123  0.00  0.00    +0.010 C 
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  20  24
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 11