REMARK  Name = BDB028373
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.603   1.455  -1.169  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1       -1.794   0.518  -0.142  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -2.743  -0.503  -0.280  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -3.519  -0.569  -1.432  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -4.522  -1.638  -1.562  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -4.615  -2.510  -0.505  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -5.301  -3.255  -0.578  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -3.860  -2.484   0.627  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -5.229  -1.732  -2.559  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -3.352   0.370  -2.455  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -2.965  -1.545   0.754  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -2.394   1.378  -2.323  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  18
ATOM     13  C   LIG    1        0.705   2.339  -0.601  0.00  0.00    +0.076 A 
ATOM     14  N   LIG    1        1.274   3.591  -0.694  0.00  0.00    -0.266 N 
ATOM     15  C   LIG    1        2.642   3.958  -0.400  0.00  0.00    +0.173 C 
ATOM     16  N   LIG    1        0.428   4.543  -1.134  0.00  0.00    -0.179 NA
ATOM     17  C   LIG    1       -0.704   3.877  -1.361  0.00  0.00    +0.143 A 
ATOM     18  C   LIG    1       -0.602   2.503  -1.049  0.00  0.00    +0.027 A 
BRANCH  13  22
ATOM     19  C   LIG    1        2.753  -1.178   0.707  0.00  0.00    -0.048 A 
ATOM     20  C   LIG    1        2.504  -0.129   1.600  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        1.845   1.025   1.171  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1        1.430   1.149  -0.159  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        1.684   0.106  -1.055  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1        2.344  -1.048  -0.626  0.00  0.00    +0.004 A 
BRANCH  19  26
ATOM     25  C   LIG    1        4.983  -2.287   1.007  0.00  0.00    +0.009 C 
ATOM     26  C   LIG    1        3.476  -2.419   1.167  0.00  0.00    +0.032 C 
ENDBRANCH  19  26
ENDBRANCH  13  22
ENDBRANCH   1  18
BRANCH  11  27
ATOM     27  C   LIG    1       -2.100  -1.512   2.019  0.00  0.00    +0.136 C 
BRANCH  27  28
ATOM     28  N   LIG    1       -2.438  -2.624   2.917  0.00  0.00    -0.325 NA
ATOM     29  H   LIG    1       -3.444  -2.577   3.096  0.00  0.00    +0.119 HD
ATOM     30  H   LIG    1       -2.341  -3.490   2.381  0.00  0.00    +0.119 HD
ENDBRANCH  27  28
ENDBRANCH  11  27
TORSDOF 5