REMARK  Name = BDB054149
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.259  -0.828  -0.265  0.00  0.00    +0.086 C 
ATOM      2  C   LIG    1        1.855  -0.330  -0.078  0.00  0.00    +0.107 A 
ATOM      3  N   LIG    1        1.719   0.882   0.537  0.00  0.00    -0.311 N 
ATOM      4  H   LIG    1        2.525   1.406   0.845  0.00  0.00    +0.170 HD
ATOM      5  C   LIG    1        0.503   1.466   0.777  0.00  0.00    +0.259 A 
ATOM      6  O   LIG    1        0.404   2.555   1.330  0.00  0.00    -0.267 OA
ATOM      7  C   LIG    1       -0.674   0.704   0.328  0.00  0.00    +0.066 A 
ATOM      8  C   LIG    1       -0.452  -0.530  -0.294  0.00  0.00    +0.096 A 
ATOM      9  C   LIG    1       -1.577  -1.255  -0.721  0.00  0.00    +0.067 A 
ATOM     10  C   LIG    1       -2.872  -0.756  -0.528  0.00  0.00    +0.022 A 
ATOM     11  C   LIG    1       -3.066   0.477   0.094  0.00  0.00    +0.002 A 
ATOM     12 CL   LIG    1       -1.412  -2.790  -1.500  0.00  0.00    -0.081 Cl
ATOM     13  C   LIG    1       -1.965   1.212   0.525  0.00  0.00    +0.015 A 
ATOM     14  N   LIG    1        0.853  -1.034  -0.489  0.00  0.00    -0.233 NA
ENDROOT
TORSDOF 0