REMARK  Name = BDB055367
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        6.844  -0.615   1.385  0.00  0.00    +0.067 C 
ATOM      2  C   LIG    1        5.564  -0.267   0.724  0.00  0.00    +0.061 A 
ATOM      3  N   LIG    1        4.400  -0.618   1.286  0.00  0.00    -0.171 NA
ATOM      4  N   LIG    1        3.448  -0.156   0.439  0.00  0.00    -0.232 N 
ATOM      5  C   LIG    1        4.010   0.482  -0.646  0.00  0.00    +0.131 A 
ATOM      6  C   LIG    1        3.176   1.051  -1.669  0.00  0.00    +0.275 A 
ATOM      7  N   LIG    1        1.817   0.892  -1.460  0.00  0.00    -0.319 N 
ATOM      8  H   LIG    1        1.216   1.303  -2.164  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1        1.261   0.255  -0.368  0.00  0.00    +0.068 A 
ATOM     10  O   LIG    1        3.595   1.637  -2.663  0.00  0.00    -0.266 OA
ATOM     11  C   LIG    1        2.070  -0.267   0.570  0.00  0.00    +0.139 A 
ATOM     12  C   LIG    1        5.374   0.426  -0.489  0.00  0.00    +0.058 A 
ENDROOT
BRANCH   9  13
ATOM     13  C   LIG    1       -0.203   0.159  -0.282  0.00  0.00    -0.000 A 
ATOM     14  C   LIG    1       -0.940  -0.378  -1.342  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -2.334  -0.463  -1.266  0.00  0.00    +0.007 A 
ATOM     16  C   LIG    1       -3.036  -0.007  -0.134  0.00  0.00    -0.017 A 
ATOM     17  C   LIG    1       -2.286   0.525   0.925  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1       -0.889   0.610   0.851  0.00  0.00    +0.010 A 
BRANCH  16  19
ATOM     19  C   LIG    1       -4.558  -0.131  -0.093  0.00  0.00    +0.085 C 
ATOM     20  C   LIG    1       -4.969  -1.594   0.106  0.00  0.00    +0.046 C 
ATOM     21  C   LIG    1       -5.249   0.740   0.965  0.00  0.00    +0.046 C 
BRANCH  19  22
ATOM     22  O   LIG    1       -5.085   0.296  -1.357  0.00  0.00    -0.385 OA
ATOM     23  H   LIG    1       -4.613   1.111  -1.600  0.00  0.00    +0.211 HD
ENDBRANCH  19  22
ENDBRANCH  16  19
ENDBRANCH   9  13
TORSDOF 3