REMARK  Name = BDB055261
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.013  -1.048   0.001  0.00  0.00    -0.009 A 
ATOM      2  C   LIG    1       -1.040  -0.203  -0.547  0.00  0.00    +0.056 A 
ATOM      3  C   LIG    1        0.314  -0.527  -0.446  0.00  0.00    +0.144 A 
ATOM      4  O   LIG    1        1.183   0.364  -1.007  0.00  0.00    -0.473 OA
ATOM      5  C   LIG    1        2.572   0.072  -0.865  0.00  0.00    +0.289 C 
ATOM      6  C   LIG    1        3.036  -1.248  -0.209  0.00  0.00    +0.263 C 
ATOM      7  N   LIG    1        2.046  -2.039   0.303  0.00  0.00    -0.279 N 
ATOM      8  H   LIG    1        2.341  -2.898   0.749  0.00  0.00    +0.155 HD
ATOM      9  O   LIG    1        4.212  -1.604  -0.137  0.00  0.00    -0.271 OA
ATOM     10  C   LIG    1        0.701  -1.700   0.201  0.00  0.00    +0.076 A 
ATOM     11  C   LIG    1       -0.260  -2.552   0.746  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1       -1.615  -2.225   0.646  0.00  0.00    +0.011 A 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1       -4.504  -2.774  -1.301  0.00  0.00    +0.070 C 
ATOM     14  C   LIG    1       -4.510  -1.445  -0.646  0.00  0.00    +0.088 A 
ATOM     15  C   LIG    1       -3.418  -0.717  -0.103  0.00  0.00    +0.047 A 
ATOM     16  C   LIG    1       -3.993   0.445   0.366  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1       -3.494   1.650   1.056  0.00  0.00    +0.090 C 
ATOM     18  O   LIG    1       -5.329   0.415   0.114  0.00  0.00    -0.359 OA
ATOM     19  N   LIG    1       -5.658  -0.770  -0.516  0.00  0.00    -0.083 NA
ENDBRANCH   1  15
BRANCH   5  20
ATOM     20  C   LIG    1        3.236   1.268  -0.194  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        4.399   1.833  -0.741  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        5.022   2.917  -0.121  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        4.496   3.446   1.056  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        3.348   2.891   1.616  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        2.723   1.806   0.998  0.00  0.00    +0.008 A 
ENDBRANCH   5  20
TORSDOF 2