REMARK  Name = BDB064506
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.575  -1.601  -1.069  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1   8
ATOM      2  C   LIG    1       -3.874  -2.246   1.185  0.00  0.00    +0.047 C 
ATOM      3  C   LIG    1       -3.064  -1.552   0.127  0.00  0.00    -0.008 A 
ATOM      4  C   LIG    1       -3.620  -0.605  -0.750  0.00  0.00    +0.128 A 
ATOM      5  C   LIG    1       -2.855  -0.057  -1.793  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -3.436   0.891  -2.802  0.00  0.00    +0.047 C 
ATOM      7  C   LIG    1       -1.490  -0.373  -1.875  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1       -0.898  -1.261  -0.969  0.00  0.00    -0.033 A 
ATOM      9  C   LIG    1       -1.698  -1.853   0.018  0.00  0.00    +0.012 A 
BRANCH   4  10
ATOM     10  O   LIG    1       -4.947  -0.281  -0.657  0.00  0.00    -0.475 OA
BRANCH  10  11
ATOM     11  C   LIG    1       -5.301   0.810   0.236  0.00  0.00    +0.200 C 
ATOM     12  C   LIG    1       -6.068   1.843  -0.599  0.00  0.00    +0.067 C 
ATOM     13  C   LIG    1       -4.162   1.505   0.999  0.00  0.00    +0.067 C 
BRANCH  11  14
ATOM     14  C   LIG    1       -6.317   0.235   1.240  0.00  0.00    +0.348 C 
ATOM     15  O   LIG    1       -6.638   0.760   2.296  0.00  0.00    -0.247 OA
BRANCH  14  16
ATOM     16  O   LIG    1       -6.879  -0.927   0.815  0.00  0.00    -0.478 OA
ATOM     17  H   LIG    1       -6.465  -1.195  -0.036  0.00  0.00    +0.295 HD
ENDBRANCH  14  16
ENDBRANCH  11  14
ENDBRANCH  10  11
ENDBRANCH   4  10
ENDBRANCH   1   8
BRANCH   1  18
ATOM     18  N   LIG    1        1.325  -1.286   0.157  0.00  0.00    -0.295 NA
ATOM     19  C   LIG    1        2.689  -1.858   0.080  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        3.542  -1.529   1.329  0.00  0.00    +0.122 C 
ATOM     21  N   LIG    1        3.634  -0.072   1.554  0.00  0.00    -0.313 N 
ATOM     22  C   LIG    1        2.295   0.558   1.591  0.00  0.00    +0.122 C 
ATOM     23  C   LIG    1        1.429   0.182   0.363  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        4.582   0.594   0.765  0.00  0.00    +0.122 A 
ATOM     25  N   LIG    1        4.200   1.610  -0.037  0.00  0.00    -0.240 NA
ATOM     26  C   LIG    1        5.135   2.248  -0.775  0.00  0.00    +0.113 A 
ATOM     27  C   LIG    1        6.477   1.930  -0.756  0.00  0.00    +0.032 A 
ATOM     28  C   LIG    1        6.893   0.901   0.085  0.00  0.00    +0.059 A 
ATOM     29  C   LIG    1        5.926   0.233   0.849  0.00  0.00    +0.056 A 
BRANCH  28  30
ATOM     30  C   LIG    1        8.336   0.491   0.168  0.00  0.00    +0.418 C 
ATOM     31  F   LIG    1        8.583  -0.660  -0.516  0.00  0.00    -0.166 F 
ATOM     32  F   LIG    1        9.191   1.420  -0.344  0.00  0.00    -0.166 F 
ATOM     33  F   LIG    1        8.752   0.265   1.444  0.00  0.00    -0.166 F 
ENDBRANCH  28  30
ENDBRANCH  21  24
ENDBRANCH   1  18
TORSDOF 8