REMARK  Name = BDB025271
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.411  -2.343  -0.243  0.00  0.00    +0.052 A 
ATOM      2  C   LIG    1       -3.384  -0.959  -0.028  0.00  0.00    +0.029 A 
ATOM      3  C   LIG    1       -2.144  -0.291   0.073  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1       -1.782   1.074   0.278  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1       -0.395   1.135   0.278  0.00  0.00    +0.142 A 
ATOM      6  N   LIG    1        0.088  -0.140   0.101  0.00  0.00    -0.313 N 
ATOM      7  N   LIG    1        0.370   2.237   0.422  0.00  0.00    -0.237 NA
ATOM      8  C   LIG    1       -0.351   3.367   0.599  0.00  0.00    +0.113 A 
ATOM      9  C   LIG    1       -1.736   3.447   0.625  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -2.482   2.280   0.459  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1       -0.961  -1.033  -0.044  0.00  0.00    +0.052 A 
ATOM     12  C   LIG    1       -0.979  -2.421  -0.261  0.00  0.00    +0.028 A 
ATOM     13  C   LIG    1       -2.220  -3.060  -0.358  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   6  14
ATOM     14  C   LIG    1        1.512  -0.466   0.046  0.00  0.00    +0.176 C 
ATOM     15  C   LIG    1        2.245   0.012   1.295  0.00  0.00    +0.242 C 
ATOM     16  O   LIG    1        1.825  -0.173   2.437  0.00  0.00    -0.273 OA
ATOM     17  N   LIG    1        3.488   0.569   1.104  0.00  0.00    -0.255 N 
ATOM     18  H   LIG    1        3.960   0.871   1.946  0.00  0.00    +0.158 HD
ATOM     19  C   LIG    1        4.294   0.412   0.007  0.00  0.00    +0.219 C 
ATOM     20  O   LIG    1        5.492   0.674   0.054  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1        3.654  -0.205  -1.213  0.00  0.00    +0.099 C 
ATOM     22  C   LIG    1        2.159   0.060  -1.239  0.00  0.00    +0.044 C 
ENDBRANCH   6  14
BRANCH   1  24
ATOM     23  N   LIG    1       -5.688  -3.572  -0.435  0.00  0.00    -0.191 NA
ATOM     24  C   LIG    1       -4.669  -3.022  -0.347  0.00  0.00    +0.099 C 
ENDBRANCH   1  24
TORSDOF 2