REMARK  Name = BDB064493
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.124  -1.843  -1.551  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1   8
ATOM      2  C   LIG    1       -4.743  -1.514  -0.362  0.00  0.00    +0.047 C 
ATOM      3  C   LIG    1       -3.550  -0.900  -1.035  0.00  0.00    -0.008 A 
ATOM      4  C   LIG    1       -3.603   0.346  -1.681  0.00  0.00    +0.128 A 
ATOM      5  C   LIG    1       -2.490   0.830  -2.389  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -2.530   2.099  -3.189  0.00  0.00    +0.047 C 
ATOM      7  C   LIG    1       -1.281   0.118  -2.326  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1       -1.185  -1.086  -1.619  0.00  0.00    -0.033 A 
ATOM      9  C   LIG    1       -2.328  -1.588  -0.985  0.00  0.00    +0.012 A 
BRANCH   4  10
ATOM     10  O   LIG    1       -4.779   1.051  -1.695  0.00  0.00    -0.475 OA
BRANCH  10  11
ATOM     11  C   LIG    1       -4.929   2.021  -0.642  0.00  0.00    +0.200 C 
ATOM     12  C   LIG    1       -6.211   1.653   0.130  0.00  0.00    +0.067 C 
ATOM     13  C   LIG    1       -5.218   3.373  -1.325  0.00  0.00    +0.067 C 
BRANCH  11  14
ATOM     14  C   LIG    1       -3.766   2.247   0.364  0.00  0.00    +0.348 C 
ATOM     15  O   LIG    1       -2.878   3.083   0.278  0.00  0.00    -0.247 OA
BRANCH  14  16
ATOM     16  O   LIG    1       -3.768   1.393   1.410  0.00  0.00    -0.478 OA
ATOM     17  H   LIG    1       -2.941   1.609   1.889  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        0.683  -1.912  -0.192  0.00  0.00    -0.295 NA
ATOM     19  C   LIG    1        1.837  -2.833  -0.127  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        3.233  -2.171  -0.192  0.00  0.00    +0.120 C 
ATOM     21  N   LIG    1        3.393  -1.159   0.866  0.00  0.00    -0.326 N 
ATOM     22  C   LIG    1        2.152  -0.565   1.393  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        1.046  -0.566   0.312  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        4.637  -0.840   1.378  0.00  0.00    +0.048 A 
ATOM     25  C   LIG    1        5.835  -1.117   0.712  0.00  0.00    +0.134 A 
ATOM     26  N   LIG    1        7.089  -0.833   1.159  0.00  0.00    -0.249 NA
ATOM     27  C   LIG    1        7.199  -0.224   2.368  0.00  0.00    +0.144 A 
ATOM     28  C   LIG    1        6.071   0.108   3.113  0.00  0.00    +0.034 A 
ATOM     29  C   LIG    1        4.801  -0.204   2.613  0.00  0.00    +0.027 A 
BRANCH  27  30
ATOM     30  C   LIG    1        8.575   0.135   2.912  0.00  0.00    +0.434 C 
ATOM     31  F   LIG    1        8.709  -0.169   4.238  0.00  0.00    -0.164 F 
ATOM     32  F   LIG    1        8.841   1.471   2.820  0.00  0.00    -0.164 F 
ATOM     33  F   LIG    1        9.611  -0.495   2.288  0.00  0.00    -0.164 F 
ENDBRANCH  27  30
ENDBRANCH  21  24
ENDBRANCH   1  18
TORSDOF 8