REMARK  Name = BDB049481
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.091   0.319  -0.224  0.00  0.00    +0.059 C 
ATOM      2  C   LIG    1        0.864   0.045  -1.068  0.00  0.00    +0.037 C 
ATOM      3  C   LIG    1        1.891  -1.036  -0.826  0.00  0.00    +0.028 C 
ENDROOT
BRANCH   2   4
ATOM      4  C   LIG    1       -0.497  -0.039  -0.416  0.00  0.00    -0.043 A 
ATOM      5  C   LIG    1       -1.015   1.032   0.330  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1       -2.278   0.964   0.924  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -3.056  -0.181   0.776  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1       -2.571  -1.252   0.032  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1       -1.307  -1.178  -0.559  0.00  0.00    +0.004 A 
ENDBRANCH   2   4
BRANCH   1  10
ATOM     10  N   LIG    1        3.148   1.177  -0.758  0.00  0.00    -0.327 NA
ATOM     11  H   LIG    1        4.040   0.965  -0.312  0.00  0.00    +0.118 HD
ATOM     12  H   LIG    1        2.954   2.156  -0.552  0.00  0.00    +0.118 HD
ENDBRANCH   1  10
TORSDOF 2