REMARK  Name = BDB042487
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.918  -1.107  -0.758  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.330  -1.650  -1.013  0.00  0.00    +0.054 C 
BRANCH   2  10
ATOM      3  C   LIG    1       -6.093  -0.416   2.572  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1       -6.123   0.575   1.440  0.00  0.00    -0.040 A 
ATOM      5  C   LIG    1       -5.237   0.498   0.343  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -5.327   1.466  -0.679  0.00  0.00    +0.049 A 
ATOM      7  C   LIG    1       -4.400   1.392  -1.835  0.00  0.00    +0.257 A 
ATOM      8  N   LIG    1       -3.491   0.359  -1.825  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1       -2.872   0.330  -2.627  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1       -3.386  -0.587  -0.835  0.00  0.00    +0.020 A 
ATOM     11  O   LIG    1       -4.440   2.204  -2.752  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -6.272   2.493  -0.627  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1       -7.133   2.554   0.454  0.00  0.00    +0.124 A 
ATOM     14  F   LIG    1       -8.045   3.533   0.519  0.00  0.00    -0.205 F 
ATOM     15  C   LIG    1       -4.216  -0.555   0.220  0.00  0.00    +0.030 A 
ATOM     16  C   LIG    1       -7.069   1.614   1.479  0.00  0.00    +0.042 A 
ENDBRANCH   2  10
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1        0.129  -2.216  -0.944  0.00  0.00    +0.085 C 
BRANCH  17  18
ATOM     18  N   LIG    1        1.533  -1.856  -0.722  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1        2.031  -0.821  -1.648  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        3.545  -0.555  -1.464  0.00  0.00    +0.120 C 
ATOM     21  N   LIG    1        3.843  -0.182  -0.065  0.00  0.00    -0.325 N 
ATOM     22  C   LIG    1        3.328  -1.181   0.904  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        1.821  -1.447   0.668  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        5.117   0.323   0.247  0.00  0.00    +0.066 A 
ATOM     25  C   LIG    1        5.359   0.983   1.472  0.00  0.00    +0.146 A 
ATOM     26  F   LIG    1        4.362   1.155   2.356  0.00  0.00    -0.204 F 
ATOM     27  C   LIG    1        6.606   1.508   1.812  0.00  0.00    +0.059 A 
ATOM     28  C   LIG    1        7.667   1.397   0.918  0.00  0.00    +0.055 A 
ATOM     29  C   LIG    1        7.464   0.763  -0.309  0.00  0.00    +0.021 A 
ATOM     30  C   LIG    1        6.204   0.240  -0.638  0.00  0.00    +0.027 A 
BRANCH  28  31
ATOM     31  C   LIG    1        8.954   1.931   1.253  0.00  0.00    +0.099 C 
ATOM     32  N   LIG    1        9.997   2.361   1.522  0.00  0.00    -0.191 NA
ENDBRANCH  28  31
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 6