REMARK  Name = BDB064528
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.308   0.380  -0.770  0.00  0.00    +0.076 A 
ATOM      2  C   LIG    1       -0.476  -0.646  -0.246  0.00  0.00    +0.184 A 
ATOM      3  O   LIG    1       -1.032  -1.533   0.655  0.00  0.00    -0.483 OA
ATOM      4  C   LIG    1       -0.250  -2.717   0.819  0.00  0.00    +0.270 C 
ATOM      5  C   LIG    1        1.197  -2.347   1.057  0.00  0.00    +0.270 C 
ATOM      6  O   LIG    1        1.729  -1.703  -0.102  0.00  0.00    -0.484 OA
ATOM      7  C   LIG    1        0.891  -0.728  -0.586  0.00  0.00    +0.176 A 
ATOM      8  C   LIG    1        1.442   0.203  -1.467  0.00  0.00    +0.087 A 
ATOM      9  C   LIG    1        0.644   1.200  -2.022  0.00  0.00    +0.019 A 
ATOM     10  C   LIG    1       -0.703   1.289  -1.661  0.00  0.00    +0.028 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.867   0.153  -1.842  0.00  0.00    +0.285 C 
ATOM     12  N   LIG    1        3.930   0.198  -0.920  0.00  0.00    -0.162 N 
ATOM     13  C   LIG    1        3.945   0.557   0.427  0.00  0.00    +0.219 A 
ATOM     14  N   LIG    1        5.145   0.373   0.916  0.00  0.00    -0.192 NA
ATOM     15  C   LIG    1        5.896  -0.033  -0.169  0.00  0.00    +0.202 A 
ATOM     16  N   LIG    1        5.198  -0.098  -1.312  0.00  0.00    -0.139 NA
ATOM     17  O   LIG    1        3.120   0.106  -3.048  0.00  0.00    -0.265 OA
BRANCH  15  18
ATOM     18  C   LIG    1        7.332  -0.334  -0.046  0.00  0.00    +0.110 A 
ATOM     19  N   LIG    1        7.997  -0.718  -1.168  0.00  0.00    -0.252 NA
ATOM     20  C   LIG    1        9.313  -0.993  -1.050  0.00  0.00    +0.111 A 
ATOM     21  C   LIG    1       10.015  -0.908   0.140  0.00  0.00    +0.020 A 
ATOM     22  C   LIG    1        9.326  -0.516   1.281  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        7.967  -0.224   1.191  0.00  0.00    +0.031 A 
ENDBRANCH  15  18
BRANCH  13  24
ATOM     24  N   LIG    1        2.910   1.065   1.134  0.00  0.00    -0.327 N 
ATOM     25  H   LIG    1        2.208   1.641   0.679  0.00  0.00    +0.145 HD
ATOM     26  H   LIG    1        3.171   1.448   2.040  0.00  0.00    +0.145 HD
ENDBRANCH  13  24
ENDBRANCH   8  11
BRANCH   1  30
ATOM     27  N   LIG    1       -5.648   0.768  -0.171  0.00  0.00    -0.297 NA
ATOM     28  C   LIG    1       -4.660   1.784   0.255  0.00  0.00    +0.103 C 
ATOM     29  C   LIG    1       -3.368   1.793  -0.595  0.00  0.00    +0.120 C 
ATOM     30  N   LIG    1       -2.656   0.515  -0.452  0.00  0.00    -0.325 N 
ATOM     31  C   LIG    1       -3.500  -0.664  -0.193  0.00  0.00    +0.120 C 
ATOM     32  C   LIG    1       -4.956  -0.443  -0.679  0.00  0.00    +0.103 C 
BRANCH  27  34
ATOM     33  C   LIG    1       -7.871  -0.260   0.213  0.00  0.00    +0.024 C 
ATOM     34  C   LIG    1       -6.678   0.474   0.849  0.00  0.00    +0.051 C 
ATOM     35  C   LIG    1       -7.236   1.736   1.533  0.00  0.00    +0.024 C 
ENDBRANCH  27  34
ENDBRANCH   1  30
TORSDOF 5