REMARK  Name = BDB030274
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.380  -0.429   0.609  0.00  0.00    +0.085 C 
ATOM      2  C   LIG    1        2.098   0.016  -0.813  0.00  0.00    +0.024 C 
ATOM      3  C   LIG    1        0.867  -0.423  -1.532  0.00  0.00    +0.112 C 
ATOM      4  N   LIG    1       -0.234   0.131  -0.763  0.00  0.00    -0.296 N 
ATOM      5  C   LIG    1       -1.541  -0.134  -1.159  0.00  0.00    +0.267 C 
ATOM      6  O   LIG    1       -1.753  -0.874  -2.124  0.00  0.00    -0.268 OA
ATOM      7  C   LIG    1        0.198   0.996   0.330  0.00  0.00    +0.112 C 
ATOM      8  C   LIG    1        1.689   0.888   0.321  0.00  0.00    +0.024 C 
ENDROOT
BRANCH   5   9
ATOM      9  C   LIG    1       -2.681   0.466  -0.427  0.00  0.00    +0.147 A 
ATOM     10  N   LIG    1       -2.582   1.319   0.611  0.00  0.00    -0.169 NA
ATOM     11  N   LIG    1       -3.850   1.597   0.949  0.00  0.00    -0.281 N 
ATOM     12  H   LIG    1       -4.010   2.232   1.725  0.00  0.00    +0.189 HD
ATOM     13  C   LIG    1       -4.782   0.968   0.174  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1       -4.053   0.227  -0.729  0.00  0.00    +0.057 A 
BRANCH  13  15
ATOM     15  C   LIG    1       -6.254   1.146   0.384  0.00  0.00    +0.031 C 
ATOM     16  C   LIG    1       -6.919  -0.183   0.741  0.00  0.00    +0.014 C 
ATOM     17  C   LIG    1       -6.911   1.765  -0.850  0.00  0.00    +0.014 C 
ENDBRANCH  13  15
ENDBRANCH   5   9
BRANCH   1  20
ATOM     18  N   LIG    1        4.623  -1.244   0.458  0.00  0.00    -0.313 N 
ATOM     19  H   LIG    1        4.290  -1.676  -0.394  0.00  0.00    +0.149 HD
ATOM     20  C   LIG    1        3.763  -0.421   1.140  0.00  0.00    +0.217 C 
ATOM     21  O   LIG    1        4.057   0.268   2.106  0.00  0.00    -0.275 OA
BRANCH  18  23
ATOM     22  C   LIG    1        6.758  -0.120   0.031  0.00  0.00    +0.027 C 
ATOM     23  C   LIG    1        6.049  -1.270   0.744  0.00  0.00    +0.067 C 
ATOM     24  C   LIG    1        6.643  -2.612   0.331  0.00  0.00    +0.027 C 
ENDBRANCH  18  23
ENDBRANCH   1  20
TORSDOF 4