REMARK  Name = BDB006054
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        5.882   1.484  -1.311  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1        4.697   1.208  -1.167  0.00  0.00    +0.273 A 
ATOM      3  C   LIG    1        4.181   0.730   0.123  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1        2.832   0.438   0.213  0.00  0.00    +0.057 A 
ATOM      5  C   LIG    1        2.240  -0.025   1.397  0.00  0.00    +0.077 A 
ATOM      6  N   LIG    1        0.859  -0.328   1.501  0.00  0.00    -0.230 NA
ATOM      7  C   LIG    1        0.137  -0.157   0.425  0.00  0.00    +0.147 A 
ATOM      8  N   LIG    1        0.668   0.295  -0.763  0.00  0.00    -0.324 N 
ATOM      9  H   LIG    1        0.036   0.400  -1.550  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1        3.063  -0.188   2.513  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1        4.433   0.104   2.439  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        1.980   0.613  -0.968  0.00  0.00    +0.162 A 
ATOM     13  N   LIG    1        2.438   1.036  -2.108  0.00  0.00    -0.153 NA
ATOM     14  C   LIG    1        4.995   0.564   1.244  0.00  0.00    +0.014 A 
ATOM     15  N   LIG    1        3.775   1.323  -2.186  0.00  0.00    -0.241 N 
ATOM     16  H   LIG    1        4.114   1.652  -3.085  0.00  0.00    +0.192 HD
ENDROOT
BRANCH   7  17
ATOM     17  C   LIG    1       -1.354  -0.470   0.490  0.00  0.00    +0.303 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -1.935  -0.212  -0.785  0.00  0.00    -0.484 OA
BRANCH  18  19
ATOM     19  C   LIG    1       -3.277  -0.442  -0.908  0.00  0.00    +0.121 A 
ATOM     20  C   LIG    1       -4.127  -0.903   0.099  0.00  0.00    +0.045 A 
ATOM     21  C   LIG    1       -5.487  -1.095  -0.165  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -6.003  -0.827  -1.432  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -5.159  -0.366  -2.439  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -3.802  -0.175  -2.176  0.00  0.00    +0.045 A 
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   7  17
TORSDOF 3