REMARK  Name = BDB016574
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.993  -0.825   0.765  0.00  0.00    -0.337 N 
ATOM      2  H   LIG    1        1.056  -0.871   1.785  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        2.165  -0.310   0.209  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1        3.304  -0.046   0.869  0.00  0.00    +0.129 A 
ATOM      5 CL   LIG    1        3.415  -0.325   2.579  0.00  0.00    -0.076 Cl
ATOM      6  C   LIG    1        4.513   0.514   0.199  0.00  0.00    +0.287 A 
ATOM      7  O   LIG    1        5.551   0.720   0.826  0.00  0.00    -0.265 OA
ATOM      8  N   LIG    1        4.371   0.790  -1.157  0.00  0.00    -0.231 N 
ATOM      9  C   LIG    1        5.496   1.310  -1.913  0.00  0.00    +0.176 C 
ATOM     10  N   LIG    1        3.253   0.478  -1.888  0.00  0.00    -0.175 NA
ATOM     11  C   LIG    1        2.252  -0.030  -1.248  0.00  0.00    +0.157 A 
ENDBRANCH   1   3
BRANCH   1  17
ATOM     12  C   LIG    1       -4.557   0.019  -0.289  0.00  0.00    +0.024 C 
ATOM     13  C   LIG    1       -3.063  -0.268  -0.108  0.00  0.00    +0.053 C 
ATOM     14  N   LIG    1       -2.781  -1.291   0.913  0.00  0.00    -0.301 NA
ATOM     15  C   LIG    1       -3.305  -0.976   2.243  0.00  0.00    +0.105 C 
ATOM     16  C   LIG    1       -1.341  -1.625   0.975  0.00  0.00    +0.106 C 
ATOM     17  C   LIG    1       -0.374  -0.626   0.276  0.00  0.00    +0.084 C 
ATOM     18  C   LIG    1       -0.828   0.809   0.550  0.00  0.00    +0.025 C 
ATOM     19  C   LIG    1       -2.282   1.039   0.126  0.00  0.00    +0.020 C 
ENDBRANCH   1  17
TORSDOF 2