REMARK  Name = BDB061768
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.919  -0.714  -0.430  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.617  -1.921  -1.049  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.453  -2.042  -1.848  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.424  -3.035  -0.841  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.554  -2.933  -0.025  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.898  -1.709   0.576  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1       -2.060  -0.600   0.373  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  13
ATOM      8  N   LIG    1        4.022   0.247   0.259  0.00  0.00    -0.296 NA
ATOM      9  C   LIG    1        3.553   1.453  -0.471  0.00  0.00    +0.071 C 
ATOM     10  C   LIG    1        4.248   2.768  -0.080  0.00  0.00    +0.026 C 
ATOM     11  C   LIG    1        2.013   1.700  -0.369  0.00  0.00    +0.126 C 
ATOM     12  N   LIG    1        1.218   0.491  -0.182  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1       -0.089   0.480  -0.658  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1       -0.619   1.431  -1.228  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        1.733  -0.477   0.791  0.00  0.00    +0.123 C 
ATOM     16  C   LIG    1        3.119  -0.112   1.354  0.00  0.00    +0.103 C 
BRANCH   8  17
ATOM     17  C   LIG    1        5.436   0.185   0.622  0.00  0.00    +0.087 C 
BRANCH  17  19
ATOM     18  C   LIG    1        7.837   0.086  -0.129  0.00  0.00    +0.008 C 
ATOM     19  C   LIG    1        6.380   0.072  -0.598  0.00  0.00    -0.003 C 
ATOM     20  C   LIG    1        6.108  -1.197  -1.411  0.00  0.00    +0.008 C 
ENDBRANCH  17  19
ENDBRANCH   8  17
ENDBRANCH   1  13
BRANCH   6  21
ATOM     21  C   LIG    1       -4.122  -1.626   1.469  0.00  0.00    +0.162 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -4.894  -0.391   1.324  0.00  0.00    -0.289 N 
ATOM     23  C   LIG    1       -5.751  -0.182   0.200  0.00  0.00    +0.059 A 
ATOM     24  C   LIG    1       -6.479   1.009   0.100  0.00  0.00    +0.063 A 
ATOM     25  C   LIG    1       -7.333   1.259  -0.984  0.00  0.00    +0.015 A 
ATOM     26  C   LIG    1       -7.468   0.310  -1.991  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -6.753  -0.882  -1.912  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1       -6.346   2.021   1.158  0.00  0.00    +0.262 A 
ATOM     29  O   LIG    1       -6.974   3.073   1.137  0.00  0.00    -0.267 OA
ATOM     30  N   LIG    1       -5.484   1.715   2.173  0.00  0.00    -0.274 N 
ATOM     31  H   LIG    1       -5.377   2.405   2.900  0.00  0.00    +0.173 HD
ATOM     32  C   LIG    1       -5.903  -1.127  -0.826  0.00  0.00    +0.027 A 
ATOM     33  C   LIG    1       -4.754   0.570   2.315  0.00  0.00    +0.330 A 
ATOM     34  O   LIG    1       -4.016   0.447   3.292  0.00  0.00    -0.246 OA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 5