REMARK  Name = BDB055353
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.462   1.880   0.774  0.00  0.00    +0.064 C 
ATOM      2  C   LIG    1       -4.474   0.522   0.167  0.00  0.00    +0.021 A 
ATOM      3  N   LIG    1       -3.324  -0.205  -0.079  0.00  0.00    -0.314 N 
ATOM      4  C   LIG    1       -3.677  -1.413  -0.646  0.00  0.00    +0.111 A 
ATOM      5  C   LIG    1       -2.661  -2.374  -1.007  0.00  0.00    +0.273 A 
ATOM      6  N   LIG    1       -1.365  -1.966  -0.739  0.00  0.00    -0.319 N 
ATOM      7  H   LIG    1       -0.643  -2.636  -0.972  0.00  0.00    +0.169 HD
ATOM      8  C   LIG    1       -1.025  -0.758  -0.166  0.00  0.00    +0.066 A 
ATOM      9  O   LIG    1       -2.883  -3.470  -1.512  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -5.050  -1.459  -0.761  0.00  0.00    +0.033 A 
ATOM     11  C   LIG    1       -1.992   0.118   0.160  0.00  0.00    +0.118 A 
ATOM     12  C   LIG    1       -5.552  -0.240  -0.249  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1        0.398  -0.465   0.055  0.00  0.00    -0.000 A 
ATOM     14  C   LIG    1        1.302  -0.512  -1.012  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1        2.659  -0.241  -0.803  0.00  0.00    +0.007 A 
ATOM     16  C   LIG    1        3.157   0.088   0.469  0.00  0.00    -0.016 A 
ATOM     17  C   LIG    1        2.238   0.115   1.531  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1        0.879  -0.153   1.331  0.00  0.00    +0.010 A 
BRANCH  16  19
ATOM     19  C   LIG    1        4.626   0.358   0.684  0.00  0.00    +0.091 C 
ATOM     20  C   LIG    1        5.083   1.586   1.431  0.00  0.00    +0.043 C 
ATOM     21  C   LIG    1        5.293   1.495  -0.050  0.00  0.00    +0.043 C 
BRANCH  19  22
ATOM     22  O   LIG    1        5.466  -0.795   0.864  0.00  0.00    -0.384 OA
ATOM     23  H   LIG    1        5.004  -1.476   1.383  0.00  0.00    +0.211 HD
ENDBRANCH  19  22
ENDBRANCH  16  19
ENDBRANCH   8  13
TORSDOF 3