REMARK  Name = BDB042523
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.788   0.217  -0.023  0.00  0.00    -0.041 C 
ATOM      2  C   LIG    1        2.524   0.590   0.709  0.00  0.00    +0.054 C 
ATOM      3  C   LIG    1        1.471  -0.517   0.630  0.00  0.00    +0.113 C 
ATOM      4  N   LIG    1        1.327  -1.028  -0.735  0.00  0.00    -0.297 N 
ATOM      5  C   LIG    1        0.124  -1.472  -1.278  0.00  0.00    +0.216 C 
ATOM      6  O   LIG    1        0.083  -2.147  -2.306  0.00  0.00    -0.276 OA
ATOM      7  C   LIG    1        2.542  -1.517  -1.377  0.00  0.00    +0.135 C 
ATOM      8  C   LIG    1        3.763  -0.746  -0.963  0.00  0.00    -0.004 C 
ENDROOT
BRANCH   1  11
ATOM      9  C   LIG    1        7.424   0.966   0.788  0.00  0.00    +0.055 A 
ATOM     10  C   LIG    1        6.249   0.271   0.464  0.00  0.00    +0.027 A 
ATOM     11  C   LIG    1        5.028   0.950   0.303  0.00  0.00    -0.018 A 
ATOM     12  C   LIG    1        5.010   2.338   0.486  0.00  0.00    +0.046 A 
ATOM     13  C   LIG    1        6.182   3.019   0.807  0.00  0.00    +0.125 A 
ATOM     14  F   LIG    1        6.144   4.347   0.971  0.00  0.00    -0.205 F 
ATOM     15  C   LIG    1        7.388   2.349   0.959  0.00  0.00    +0.057 A 
BRANCH   9  17
ATOM     16  N   LIG    1        9.654  -0.325   1.075  0.00  0.00    -0.191 NA
ATOM     17  C   LIG    1        8.657   0.254   0.947  0.00  0.00    +0.099 C 
ENDBRANCH   9  17
ENDBRANCH   1  11
BRANCH   5  18
ATOM     18  C   LIG    1       -1.149  -1.073  -0.551  0.00  0.00    +0.102 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.399  -1.539  -1.302  0.00  0.00    +0.062 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -3.664  -1.100  -0.608  0.00  0.00    +0.020 A 
ATOM     21  N   LIG    1       -3.999  -1.751   0.556  0.00  0.00    -0.326 N 
ATOM     22  H   LIG    1       -3.416  -2.502   0.907  0.00  0.00    +0.169 HD
ATOM     23  C   LIG    1       -5.116  -1.489   1.323  0.00  0.00    +0.259 A 
ATOM     24  O   LIG    1       -5.326  -2.118   2.352  0.00  0.00    -0.267 OA
ATOM     25  C   LIG    1       -6.014  -0.419   0.827  0.00  0.00    +0.082 A 
ATOM     26  C   LIG    1       -5.678   0.240  -0.367  0.00  0.00    -0.008 A 
ATOM     27  C   LIG    1       -6.515   1.252  -0.855  0.00  0.00    +0.009 A 
ATOM     28  C   LIG    1       -7.675   1.603  -0.160  0.00  0.00    +0.003 A 
ATOM     29  C   LIG    1       -8.002   0.945   1.026  0.00  0.00    +0.039 A 
ATOM     30  C   LIG    1       -7.172  -0.062   1.515  0.00  0.00    +0.136 A 
ATOM     31  F   LIG    1       -7.526  -0.666   2.658  0.00  0.00    -0.205 F 
ATOM     32  C   LIG    1       -4.459  -0.132  -1.090  0.00  0.00    +0.030 A 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   5  18
TORSDOF 5