REMARK  Name = BDB002357
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.703   0.762  -0.605  0.00  0.00    +0.234 C 
ATOM      2  N   LIG    1       -0.577   1.393  -0.111  0.00  0.00    -0.303 N 
ATOM      3  H   LIG    1       -0.615   1.685   0.859  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1       -1.677   0.031  -1.595  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        0.746   0.994  -0.578  0.00  0.00    +0.156 C 
ATOM      6  C   LIG    1        1.689   2.189  -0.595  0.00  0.00    +0.038 C 
BRANCH   5   7
ATOM      7  C   LIG    1        1.285  -0.083   0.384  0.00  0.00    +0.233 C 
ATOM      8  N   LIG    1        2.321  -0.838  -0.126  0.00  0.00    -0.311 N 
ATOM      9  H   LIG    1        2.767  -0.508  -0.974  0.00  0.00    +0.149 HD
ATOM     10  O   LIG    1        0.855  -0.215   1.530  0.00  0.00    -0.274 OA
BRANCH   8  11
ATOM     11  C   LIG    1        3.077  -1.762   0.717  0.00  0.00    +0.078 C 
ATOM     12  C   LIG    1        4.148  -1.029   1.542  0.00  0.00    +0.057 C 
ATOM     13  C   LIG    1        5.350  -0.621   0.722  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1        5.668  -1.266  -0.486  0.00  0.00    -0.044 A 
ATOM     15  C   LIG    1        6.811  -0.868  -1.197  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        7.638   0.142  -0.707  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        7.333   0.766   0.498  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        4.786  -2.340  -1.074  0.00  0.00    +0.037 C 
ATOM     19  C   LIG    1        6.197   0.385   1.212  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1        3.727  -2.873  -0.110  0.00  0.00    +0.027 C 
ENDBRANCH   8  11
ENDBRANCH   5   7
ENDBRANCH   2   5
BRANCH   1  21
ATOM     21  C   LIG    1       -2.994   1.028   0.203  0.00  0.00    +0.161 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -4.132   0.681  -0.634  0.00  0.00    -0.302 N 
ATOM     23  H   LIG    1       -4.056  -0.121  -1.259  0.00  0.00    +0.150 HD
ATOM     24  C   LIG    1       -5.283   1.427  -0.719  0.00  0.00    +0.230 C 
ATOM     25  O   LIG    1       -5.475   2.447  -0.065  0.00  0.00    -0.274 OA
BRANCH  24  26
ATOM     26  C   LIG    1       -6.283   0.880  -1.763  0.00  0.00    +0.135 C 
ATOM     27  C   LIG    1       -7.703   1.344  -1.467  0.00  0.00    +0.033 C 
BRANCH  26  28
ATOM     28  N   LIG    1       -6.216  -0.599  -1.809  0.00  0.00    -0.320 NA
ATOM     29  H   LIG    1       -6.902  -0.938  -2.483  0.00  0.00    +0.119 HD
ATOM     30  H   LIG    1       -6.516  -0.963  -0.903  0.00  0.00    +0.119 HD
ENDBRANCH  26  28
ENDBRANCH  24  26
ENDBRANCH  21  22
BRANCH  21  32
ATOM     31  C   LIG    1       -3.009  -1.259   1.371  0.00  0.00    +0.009 C 
ATOM     32  C   LIG    1       -2.983   0.263   1.548  0.00  0.00    +0.012 C 
ATOM     33  C   LIG    1       -4.136   0.699   2.457  0.00  0.00    +0.009 C 
ENDBRANCH  21  32
ENDBRANCH   1  21
TORSDOF 8