REMARK  Name = BDB000737
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.781  -0.041   0.491  0.00  0.00    +0.121 A 
ATOM      2  C   LIG    1       -1.641  -0.849   0.490  0.00  0.00    +0.057 A 
ATOM      3  C   LIG    1       -0.357  -0.342   0.156  0.00  0.00    +0.025 A 
ATOM      4  C   LIG    1       -0.255   1.014  -0.205  0.00  0.00    +0.074 A 
ATOM      5  N   LIG    1        0.896   1.590  -0.572  0.00  0.00    -0.247 NA
ATOM      6  C   LIG    1        2.008   0.850  -0.655  0.00  0.00    +0.075 A 
ATOM      7  C   LIG    1        2.046  -0.519  -0.321  0.00  0.00    +0.022 A 
ATOM      8  C   LIG    1        3.270  -1.217  -0.487  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1        4.417  -0.570  -0.945  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1        4.357   0.781  -1.245  0.00  0.00    +0.043 A 
ATOM     11 CL   LIG    1        5.763   1.597  -1.807  0.00  0.00    -0.083 Cl
ATOM     12  C   LIG    1        3.161   1.478  -1.101  0.00  0.00    +0.048 A 
ATOM     13  C   LIG    1       -1.395   1.804  -0.193  0.00  0.00    +0.032 A 
ATOM     14  C   LIG    1        0.844  -1.104   0.167  0.00  0.00    +0.043 A 
ATOM     15  C   LIG    1       -2.652   1.297   0.152  0.00  0.00    +0.048 A 
ENDROOT
BRANCH  14  16
ATOM     16  N   LIG    1        0.805  -2.492   0.477  0.00  0.00    -0.357 N 
ATOM     17  H   LIG    1        1.686  -2.850   0.828  0.00  0.00    +0.142 HD
ATOM     18  H   LIG    1        0.053  -2.740   1.111  0.00  0.00    +0.142 HD
ENDBRANCH  14  16
BRANCH   1  20
ATOM     19  C   LIG    1       -5.130   0.097   0.823  0.00  0.00    +0.277 C 
ATOM     20  O   LIG    1       -3.938  -0.679   0.840  0.00  0.00    -0.495 OA
ENDBRANCH   1  20
TORSDOF 2