REMARK  Name = BDB028244
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.199  -0.522   0.898  0.00  0.00    +0.083 A 
ATOM      2  C   LIG    1       -1.808  -0.925   0.567  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -1.627  -2.194   0.023  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -0.346  -2.653  -0.304  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1        0.760  -1.830  -0.092  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1        0.591  -0.543   0.435  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -2.802  -3.048  -0.216  0.00  0.00    +0.272 A 
ATOM      8  O   LIG    1       -2.688  -4.172  -0.691  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1       -4.020  -2.509   0.119  0.00  0.00    -0.242 N 
ATOM     10  H   LIG    1       -4.842  -3.083  -0.041  0.00  0.00    +0.192 HD
ATOM     11  C   LIG    1       -0.697  -0.097   0.768  0.00  0.00    +0.020 A 
ATOM     12  N   LIG    1       -4.231  -1.282   0.667  0.00  0.00    -0.174 NA
ENDROOT
BRANCH   6  13
ATOM     13  C   LIG    1        1.741   0.323   0.656  0.00  0.00    +0.073 A 
ATOM     14  N   LIG    1        2.572   0.831  -0.331  0.00  0.00    -0.299 N 
ATOM     15  C   LIG    1        3.540   1.597   0.317  0.00  0.00    +0.138 A 
ATOM     16  C   LIG    1        4.530   2.223  -0.493  0.00  0.00    +0.047 A 
ATOM     17  C   LIG    1        4.496   2.072  -1.831  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1        3.462   1.281  -2.479  0.00  0.00    +0.018 A 
ATOM     19  N   LIG    1        3.356   1.616   1.619  0.00  0.00    -0.235 NA
ATOM     20  C   LIG    1        2.529   0.681  -1.720  0.00  0.00    +0.093 A 
ATOM     21  C   LIG    1        2.248   0.841   1.835  0.00  0.00    +0.139 A 
ENDBRANCH   6  13
BRANCH   1  22
ATOM     22  C   LIG    1       -3.466   0.841   1.528  0.00  0.00    +0.136 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.413   1.869   0.487  0.00  0.00    -0.325 NA
ATOM     24  H   LIG    1       -4.131   1.654  -0.209  0.00  0.00    +0.119 HD
ATOM     25  H   LIG    1       -3.690   2.763   0.892  0.00  0.00    +0.119 HD
ENDBRANCH  22  23
ENDBRANCH   1  22
TORSDOF 3