REMARK  Name = BDB015098
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.131  -1.297   0.321  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.452  -1.288   0.666  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1       -2.226  -0.367  -0.050  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1       -3.603  -0.229   0.184  0.00  0.00    -0.014 A 
ATOM      5  C   LIG    1       -4.196  -1.035   1.163  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -3.434  -1.960   1.877  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1       -2.065  -2.088   1.627  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1       -4.395   0.751  -0.570  0.00  0.00    -0.006 A 
ATOM      9  C   LIG    1       -5.208   0.389  -1.668  0.00  0.00    +0.062 A 
ATOM     10  C   LIG    1       -5.943   1.389  -2.337  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1       -5.874   2.722  -1.937  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -5.070   3.080  -0.861  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -4.339   2.104  -0.185  0.00  0.00    +0.009 A 
BRANCH   9  14
ATOM     14  C   LIG    1       -5.311  -1.044  -2.139  0.00  0.00    +0.418 C 
ATOM     15  F   LIG    1       -4.106  -1.609  -2.430  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1       -5.910  -1.861  -1.228  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1       -6.052  -1.179  -3.280  0.00  0.00    -0.166 F 
ENDBRANCH   9  14
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1        0.776  -2.110   1.060  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1        1.232  -1.455   2.370  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1        2.193  -2.289   3.032  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1        1.764  -3.139   3.229  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        1.754   0.004   2.246  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1        2.928   0.355   1.432  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1        2.634   0.534   0.006  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        3.851   0.910  -0.817  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        5.151   0.671  -0.337  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        6.258   0.998  -1.132  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        6.077   1.534  -2.406  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        4.790   1.753  -2.893  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        5.351   0.130   1.056  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        3.682   1.441  -2.104  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        4.084  -0.519   1.633  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 8