REMARK  Name = BDB063603
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.123  -0.725   1.683  0.00  0.00    -0.220 N 
ATOM      2  C   LIG    1        1.974   0.147   1.057  0.00  0.00    +0.316 C 
ATOM      3  O   LIG    1        1.906   1.363   1.164  0.00  0.00    -0.252 OA
ATOM      4  N   LIG    1        2.899  -0.606   0.314  0.00  0.00    -0.246 N 
ATOM      5  C   LIG    1        2.630  -2.019   0.462  0.00  0.00    +0.211 C 
ATOM      6  C   LIG    1        1.442  -2.015   1.393  0.00  0.00    +0.241 C 
ATOM      7  O   LIG    1        0.881  -3.020   1.807  0.00  0.00    -0.273 OA
ENDROOT
BRANCH   4   8
ATOM      8  C   LIG    1        3.961  -0.115  -0.493  0.00  0.00    +0.038 A 
ATOM      9  C   LIG    1        4.218   1.253  -0.635  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1        5.271   1.719  -1.435  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1        6.096   0.825  -2.125  0.00  0.00    +0.055 A 
ATOM     12  C   LIG    1        5.853  -0.545  -1.984  0.00  0.00    +0.014 A 
ATOM     13  C   LIG    1        4.800  -1.006  -1.182  0.00  0.00    +0.024 A 
BRANCH  11  14
ATOM     14  C   LIG    1        7.243   1.323  -2.969  0.00  0.00    +0.417 C 
ATOM     15  F   LIG    1        8.408   1.391  -2.269  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1        7.499   0.524  -4.043  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1        7.036   2.570  -3.477  0.00  0.00    -0.166 F 
ENDBRANCH  11  14
ENDBRANCH   4   8
BRANCH   1  18
ATOM     18  C   LIG    1        0.007  -0.323   2.507  0.00  0.00    +0.153 C 
BRANCH  18  25
ATOM     19  C   LIG    1       -2.976   2.518  -0.386  0.00  0.00    +0.047 C 
ATOM     20  C   LIG    1       -2.701   1.197   0.275  0.00  0.00    -0.008 A 
ATOM     21  C   LIG    1       -3.579   0.110   0.155  0.00  0.00    +0.127 A 
ATOM     22  C   LIG    1       -3.276  -1.137   0.725  0.00  0.00    -0.008 A 
ATOM     23  C   LIG    1       -4.181  -2.322   0.539  0.00  0.00    +0.047 C 
ATOM     24  C   LIG    1       -2.118  -1.260   1.504  0.00  0.00    +0.012 A 
ATOM     25  C   LIG    1       -1.256  -0.169   1.691  0.00  0.00    -0.029 A 
ATOM     26  C   LIG    1       -1.551   1.049   1.063  0.00  0.00    +0.012 A 
BRANCH  21  27
ATOM     27  O   LIG    1       -4.723   0.234  -0.594  0.00  0.00    -0.480 OA
BRANCH  27  28
ATOM     28  C   LIG    1       -5.798   0.706   0.220  0.00  0.00    +0.349 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -7.125   0.426  -0.452  0.00  0.00    +0.343 C 
ATOM     30  O   LIG    1       -8.054   1.212  -0.561  0.00  0.00    -0.247 OA
BRANCH  29  31
ATOM     31  O   LIG    1       -7.254  -0.841  -0.899  0.00  0.00    -0.478 OA
ATOM     32  H   LIG    1       -8.144  -0.862  -1.309  0.00  0.00    +0.295 HD
ENDBRANCH  29  31
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  21  27
ENDBRANCH  18  25
ENDBRANCH   1  18
TORSDOF 8