REMARK  Name = BDB008972
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.835   0.434   2.528  0.00  0.00    +0.092 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.554  -0.646   1.726  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1        2.455  -0.252   0.597  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1        2.652   1.192   0.231  0.00  0.00    +0.037 C 
ATOM      5  C   LIG    1        3.353   1.390  -1.117  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1        4.519   0.423  -1.281  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1        4.044  -1.028  -1.183  0.00  0.00    +0.041 C 
ATOM      8  C   LIG    1        3.073  -1.251  -0.057  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1        2.823  -2.663   0.330  0.00  0.00    +0.268 A 
ATOM     10  O   LIG    1        3.356  -3.598  -0.260  0.00  0.00    -0.266 OA
ATOM     11  N   LIG    1        1.972  -2.852   1.385  0.00  0.00    -0.243 N 
ATOM     12  H   LIG    1        1.772  -3.809   1.654  0.00  0.00    +0.192 HD
ATOM     13  N   LIG    1        1.341  -1.875   2.088  0.00  0.00    -0.175 NA
ENDBRANCH   1   2
BRANCH   1  18
ATOM     14  C   LIG    1       -2.416   0.786   0.547  0.00  0.00    +0.128 A 
ATOM     15  N   LIG    1       -2.683   2.108   0.682  0.00  0.00    -0.240 NA
ATOM     16  C   LIG    1       -1.826   2.862   1.402  0.00  0.00    +0.113 A 
ATOM     17  C   LIG    1       -0.683   2.368   2.002  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1       -0.389   1.013   1.855  0.00  0.00    -0.037 A 
ATOM     19  C   LIG    1       -1.288   0.214   1.132  0.00  0.00    +0.048 A 
BRANCH  14  22
ATOM     20  O   LIG    1       -2.322  -2.091  -0.410  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1       -3.216  -1.289  -0.627  0.00  0.00    +0.221 C 
ATOM     22  N   LIG    1       -3.339   0.033  -0.205  0.00  0.00    -0.256 N 
ATOM     23  C   LIG    1       -4.504   0.665  -0.774  0.00  0.00    +0.115 C 
ATOM     24  C   LIG    1       -5.394  -0.499  -1.157  0.00  0.00    +0.029 C 
ATOM     25  C   LIG    1       -4.405  -1.596  -1.510  0.00  0.00    +0.098 C 
ENDBRANCH  14  22
ENDBRANCH   1  18
TORSDOF 3