REMARK  Name = BDB062534
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.763  -0.913   2.661  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -1.643  -1.052   1.440  0.00  0.00    +0.251 C 
ATOM      3  N   LIG    1       -2.736  -1.431   0.669  0.00  0.00    -0.290 N 
ATOM      4  C   LIG    1       -2.683  -1.621  -0.770  0.00  0.00    +0.149 C 
ATOM      5  C   LIG    1       -1.556  -2.565  -1.133  0.00  0.00    +0.248 C 
ATOM      6  O   LIG    1       -0.370  -1.844  -1.415  0.00  0.00    -0.490 OA
ATOM      7  C   LIG    1        0.207  -1.121  -0.412  0.00  0.00    +0.133 A 
ATOM      8  C   LIG    1        1.503  -0.704  -0.791  0.00  0.00    +0.055 A 
ATOM      9  C   LIG    1        2.336   0.052   0.045  0.00  0.00    -0.013 A 
ATOM     10  C   LIG    1        1.835   0.394   1.300  0.00  0.00    +0.009 A 
ATOM     11  C   LIG    1        0.550  -0.002   1.685  0.00  0.00    +0.017 A 
ATOM     12  C   LIG    1       -0.296  -0.759   0.842  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   9  13
ATOM     13  C   LIG    1        3.682   0.463  -0.381  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        4.809   0.225   0.423  0.00  0.00    +0.021 A 
ATOM     15  C   LIG    1        6.069   0.641  -0.040  0.00  0.00    +0.019 A 
ATOM     16  C   LIG    1        6.117   1.269  -1.278  0.00  0.00    +0.138 A 
ATOM     17  N   LIG    1        7.421   1.589  -1.538  0.00  0.00    -0.346 N 
ATOM     18  H   LIG    1        7.724   2.056  -2.380  0.00  0.00    +0.167 HD
ATOM     19  C   LIG    1        8.216   1.180  -0.497  0.00  0.00    +0.085 A 
ATOM     20  N   LIG    1        5.090   1.534  -2.103  0.00  0.00    -0.237 NA
ATOM     21  C   LIG    1        7.403   0.588   0.447  0.00  0.00    +0.029 A 
ATOM     22  C   LIG    1        3.900   1.111  -1.604  0.00  0.00    +0.121 A 
ENDBRANCH   9  13
BRANCH   3  23
ATOM     23  C   LIG    1       -4.057  -1.463   1.299  0.00  0.00    +0.143 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.867  -0.224   0.985  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1       -5.934  -0.274   0.074  0.00  0.00    +0.008 A 
ATOM     26  C   LIG    1       -6.666   0.878  -0.219  0.00  0.00    +0.038 A 
ATOM     27  C   LIG    1       -6.332   2.079   0.397  0.00  0.00    +0.123 A 
ATOM     28  F   LIG    1       -7.036   3.182   0.113  0.00  0.00    -0.205 F 
ATOM     29  C   LIG    1       -5.280   2.151   1.301  0.00  0.00    +0.038 A 
ATOM     30  C   LIG    1       -4.547   1.001   1.595  0.00  0.00    +0.008 A 
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 3