REMARK  Name = BDB056157
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.668   0.352   0.009  0.00  0.00    -0.327 N 
ATOM      2  C   LIG    1        0.497   0.401  -0.882  0.00  0.00    +0.120 C 
ATOM      3  C   LIG    1       -0.805   0.466  -0.050  0.00  0.00    +0.103 C 
ATOM      4  N   LIG    1       -1.008  -0.669   0.886  0.00  0.00    -0.295 NA
ATOM      5  C   LIG    1        0.264  -1.381   1.143  0.00  0.00    +0.103 C 
ATOM      6  C   LIG    1        1.496  -0.451   1.239  0.00  0.00    +0.120 C 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1        5.587   0.417  -1.604  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1        5.331   0.976  -0.349  0.00  0.00    +0.018 A 
ATOM      9  C   LIG    1        4.026   0.984   0.188  0.00  0.00    -0.029 A 
ATOM     10  C   LIG    1        3.822   1.650   1.524  0.00  0.00    +0.045 C 
ATOM     11  C   LIG    1        2.955   0.398  -0.528  0.00  0.00    +0.033 A 
ATOM     12  C   LIG    1        3.236  -0.124  -1.803  0.00  0.00    +0.024 A 
ATOM     13  C   LIG    1        4.528  -0.114  -2.338  0.00  0.00    +0.015 A 
BRANCH   7  16
ATOM     14  N   LIG    1        8.009   0.370  -1.321  0.00  0.00    -0.312 N 
ATOM     15  H   LIG    1        7.829   0.180  -0.345  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        6.949   0.397  -2.205  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1        7.084   0.371  -3.423  0.00  0.00    -0.270 OA
BRANCH  14  19
ATOM     18  C   LIG    1        9.755  -1.186  -2.070  0.00  0.00    +0.024 C 
ATOM     19  C   LIG    1        9.375   0.256  -1.786  0.00  0.00    +0.101 C 
ENDBRANCH  14  19
ENDBRANCH   7  16
ENDBRANCH   1  11
BRANCH   4  20
ATOM     20  C   LIG    1       -2.036  -1.612   0.426  0.00  0.00    +0.119 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -3.441  -1.043   0.485  0.00  0.00    -0.028 A 
ATOM     22  C   LIG    1       -3.910  -0.419   1.657  0.00  0.00    +0.054 A 
ATOM     23  C   LIG    1       -5.212   0.087   1.736  0.00  0.00    +0.164 A 
ATOM     24  C   LIG    1       -6.056  -0.032   0.622  0.00  0.00    +0.184 A 
ATOM     25  O   LIG    1       -7.350   0.418   0.745  0.00  0.00    -0.474 OA
ATOM     26  C   LIG    1       -7.984   0.703  -0.498  0.00  0.00    +0.256 C 
ATOM     27  C   LIG    1       -7.710  -0.277  -1.649  0.00  0.00    +0.258 C 
ATOM     28  N   LIG    1       -6.454  -0.824  -1.635  0.00  0.00    -0.279 N 
ATOM     29  H   LIG    1       -6.195  -1.397  -2.427  0.00  0.00    +0.155 HD
ATOM     30  O   LIG    1       -8.487  -0.504  -2.573  0.00  0.00    -0.271 OA
ATOM     31  C   LIG    1       -9.481   0.808  -0.235  0.00  0.00    +0.062 C 
ATOM     32  C   LIG    1       -5.599  -0.662  -0.542  0.00  0.00    +0.080 A 
ATOM     33  C   LIG    1       -4.304  -1.173  -0.611  0.00  0.00    +0.032 A 
BRANCH  23  34
ATOM     34  O   LIG    1       -5.747   0.706   2.836  0.00  0.00    -0.491 OA
ATOM     35  C   LIG    1       -4.905   0.871   3.968  0.00  0.00    +0.277 C 
ENDBRANCH  23  34
ENDBRANCH  20  21
ENDBRANCH   4  20
TORSDOF 6