REMARK  Name = BDB055930
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.494   0.741  -0.223  0.00  0.00    -0.314 N 
ATOM      2  H   LIG    1       -2.787   1.717  -0.245  0.00  0.00    +0.152 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -3.477  -0.047  -0.887  0.00  0.00    +0.044 A 
ATOM      4  C   LIG    1       -4.757  -0.265  -0.320  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1       -5.696  -0.865  -1.178  0.00  0.00    +0.143 A 
ATOM      6  N   LIG    1       -7.017  -1.010  -0.774  0.00  0.00    -0.306 N 
ATOM      7  H   LIG    1       -7.654  -1.404  -1.451  0.00  0.00    +0.170 HD
ATOM      8  C   LIG    1       -7.524  -0.583   0.417  0.00  0.00    +0.258 A 
ATOM      9  C   LIG    1       -6.559  -0.033   1.401  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -7.042   0.307   2.676  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -6.164   0.744   3.660  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -4.807   0.817   3.374  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -4.331   0.481   2.099  0.00  0.00    +0.009 A 
ATOM     14  O   LIG    1       -8.721  -0.670   0.672  0.00  0.00    -0.267 OA
ATOM     15  N   LIG    1       -5.458  -1.292  -2.437  0.00  0.00    -0.237 NA
ATOM     16  C   LIG    1       -4.223  -1.094  -2.920  0.00  0.00    +0.115 A 
ATOM     17  C   LIG    1       -5.194   0.082   1.061  0.00  0.00    -0.000 A 
ATOM     18  C   LIG    1       -3.225  -0.466  -2.205  0.00  0.00    +0.043 A 
ENDBRANCH   1   3
BRANCH   1  22
ATOM     19  C   LIG    1        1.737   0.407  -0.326  0.00  0.00    +0.034 A 
ATOM     20  C   LIG    1        0.939  -0.726  -0.479  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -0.458  -0.620  -0.454  0.00  0.00    +0.025 A 
ATOM     22  C   LIG    1       -1.088   0.619  -0.301  0.00  0.00    +0.031 A 
ATOM     23  C   LIG    1       -0.282   1.746  -0.105  0.00  0.00    +0.025 A 
ATOM     24  C   LIG    1        1.114   1.643  -0.128  0.00  0.00    +0.025 A 
BRANCH  19  26
ATOM     25  C   LIG    1        3.967  -0.695  -0.606  0.00  0.00    +0.248 C 
ATOM     26  N   LIG    1        3.147   0.386  -0.334  0.00  0.00    -0.282 N 
ATOM     27  H   LIG    1        3.600   1.280  -0.200  0.00  0.00    +0.155 HD
ATOM     28  O   LIG    1        3.615  -1.813  -0.964  0.00  0.00    -0.270 OA
BRANCH  25  33
ATOM     29  C   LIG    1        9.664   0.320  -0.239  0.00  0.00    +0.044 C 
ATOM     30  C   LIG    1        8.191   0.043  -0.307  0.00  0.00    -0.050 A 
ATOM     31  C   LIG    1        7.311   0.660   0.591  0.00  0.00    +0.004 A 
ATOM     32  C   LIG    1        5.935   0.425   0.512  0.00  0.00    +0.013 A 
ATOM     33  C   LIG    1        5.426  -0.418  -0.484  0.00  0.00    +0.037 A 
ATOM     34  C   LIG    1        6.302  -1.040  -1.380  0.00  0.00    +0.013 A 
ATOM     35  C   LIG    1        7.675  -0.802  -1.298  0.00  0.00    +0.004 A 
ENDBRANCH  25  33
ENDBRANCH  19  26
ENDBRANCH   1  22
TORSDOF 4