REMARK  Name = BDB017707
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.217   1.353   1.354  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.203   0.938   1.033  0.00  0.00    -0.031 A 
ATOM      3  C   LIG    1        1.954   1.630   0.076  0.00  0.00    +0.031 A 
ATOM      4  C   LIG    1        3.264   1.234  -0.212  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        3.867   0.155   0.454  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1        5.266  -0.200   0.111  0.00  0.00    +0.045 A 
ATOM      7  N   LIG    1        5.912  -1.209   0.823  0.00  0.00    -0.343 N 
ATOM      8  H   LIG    1        5.579  -1.301   1.778  0.00  0.00    +0.146 HD
ATOM      9  C   LIG    1        7.353  -1.402   0.701  0.00  0.00    +0.102 C 
ATOM     10  C   LIG    1        7.765  -1.230  -0.756  0.00  0.00    +0.023 C 
ATOM     11  C   LIG    1        7.301   0.127  -1.296  0.00  0.00    +0.044 C 
ATOM     12  C   LIG    1        5.895   0.466  -0.878  0.00  0.00    +0.038 A 
ATOM     13  C   LIG    1        5.238   1.593  -1.593  0.00  0.00    +0.254 A 
ATOM     14  O   LIG    1        5.807   2.216  -2.485  0.00  0.00    -0.268 OA
ATOM     15  C   LIG    1        3.101  -0.544   1.396  0.00  0.00    +0.012 A 
ATOM     16  N   LIG    1        3.973   1.921  -1.202  0.00  0.00    -0.322 N 
ATOM     17  H   LIG    1        3.547   2.690  -1.700  0.00  0.00    +0.169 HD
ATOM     18  C   LIG    1        1.788  -0.155   1.687  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1  24
ATOM     19  C   LIG    1       -4.833   1.704   1.170  0.00  0.00    +0.029 C 
ATOM     20  C   LIG    1       -3.546   1.199   0.515  0.00  0.00    +0.084 C 
ATOM     21  N   LIG    1       -3.744   0.200  -0.580  0.00  0.00    -0.325 N 
ATOM     22  C   LIG    1       -2.577  -0.694  -0.805  0.00  0.00    +0.121 C 
ATOM     23  C   LIG    1       -1.261  -0.009  -0.382  0.00  0.00    +0.103 C 
ATOM     24  N   LIG    1       -1.208   0.304   1.068  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -2.550   0.670   1.585  0.00  0.00    +0.107 C 
BRANCH  21  26
ATOM     26  C   LIG    1       -4.962  -0.480  -0.661  0.00  0.00    +0.033 A 
ATOM     27  C   LIG    1       -5.336  -1.496   0.225  0.00  0.00    +0.062 A 
ATOM     28  C   LIG    1       -6.569  -2.133   0.088  0.00  0.00    +0.142 A 
ATOM     29  F   LIG    1       -6.891  -3.099   0.961  0.00  0.00    -0.204 F 
ATOM     30  C   LIG    1       -7.452  -1.777  -0.927  0.00  0.00    +0.087 A 
ATOM     31  C   LIG    1       -7.091  -0.765  -1.819  0.00  0.00    +0.023 A 
ATOM     32  C   LIG    1       -5.855  -0.125  -1.683  0.00  0.00    +0.024 A 
BRANCH  30  33
ATOM     33  C   LIG    1       -8.713  -2.438  -1.053  0.00  0.00    +0.102 C 
ATOM     34  N   LIG    1       -9.745  -2.955  -1.181  0.00  0.00    -0.191 NA
ENDBRANCH  30  33
ENDBRANCH  21  26
ENDBRANCH   1  24
TORSDOF 4