REMARK  Name = BDB051352
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.121   1.208   0.462  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1       -1.924   1.393  -0.672  0.00  0.00    +0.040 A 
ATOM      3  C   LIG    1       -2.958   0.499  -0.941  0.00  0.00    +0.067 A 
ATOM      4  N   LIG    1       -3.752   0.686  -2.083  0.00  0.00    -0.319 N 
ATOM      5  H   LIG    1       -3.583   1.464  -2.707  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -4.795  -0.141  -2.437  0.00  0.00    +0.273 A 
ATOM      7  C   LIG    1       -5.031  -1.242  -1.538  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1       -4.263  -1.441  -0.412  0.00  0.00    -0.310 N 
ATOM      9  C   LIG    1       -4.719  -2.560   0.245  0.00  0.00    +0.092 A 
ATOM     10  C   LIG    1       -5.782  -3.077  -0.465  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1       -5.979  -2.246  -1.591  0.00  0.00    +0.033 A 
ATOM     12  O   LIG    1       -5.450   0.079  -3.452  0.00  0.00    -0.266 OA
ATOM     13  C   LIG    1       -3.199  -0.577  -0.073  0.00  0.00    +0.070 A 
ATOM     14  C   LIG    1       -2.414  -0.761   1.067  0.00  0.00    +0.029 A 
ATOM     15  C   LIG    1       -1.376   0.138   1.334  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  17
ATOM     16  O   LIG    1       -0.087   3.311   0.228  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1       -0.028   2.188   0.715  0.00  0.00    +0.244 C 
ATOM     18  N   LIG    1        1.033   1.739   1.474  0.00  0.00    -0.310 N 
ATOM     19  H   LIG    1        1.185   0.738   1.510  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1        2.254   2.523   1.569  0.00  0.00    +0.120 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.209   2.211   0.402  0.00  0.00    +0.103 C 
BRANCH  21  22
ATOM     22  N   LIG    1        3.519   0.772   0.300  0.00  0.00    -0.301 NA
ATOM     23  C   LIG    1        4.387   0.290   1.376  0.00  0.00    +0.084 C 
ATOM     24  C   LIG    1        4.903  -1.039   0.841  0.00  0.00    +0.017 C 
ATOM     25  C   LIG    1        4.782  -0.933  -0.675  0.00  0.00    +0.017 C 
ATOM     26  C   LIG    1        4.253   0.468  -0.932  0.00  0.00    +0.084 C 
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   1  17
TORSDOF 4