REMARK  Name = BDB056532
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.151  -0.362   0.799  0.00  0.00    -0.033 A 
ATOM      2  C   LIG    1       -0.648  -1.667   0.733  0.00  0.00    +0.005 A 
ATOM      3  C   LIG    1        0.670  -1.906   0.329  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1        1.528  -0.850  -0.019  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1        1.015   0.457   0.064  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -0.303   0.701   0.466  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.921  -1.086  -0.452  0.00  0.00    +0.073 A 
ATOM      8  N   LIG    1        3.827  -0.205   0.041  0.00  0.00    -0.229 NA
ATOM      9  C   LIG    1        5.105  -0.420  -0.353  0.00  0.00    +0.149 A 
ATOM     10  C   LIG    1        5.542  -1.433  -1.204  0.00  0.00    +0.019 A 
ATOM     11  C   LIG    1        6.941  -1.287  -1.356  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1        7.323  -0.203  -0.601  0.00  0.00    +0.098 A 
ATOM     13  C   LIG    1        4.581  -2.323  -1.702  0.00  0.00    +0.013 A 
ATOM     14  N   LIG    1        6.208   0.340   0.029  0.00  0.00    -0.255 N 
ATOM     15  C   LIG    1        6.249   1.457   0.890  0.00  0.00    +0.317 C 
ATOM     16  O   LIG    1        7.305   2.026   1.127  0.00  0.00    -0.249 OA
ATOM     17  N   LIG    1        5.037   1.802   1.406  0.00  0.00    -0.311 N 
ATOM     18  H   LIG    1        4.200   1.258   1.199  0.00  0.00    +0.147 HD
ATOM     19  H   LIG    1        4.979   2.565   2.064  0.00  0.00    +0.147 HD
ATOM     20  C   LIG    1        3.254  -2.135  -1.311  0.00  0.00    +0.029 A 
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1       -2.574  -0.104   1.250  0.00  0.00    +0.119 C 
BRANCH  21  26
ATOM     22  C   LIG    1       -6.261   2.438  -0.528  0.00  0.00    +0.105 C 
ATOM     23  N   LIG    1       -5.683   1.100  -0.446  0.00  0.00    -0.303 NA
ATOM     24  C   LIG    1       -5.603   0.639   0.951  0.00  0.00    +0.099 C 
ATOM     25  C   LIG    1       -4.916  -0.742   1.075  0.00  0.00    +0.100 C 
ATOM     26  N   LIG    1       -3.577  -0.831   0.453  0.00  0.00    -0.296 NA
ATOM     27  C   LIG    1       -3.677  -0.328  -0.935  0.00  0.00    +0.100 C 
ATOM     28  C   LIG    1       -4.354   1.056  -1.082  0.00  0.00    +0.099 C 
ENDBRANCH  21  26
ENDBRANCH   1  21
TORSDOF 3