REMARK  Name = BDB031060
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.745   0.319   0.309  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -3.438   0.486  -0.006  0.00  0.00    +0.097 A 
ATOM      3  N   LIG    1       -2.775   1.694   0.239  0.00  0.00    -0.298 N 
ATOM      4  C   LIG    1       -3.390   2.781   0.848  0.00  0.00    +0.138 A 
ATOM      5  N   LIG    1       -2.559   3.784   1.024  0.00  0.00    -0.235 NA
ATOM      6  C   LIG    1       -1.365   3.345   0.516  0.00  0.00    +0.141 A 
ATOM      7  C   LIG    1       -4.758   2.641   1.189  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1       -1.470   2.075  -0.023  0.00  0.00    +0.091 A 
ATOM      9  C   LIG    1       -5.401   1.485   0.937  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1       -0.457   1.271  -0.681  0.00  0.00    +0.091 A 
ATOM     11  N   LIG    1        0.692   1.149   0.021  0.00  0.00    -0.231 NA
ATOM     12  C   LIG    1        1.692   0.428  -0.521  0.00  0.00    +0.120 A 
ATOM     13  C   LIG    1        1.573  -0.181  -1.765  0.00  0.00    +0.043 A 
ATOM     14  C   LIG    1        0.390  -0.033  -2.484  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1       -0.646   0.712  -1.937  0.00  0.00    +0.030 A 
BRANCH  12  16
ATOM     16  N   LIG    1        2.845   0.316   0.264  0.00  0.00    -0.326 N 
ATOM     17  H   LIG    1        2.713   0.952   1.048  0.00  0.00    +0.148 HD
BRANCH  16  18
ATOM     18  C   LIG    1        4.179   0.207  -0.224  0.00  0.00    +0.073 C 
ATOM     19  C   LIG    1        5.223   0.222   0.932  0.00  0.00    +0.031 C 
ATOM     20  C   LIG    1        5.875  -0.949   0.236  0.00  0.00    -0.001 C 
ATOM     21  C   LIG    1        7.155  -0.720  -0.519  0.00  0.00    +0.089 C 
ATOM     22  N   LIG    1        7.866  -1.436   0.572  0.00  0.00    -0.315 NA
ATOM     23  H   LIG    1        8.292  -0.806   1.253  0.00  0.00    +0.122 HD
ATOM     24  C   LIG    1        6.572  -2.003   1.039  0.00  0.00    +0.089 C 
ATOM     25  C   LIG    1        4.610  -1.260  -0.517  0.00  0.00    +0.031 C 
ENDBRANCH  16  18
ENDBRANCH  12  16
ENDBRANCH   8  10
BRANCH   1  26
ATOM     26  C   LIG    1       -5.535  -0.954   0.070  0.00  0.00    +0.092 C 
ATOM     27  C   LIG    1       -6.522  -1.379   1.155  0.00  0.00    +0.021 C 
ATOM     28  C   LIG    1       -7.042  -0.850  -0.152  0.00  0.00    +0.021 C 
BRANCH  26  30
ATOM     29  F   LIG    1       -4.396  -1.652  -1.897  0.00  0.00    -0.170 F 
ATOM     30  C   LIG    1       -4.824  -2.075  -0.683  0.00  0.00    +0.399 C 
ATOM     31  F   LIG    1       -3.747  -2.521   0.007  0.00  0.00    -0.170 F 
ATOM     32  F   LIG    1       -5.638  -3.140  -0.891  0.00  0.00    -0.170 F 
ENDBRANCH  26  30
ENDBRANCH   1  26
TORSDOF 5