REMARK  Name = BDB049936
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.642   0.072  -0.229  0.00  0.00    +0.148 A 
ATOM      2  C   LIG    1       -3.861   0.258   0.400  0.00  0.00    +0.125 A 
ATOM      3  C   LIG    1       -5.003   0.533  -0.329  0.00  0.00    +0.183 A 
ATOM      4  N   LIG    1       -6.089   0.684   0.493  0.00  0.00    -0.216 NA
ATOM      5  C   LIG    1       -5.628   0.479   1.706  0.00  0.00    +0.199 A 
ATOM      6  N   LIG    1       -5.021   0.634  -1.668  0.00  0.00    -0.214 NA
ATOM      7  C   LIG    1       -3.816   0.420  -2.209  0.00  0.00    +0.225 A 
ATOM      8  N   LIG    1       -4.287   0.213   1.699  0.00  0.00    -0.340 N 
ATOM      9  H   LIG    1       -3.717  -0.009   2.503  0.00  0.00    +0.167 HD
ATOM     10  N   LIG    1       -2.653   0.150  -1.577  0.00  0.00    -0.219 NA
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1       -1.474  -0.193   0.486  0.00  0.00    -0.327 N 
ATOM     12  H   LIG    1       -1.445   0.325   1.356  0.00  0.00    +0.148 HD
BRANCH  11  13
ATOM     13  C   LIG    1       -0.242  -0.100  -0.292  0.00  0.00    +0.103 C 
BRANCH  13  14
ATOM     14  C   LIG    1        0.948  -0.433   0.610  0.00  0.00    +0.019 C 
BRANCH  14  15
ATOM     15  C   LIG    1        2.268  -0.362  -0.159  0.00  0.00    +0.002 C 
BRANCH  15  16
ATOM     16  C   LIG    1        3.456  -0.692   0.748  0.00  0.00    -0.000 C 
BRANCH  16  18
ATOM     17  C   LIG    1        5.223   0.609  -0.556  0.00  0.00    +0.004 C 
ATOM     18  C   LIG    1        4.792  -0.738   0.004  0.00  0.00    -0.003 C 
ENDBRANCH  16  18
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH  11  13
ENDBRANCH   1  11
TORSDOF 6