REMARK  Name = BDB062041
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.585   0.728  -0.045  0.00  0.00    +0.041 A 
ATOM      2  C   LIG    1       -2.656  -0.190   0.105  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1       -3.963   0.316   0.299  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1       -5.108  -0.620   0.462  0.00  0.00    +0.257 A 
ATOM      5  N   LIG    1       -4.810  -1.962   0.410  0.00  0.00    -0.329 N 
ATOM      6  H   LIG    1       -5.601  -2.586   0.522  0.00  0.00    +0.168 HD
ATOM      7  C   LIG    1       -3.555  -2.463   0.223  0.00  0.00    +0.086 A 
ATOM      8  O   LIG    1       -6.255  -0.225   0.633  0.00  0.00    -0.267 OA
ATOM      9  C   LIG    1       -4.215   1.690   0.344  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -3.163   2.582   0.197  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1       -2.496  -1.660   0.073  0.00  0.00    +0.028 A 
ATOM     12  C   LIG    1       -1.864   2.104   0.006  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   1  15
ATOM     13  O   LIG    1        0.985   2.203  -0.520  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1        0.900   0.983  -0.441  0.00  0.00    +0.222 C 
ATOM     15  N   LIG    1       -0.261   0.250  -0.235  0.00  0.00    -0.285 N 
ATOM     16  H   LIG    1       -0.145  -0.751  -0.260  0.00  0.00    +0.155 HD
BRANCH  14  17
ATOM     17  C   LIG    1        2.133   0.086  -0.548  0.00  0.00    +0.089 C 
ATOM     18  C   LIG    1        2.491  -0.465   0.839  0.00  0.00    +0.093 C 
ATOM     19  N   LIG    1        3.666  -1.341   0.782  0.00  0.00    -0.315 NA
ATOM     20  H   LIG    1        3.879  -1.678   1.722  0.00  0.00    +0.122 HD
ATOM     21  C   LIG    1        4.835  -0.626   0.263  0.00  0.00    +0.081 C 
ATOM     22  C   LIG    1        4.573  -0.060  -1.131  0.00  0.00    +0.016 C 
ATOM     23  C   LIG    1        3.334   0.831  -1.143  0.00  0.00    +0.015 C 
ENDBRANCH  14  17
ENDBRANCH   1  15
TORSDOF 2