REMARK  Name = BDB042493
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.789  -1.025  -0.050  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.566  -0.531   1.175  0.00  0.00    +0.054 C 
BRANCH   2  11
ATOM      3  O   LIG    1       -5.809  -2.355   0.213  0.00  0.00    -0.267 OA
ATOM      4  C   LIG    1       -5.173  -1.321   0.377  0.00  0.00    +0.259 A 
ATOM      5  C   LIG    1       -5.780   0.028   0.290  0.00  0.00    +0.082 A 
ATOM      6  C   LIG    1       -4.960   1.149   0.501  0.00  0.00    -0.008 A 
ATOM      7  C   LIG    1       -5.515   2.433   0.425  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -6.872   2.598   0.140  0.00  0.00    +0.003 A 
ATOM      9  C   LIG    1       -7.680   1.481  -0.069  0.00  0.00    +0.039 A 
ATOM     10  C   LIG    1       -3.537   0.968   0.800  0.00  0.00    +0.030 A 
ATOM     11  C   LIG    1       -3.018  -0.268   0.862  0.00  0.00    +0.020 A 
ATOM     12  C   LIG    1       -7.133   0.201   0.007  0.00  0.00    +0.136 A 
ATOM     13  F   LIG    1       -7.949  -0.842  -0.201  0.00  0.00    -0.205 F 
ATOM     14  N   LIG    1       -3.823  -1.365   0.661  0.00  0.00    -0.326 N 
ATOM     15  H   LIG    1       -3.433  -2.299   0.711  0.00  0.00    +0.169 HD
ENDBRANCH   2  11
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1        0.689  -1.254   0.298  0.00  0.00    +0.085 C 
BRANCH  16  17
ATOM     17  N   LIG    1        1.435  -1.830  -0.831  0.00  0.00    -0.298 NA
ATOM     18  C   LIG    1        2.677  -2.490  -0.388  0.00  0.00    +0.089 C 
ATOM     19  C   LIG    1        3.727  -1.520   0.186  0.00  0.00    +0.051 C 
ATOM     20  C   LIG    1        3.887  -0.279  -0.664  0.00  0.00    -0.040 C 
ATOM     21  C   LIG    1        2.968   0.008  -1.607  0.00  0.00    -0.007 C 
ATOM     22  C   LIG    1        1.754  -0.844  -1.876  0.00  0.00    +0.112 C 
BRANCH  20  23
ATOM     23  C   LIG    1        5.058   0.588  -0.426  0.00  0.00    -0.004 A 
ATOM     24  C   LIG    1        5.771   1.178  -1.473  0.00  0.00    +0.122 A 
ATOM     25  N   LIG    1        6.859   1.972  -1.323  0.00  0.00    -0.227 NA
ATOM     26  C   LIG    1        7.270   2.187  -0.059  0.00  0.00    +0.213 A 
ATOM     27  F   LIG    1        8.344   2.969   0.121  0.00  0.00    -0.184 F 
ATOM     28  C   LIG    1        6.652   1.649   1.054  0.00  0.00    +0.060 A 
ATOM     29  C   LIG    1        5.534   0.837   0.866  0.00  0.00    +0.014 A 
ENDBRANCH  20  23
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 5