REMARK  Name = BDB065319
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.644   0.612   0.179  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.686   1.619  -0.780  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.124   2.684  -0.697  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.565   1.528  -1.854  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.429   0.435  -1.954  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        2.434  -0.567  -0.969  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        1.523  -0.475   0.094  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  14
ATOM      8  C   LIG    1       -5.797   0.591   1.157  0.00  0.00    +0.136 A 
ATOM      9  N   LIG    1       -4.442   0.428   1.031  0.00  0.00    -0.309 N 
ATOM     10  C   LIG    1       -3.633  -0.080  -0.059  0.00  0.00    +0.104 C 
ATOM     11  C   LIG    1       -2.325   0.727  -0.117  0.00  0.00    +0.133 C 
ATOM     12  N   LIG    1       -1.629   0.738   1.179  0.00  0.00    -0.288 N 
ATOM     13  C   LIG    1       -2.410   1.066   2.380  0.00  0.00    +0.184 C 
ATOM     14  C   LIG    1       -0.246   0.704   1.348  0.00  0.00    +0.250 C 
ATOM     15  O   LIG    1        0.294   0.702   2.453  0.00  0.00    -0.270 OA
ATOM     16  C   LIG    1       -3.345  -1.574   0.110  0.00  0.00    +0.032 C 
ATOM     17  C   LIG    1       -3.877   0.938   2.174  0.00  0.00    +0.151 A 
ATOM     18  N   LIG    1       -4.837   1.306   2.991  0.00  0.00    -0.133 NA
ATOM     19  N   LIG    1       -6.033   1.087   2.358  0.00  0.00    -0.134 NA
BRANCH   8  21
ATOM     20  C   LIG    1       -6.851   1.361  -0.984  0.00  0.00    +0.015 C 
ATOM     21  C   LIG    1       -6.870   0.329   0.142  0.00  0.00    +0.051 C 
ATOM     22  C   LIG    1       -6.877  -1.097  -0.398  0.00  0.00    +0.015 C 
ENDBRANCH   8  21
ENDBRANCH   1  14
BRANCH   6  23
ATOM     23  C   LIG    1        3.380  -1.744  -1.060  0.00  0.00    +0.093 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.829  -1.341  -1.308  0.00  0.00    +0.074 A 
ATOM     25  C   LIG    1        5.656  -0.805  -0.197  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1        6.968  -0.445  -0.499  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1        7.814   0.072   0.491  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1        7.341   0.230   1.792  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        6.030  -0.129   2.102  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        7.461  -0.612  -1.875  0.00  0.00    +0.272 A 
ATOM     31  O   LIG    1        8.607  -0.311  -2.187  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1        6.564  -1.123  -2.780  0.00  0.00    -0.242 N 
ATOM     33  H   LIG    1        6.889  -1.249  -3.734  0.00  0.00    +0.192 HD
ATOM     34  C   LIG    1        5.187  -0.647   1.113  0.00  0.00    +0.010 A 
ATOM     35  N   LIG    1        5.278  -1.481  -2.522  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   6  23
TORSDOF 4