REMARK  Name = BDB035163
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.016   0.276  -0.912  0.00  0.00    +0.201 A 
ATOM      2  N   LIG    1       -2.850   0.035  -0.308  0.00  0.00    -0.143 NA
ATOM      3  N   LIG    1       -1.947   0.606  -1.147  0.00  0.00    -0.216 N 
ATOM      4  C   LIG    1       -2.635   1.164  -2.226  0.00  0.00    +0.157 A 
ATOM      5  C   LIG    1       -1.879   1.817  -3.235  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1       -0.541   1.878  -3.122  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1        0.155   1.289  -1.990  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1       -0.543   0.662  -1.017  0.00  0.00    +0.049 A 
ATOM      9  N   LIG    1       -3.924   0.966  -2.090  0.00  0.00    -0.205 NA
ENDROOT
BRANCH   1  12
ATOM     10  C   LIG    1       -6.961   0.781  -2.148  0.00  0.00    +0.048 C 
ATOM     11  C   LIG    1       -6.631   0.075  -0.888  0.00  0.00    -0.002 A 
ATOM     12  C   LIG    1       -5.388  -0.173  -0.328  0.00  0.00    +0.111 A 
ATOM     13  N   LIG    1       -5.620  -0.873   0.831  0.00  0.00    -0.258 N 
ATOM     14  N   LIG    1       -6.941  -1.044   1.081  0.00  0.00    -0.178 NA
ATOM     15  C   LIG    1       -7.541  -0.484   0.033  0.00  0.00    +0.138 A 
BRANCH  13  16
ATOM     16  C   LIG    1       -4.647  -1.397   1.787  0.00  0.00    +0.102 C 
ATOM     17  C   LIG    1       -4.319  -0.352   2.852  0.00  0.00    +0.032 C 
ATOM     18  C   LIG    1       -5.096  -2.710   2.440  0.00  0.00    +0.032 C 
ENDBRANCH  13  16
ENDBRANCH   1  12
BRANCH   8  19
ATOM     19  C   LIG    1        0.037   0.007   0.216  0.00  0.00    +0.090 C 
BRANCH  19  20
ATOM     20  C   LIG    1        1.545   0.036   0.341  0.00  0.00    -0.042 A 
ATOM     21  C   LIG    1        2.325  -0.989  -0.211  0.00  0.00    +0.005 A 
ATOM     22  C   LIG    1        3.720  -0.944  -0.123  0.00  0.00    +0.012 A 
ATOM     23  C   LIG    1        4.358   0.121   0.523  0.00  0.00    +0.017 A 
ATOM     24  C   LIG    1        3.578   1.156   1.054  0.00  0.00    +0.012 A 
ATOM     25  C   LIG    1        2.184   1.113   0.970  0.00  0.00    +0.005 A 
BRANCH  23  26
ATOM     26  C   LIG    1        5.816   0.201   0.621  0.00  0.00    +0.141 A 
ATOM     27  N   LIG    1        6.645  -0.786   1.112  0.00  0.00    -0.333 N 
ATOM     28  C   LIG    1        6.247  -2.051   1.684  0.00  0.00    +0.150 C 
ATOM     29  C   LIG    1        7.937  -0.340   1.033  0.00  0.00    +0.119 A 
ATOM     30  C   LIG    1        7.865   0.942   0.520  0.00  0.00    +0.162 A 
ATOM     31  N   LIG    1        6.534   1.260   0.289  0.00  0.00    -0.224 NA
BRANCH  30  32
ATOM     32  C   LIG    1        8.981   1.904   0.236  0.00  0.00    +0.436 C 
ATOM     33  F   LIG    1       10.194   1.388   0.583  0.00  0.00    -0.164 F 
ATOM     34  F   LIG    1        8.851   3.069   0.925  0.00  0.00    -0.164 F 
ATOM     35  F   LIG    1        9.066   2.226  -1.081  0.00  0.00    -0.164 F 
ENDBRANCH  30  32
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH   8  19
TORSDOF 6