REMARK  Name = BDB064179
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.075   0.254  -0.749  0.00  0.00    +0.144 A 
ATOM      2  N   LIG    1        0.545  -0.602  -1.645  0.00  0.00    -0.132 NA
ATOM      3  N   LIG    1       -0.827  -0.694  -1.847  0.00  0.00    -0.132 NA
ATOM      4  C   LIG    1       -1.681   0.074  -1.149  0.00  0.00    +0.146 A 
ATOM      5  C   LIG    1       -1.174   0.994  -0.250  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1        0.207   1.082  -0.049  0.00  0.00    +0.049 A 
ENDROOT
BRANCH   1  12
ATOM      7  C   LIG    1        6.931  -1.085   1.714  0.00  0.00    +0.109 C 
ATOM      8  C   LIG    1        6.533  -0.740   0.302  0.00  0.00    +0.213 C 
ATOM      9  N   LIG    1        5.198  -0.458   0.074  0.00  0.00    -0.299 N 
ATOM     10  C   LIG    1        4.760  -0.203  -1.303  0.00  0.00    +0.126 C 
ATOM     11  C   LIG    1        3.261  -0.474  -1.510  0.00  0.00    +0.125 C 
ATOM     12  N   LIG    1        2.454   0.333  -0.577  0.00  0.00    -0.311 N 
ATOM     13  C   LIG    1        2.997   0.539   0.775  0.00  0.00    +0.125 C 
ATOM     14  C   LIG    1        4.154  -0.427   1.104  0.00  0.00    +0.126 C 
ATOM     15  O   LIG    1        7.378  -0.712  -0.593  0.00  0.00    -0.276 OA
ENDBRANCH   1  12
BRANCH   4  16
ATOM     16  N   LIG    1       -3.044  -0.057  -1.423  0.00  0.00    -0.298 N 
ATOM     17  H   LIG    1       -3.165  -0.738  -2.168  0.00  0.00    +0.154 HD
BRANCH  16  18
ATOM     18  C   LIG    1       -4.181   0.056  -0.604  0.00  0.00    +0.032 A 
ATOM     19  C   LIG    1       -4.134   0.087   0.792  0.00  0.00    +0.023 A 
ATOM     20  C   LIG    1       -5.303   0.229   1.551  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1       -6.548   0.339   0.925  0.00  0.00    -0.050 A 
ATOM     22  C   LIG    1       -7.795   0.525   1.737  0.00  0.00    +0.044 C 
ATOM     23  C   LIG    1       -6.603   0.327  -0.470  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1       -5.433   0.183  -1.223  0.00  0.00    +0.023 A 
ENDBRANCH  16  18
ENDBRANCH   4  16
TORSDOF 3