REMARK  Name = BDB054282
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.899  -0.484  -0.109  0.00  0.00    -0.147 NA
ATOM      2  N   LIG    1       -0.393   0.496  -0.701  0.00  0.00    -0.149 NA
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        1.012   0.456  -0.637  0.00  0.00    +0.087 A 
ATOM      4  C   LIG    1        1.707   0.331   0.576  0.00  0.00    +0.035 A 
ATOM      5  C   LIG    1        3.107   0.317   0.602  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1        3.861   0.273   1.901  0.00  0.00    +0.046 C 
ATOM      7  C   LIG    1        5.220  -0.385   1.727  0.00  0.00    +0.101 C 
ATOM      8  C   LIG    1        5.966   0.160   0.530  0.00  0.00    +0.218 C 
ATOM      9  N   LIG    1        5.213   0.461  -0.574  0.00  0.00    -0.285 N 
ATOM     10  H   LIG    1        5.734   0.697  -1.408  0.00  0.00    +0.155 HD
ATOM     11  O   LIG    1        7.191   0.241   0.500  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        3.816   0.453  -0.595  0.00  0.00    +0.037 A 
ATOM     13  C   LIG    1        3.142   0.612  -1.804  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1        1.744   0.610  -1.820  0.00  0.00    +0.031 A 
ENDBRANCH   2   3
BRANCH   1  20
ATOM     15  C   LIG    1       -5.190   1.699   1.108  0.00  0.00    +0.047 C 
ATOM     16  C   LIG    1       -4.432   0.608   0.409  0.00  0.00    -0.007 A 
ATOM     17  C   LIG    1       -5.100  -0.419  -0.262  0.00  0.00    +0.122 A 
ATOM     18  C   LIG    1       -4.398  -1.444  -0.900  0.00  0.00    +0.070 A 
ATOM     19  C   LIG    1       -2.999  -1.442  -0.906  0.00  0.00    +0.056 A 
ATOM     20  C   LIG    1       -2.307  -0.439  -0.192  0.00  0.00    +0.107 A 
ATOM     21  C   LIG    1       -3.032   0.578   0.452  0.00  0.00    +0.038 A 
BRANCH  19  22
ATOM     22  N   LIG    1       -2.311  -2.550  -1.448  0.00  0.00    -0.356 N 
ATOM     23  H   LIG    1       -2.764  -2.963  -2.256  0.00  0.00    +0.142 HD
ATOM     24  H   LIG    1       -1.328  -2.335  -1.611  0.00  0.00    +0.142 HD
ENDBRANCH  19  22
BRANCH  17  25
ATOM     25  O   LIG    1       -6.467  -0.413  -0.269  0.00  0.00    -0.506 OA
ATOM     26  H   LIG    1       -6.782  -1.206  -0.732  0.00  0.00    +0.292 HD
ENDBRANCH  17  25
ENDBRANCH   1  20
TORSDOF 4