REMARK  Name = BDB057357
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.446  -1.244   0.051  0.00  0.00    +0.217 A 
ATOM      2  N   LIG    1        3.268  -0.232  -0.803  0.00  0.00    -0.197 NA
ATOM      3  C   LIG    1        2.048   0.357  -0.871  0.00  0.00    +0.147 A 
ATOM      4  N   LIG    1        2.011   1.457  -1.724  0.00  0.00    -0.321 N 
ATOM      5  H   LIG    1        2.938   1.613  -2.102  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1        1.264   2.558  -1.548  0.00  0.00    +0.180 A 
ATOM      7  C   LIG    1       -0.015   2.598  -0.955  0.00  0.00    +0.129 A 
ATOM      8  N   LIG    1       -0.873   1.584  -0.552  0.00  0.00    -0.241 NA
ATOM      9  C   LIG    1       -0.432   0.405  -0.234  0.00  0.00    +0.084 A 
ATOM     10  C   LIG    1       -0.391   3.919  -0.961  0.00  0.00    +0.060 A 
ATOM     11  C   LIG    1       -1.626   4.600  -0.521  0.00  0.00    +0.067 C 
ATOM     12  N   LIG    1        0.655   4.580  -1.540  0.00  0.00    -0.278 N 
ATOM     13  H   LIG    1        0.738   5.573  -1.728  0.00  0.00    +0.189 HD
ATOM     14  N   LIG    1        1.670   3.780  -1.909  0.00  0.00    -0.154 NA
ATOM     15  C   LIG    1        0.973  -0.091  -0.131  0.00  0.00    +0.061 A 
ATOM     16  C   LIG    1        1.278  -1.115   0.749  0.00  0.00    +0.128 A 
ATOM     17  N   LIG    1        2.489  -1.697   0.861  0.00  0.00    -0.222 NA
ENDROOT
BRANCH   9  18
ATOM     18  C   LIG    1       -1.522  -0.581   0.072  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -1.574  -1.813  -0.589  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1       -2.595  -2.717  -0.288  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1       -3.568  -2.398   0.668  0.00  0.00    -0.050 A 
ATOM     22  C   LIG    1       -4.685  -3.357   0.961  0.00  0.00    +0.044 C 
ATOM     23  C   LIG    1       -3.527  -1.147   1.297  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -2.509  -0.239   1.001  0.00  0.00    +0.010 A 
ENDBRANCH   9  18
BRANCH   1  26
ATOM     25  C   LIG    1        5.146  -2.289   1.354  0.00  0.00    +0.128 C 
ATOM     26  N   LIG    1        4.711  -1.808   0.063  0.00  0.00    -0.316 N 
ATOM     27  H   LIG    1        5.327  -1.136  -0.381  0.00  0.00    +0.149 HD
ENDBRANCH   1  26
TORSDOF 2