REMARK  Name = BDB018815
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.357  -1.044  -0.147  0.00  0.00    -0.009 A 
ATOM      2  C   LIG    1       -1.158  -0.367   0.059  0.00  0.00    -0.017 A 
ATOM      3  C   LIG    1       -0.968   1.062   0.456  0.00  0.00    +0.057 C 
ATOM      4  C   LIG    1        0.551   1.148   0.625  0.00  0.00    +0.118 C 
ATOM      5  N   LIG    1        1.131  -0.109   0.123  0.00  0.00    -0.269 N 
ATOM      6  C   LIG    1        2.483  -0.407   0.018  0.00  0.00    +0.241 C 
ATOM      7  O   LIG    1        2.921  -1.486  -0.392  0.00  0.00    -0.273 OA
ATOM      8  C   LIG    1        0.071  -0.999  -0.147  0.00  0.00    +0.040 A 
ATOM      9  C   LIG    1        0.126  -2.322  -0.558  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -1.072  -3.014  -0.762  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -2.306  -2.381  -0.558  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  14
ATOM     12  C   LIG    1       -4.020  -0.579   2.630  0.00  0.00    +0.068 C 
ATOM     13  C   LIG    1       -4.372  -0.177   1.246  0.00  0.00    +0.068 A 
ATOM     14  C   LIG    1       -3.632  -0.397   0.057  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1       -4.394   0.159  -0.951  0.00  0.00    +0.041 A 
ATOM     16  C   LIG    1       -4.189   0.262  -2.415  0.00  0.00    +0.065 C 
ATOM     17  N   LIG    1       -5.504   0.661  -0.330  0.00  0.00    -0.281 N 
ATOM     18  H   LIG    1       -6.294   1.139  -0.751  0.00  0.00    +0.189 HD
ATOM     19  N   LIG    1       -5.510   0.484   1.000  0.00  0.00    -0.178 NA
ENDBRANCH   1  14
BRANCH   6  20
ATOM     20  C   LIG    1        3.457   0.728   0.377  0.00  0.00    +0.170 C 
ATOM     21  N   LIG    1        4.782   0.243   0.892  0.00  0.00    -0.258 N 
ATOM     22  C   LIG    1        5.832   0.624  -0.076  0.00  0.00    +0.117 C 
ATOM     23  C   LIG    1        5.266   1.865  -0.742  0.00  0.00    +0.022 C 
ATOM     24  C   LIG    1        3.793   1.531  -0.887  0.00  0.00    +0.034 C 
BRANCH  21  25
ATOM     25  C   LIG    1        4.930  -0.675   1.855  0.00  0.00    +0.170 C 
ATOM     26  N   LIG    1        5.062  -1.439   2.714  0.00  0.00    -0.174 NA
ENDBRANCH  21  25
ENDBRANCH   6  20
TORSDOF 3