REMARK  Name = BDB051607
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.957  -0.599   0.360  0.00  0.00    -0.220 N 
ATOM      2  C   LIG    1       -1.713  -1.745   0.554  0.00  0.00    +0.141 A 
ATOM      3 CL   LIG    1       -1.068  -3.321   0.676  0.00  0.00    -0.061 Cl
ATOM      4  C   LIG    1       -3.007  -1.339   0.719  0.00  0.00    +0.040 A 
ATOM      5  C   LIG    1       -2.998   0.101   0.691  0.00  0.00    +0.107 A 
ATOM      6  C   LIG    1       -4.207   0.812   0.858  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1       -5.352  -0.005   1.049  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1       -5.300  -1.431   1.075  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -4.112  -2.169   0.914  0.00  0.00    +0.013 A 
ATOM     10  N   LIG    1       -1.740   0.518   0.485  0.00  0.00    -0.164 NA
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1        3.150   0.108  -0.553  0.00  0.00    -0.033 A 
ATOM     12  C   LIG    1        2.328   1.127  -0.066  0.00  0.00    +0.007 A 
ATOM     13  C   LIG    1        0.982   0.877   0.223  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1        0.428  -0.405   0.046  0.00  0.00    +0.067 A 
ATOM     15  C   LIG    1        1.248  -1.418  -0.460  0.00  0.00    +0.028 A 
ATOM     16  C   LIG    1        2.595  -1.163  -0.750  0.00  0.00    +0.007 A 
BRANCH  11  17
ATOM     17  C   LIG    1        4.603   0.368  -0.872  0.00  0.00    +0.116 C 
BRANCH  17  19
ATOM     18  C   LIG    1        6.878  -0.110  -0.254  0.00  0.00    +0.101 C 
ATOM     19  N   LIG    1        5.478  -0.408   0.007  0.00  0.00    -0.315 NA
ATOM     20  H   LIG    1        5.255  -0.175   0.975  0.00  0.00    +0.122 HD
ENDBRANCH  17  19
ENDBRANCH  11  17
ENDBRANCH   1  14
BRANCH   6  21
ATOM     21  C   LIG    1       -4.275   2.282   0.868  0.00  0.00    +0.244 C 
ATOM     22  O   LIG    1       -3.404   2.989   1.351  0.00  0.00    -0.270 OA
ATOM     23  N   LIG    1       -5.393   2.839   0.303  0.00  0.00    -0.325 N 
ATOM     24  H   LIG    1       -5.368   3.845   0.197  0.00  0.00    +0.145 HD
ATOM     25  H   LIG    1       -5.983   2.319  -0.332  0.00  0.00    +0.145 HD
ENDBRANCH   6  21
TORSDOF 4