REMARK  Name = BDB055862
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.220   0.719   0.239  0.00  0.00    +0.111 A 
ATOM      2  N   LIG    1       -1.835   1.605   1.090  0.00  0.00    -0.340 N 
ATOM      3  H   LIG    1       -1.371   2.164   1.792  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1       -3.181   1.587   0.832  0.00  0.00    +0.085 A 
ATOM      5  C   LIG    1       -3.330   0.683  -0.216  0.00  0.00    +0.104 A 
ATOM      6  C   LIG    1       -4.614   0.450  -0.718  0.00  0.00    +0.082 A 
ATOM      7  C   LIG    1       -5.648   1.153  -0.113  0.00  0.00    +0.126 A 
ATOM      8  N   LIG    1       -5.495   2.023   0.919  0.00  0.00    -0.260 NA
ATOM      9  C   LIG    1       -4.252   2.259   1.401  0.00  0.00    +0.138 A 
ATOM     10  N   LIG    1       -2.106   0.144  -0.547  0.00  0.00    -0.231 NA
ENDROOT
BRANCH   1  14
ATOM     11  N   LIG    1        2.602  -1.200  -0.110  0.00  0.00    -0.302 NA
ATOM     12  C   LIG    1        2.123  -0.909   1.238  0.00  0.00    +0.085 C 
ATOM     13  C   LIG    1        0.618  -0.641   1.243  0.00  0.00    +0.026 C 
ATOM     14  C   LIG    1        0.261   0.483   0.265  0.00  0.00    +0.057 C 
ATOM     15  C   LIG    1        0.805   0.149  -1.127  0.00  0.00    +0.026 C 
ATOM     16  C   LIG    1        2.306  -0.139  -1.072  0.00  0.00    +0.085 C 
BRANCH  11  17
ATOM     17  C   LIG    1        3.978  -1.700  -0.168  0.00  0.00    +0.084 C 
BRANCH  17  19
ATOM     18  C   LIG    1        5.369   0.444   0.185  0.00  0.00    +0.005 C 
ATOM     19  C   LIG    1        5.079  -0.980   0.627  0.00  0.00    +0.012 C 
ENDBRANCH  17  19
ENDBRANCH  11  17
ENDBRANCH   1  14
BRANCH   6  20
ATOM     20  C   LIG    1       -4.869  -0.461  -1.836  0.00  0.00    +0.245 C 
ATOM     21  O   LIG    1       -4.234  -0.419  -2.879  0.00  0.00    -0.270 OA
ATOM     22  N   LIG    1       -5.885  -1.363  -1.659  0.00  0.00    -0.325 N 
ATOM     23  H   LIG    1       -5.955  -2.075  -2.376  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1       -6.222  -1.604  -0.737  0.00  0.00    +0.145 HD
ENDBRANCH   6  20
TORSDOF 4