REMARK  Name = BDB056602
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.605  -0.138   0.122  0.00  0.00    +0.125 A 
ATOM      2  N   LIG    1       -0.433  -1.299   0.792  0.00  0.00    -0.239 NA
ATOM      3  C   LIG    1        0.812  -1.772   1.047  0.00  0.00    +0.123 A 
ATOM      4  C   LIG    1        1.941  -1.074   0.613  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1        1.749   0.115  -0.087  0.00  0.00    +0.052 A 
ATOM      6  N   LIG    1        2.993   0.603  -0.411  0.00  0.00    -0.354 N 
ATOM      7  H   LIG    1        3.164   1.454  -0.926  0.00  0.00    +0.166 HD
ATOM      8  C   LIG    1        3.967  -0.233   0.067  0.00  0.00    +0.050 A 
ATOM      9  C   LIG    1        3.346  -1.282   0.706  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        0.474   0.613  -0.353  0.00  0.00    +0.070 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        5.486  -0.015  -0.098  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1        6.087   1.038  -0.741  0.00  0.00    +0.114 A 
ATOM     13  N   LIG    1        7.432   0.816  -0.639  0.00  0.00    -0.284 N 
ATOM     14  H   LIG    1        8.192   1.385  -0.998  0.00  0.00    +0.188 HD
ATOM     15  N   LIG    1        7.741  -0.309   0.027  0.00  0.00    -0.182 NA
ATOM     16  C   LIG    1        6.549  -0.817   0.357  0.00  0.00    +0.144 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.899   0.360  -0.156  0.00  0.00    -0.297 N 
ATOM     18  H   LIG    1       -1.962   1.346   0.088  0.00  0.00    +0.154 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -4.280   0.583   0.320  0.00  0.00    +0.141 A 
ATOM     20  C   LIG    1       -3.158  -0.248   0.089  0.00  0.00    +0.075 A 
ATOM     21  C   LIG    1       -3.349  -1.632   0.009  0.00  0.00    +0.027 A 
ATOM     22  C   LIG    1       -4.614  -2.191   0.198  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -5.708  -1.369   0.450  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -5.545   0.017   0.508  0.00  0.00    +0.047 A 
BRANCH  19  26
ATOM     25  C   LIG    1       -5.108   2.806   0.568  0.00  0.00    +0.277 C 
ATOM     26  O   LIG    1       -4.006   1.933   0.353  0.00  0.00    -0.493 OA
ENDBRANCH  19  26
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 4