REMARK  Name = BDB060425
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.075  -0.678  -0.155  0.00  0.00    -0.281 N 
ATOM      2  H   LIG    1       -0.082  -0.018  -0.922  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        1.163  -1.072   0.320  0.00  0.00    +0.248 C 
ATOM      4  O   LIG    1        1.391  -1.731   1.326  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  14
ATOM      5  C   LIG    1       -3.895   3.360  -1.288  0.00  0.00    +0.129 C 
ATOM      6  N   LIG    1       -3.889   2.017  -0.764  0.00  0.00    -0.302 N 
ATOM      7  H   LIG    1       -3.522   1.905   0.172  0.00  0.00    +0.150 HD
ATOM      8  C   LIG    1       -4.942   1.173  -1.033  0.00  0.00    +0.306 C 
ATOM      9  N   LIG    1       -4.918  -0.056  -0.363  0.00  0.00    -0.255 N 
ATOM     10  C   LIG    1       -3.770  -0.697   0.212  0.00  0.00    +0.043 A 
ATOM     11  C   LIG    1       -3.942  -1.670   1.212  0.00  0.00    -0.026 A 
ATOM     12  C   LIG    1       -2.824  -2.257   1.820  0.00  0.00    +0.007 A 
ATOM     13  C   LIG    1       -1.532  -1.931   1.403  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -1.341  -1.025   0.364  0.00  0.00    +0.035 A 
ATOM     15  C   LIG    1       -5.320  -2.079   1.648  0.00  0.00    +0.038 C 
ATOM     16  C   LIG    1       -6.231  -2.058   0.435  0.00  0.00    +0.024 C 
ATOM     17  C   LIG    1       -2.463  -0.426  -0.229  0.00  0.00    +0.047 A 
ATOM     18  C   LIG    1       -6.235  -0.666  -0.173  0.00  0.00    +0.115 C 
ATOM     19  O   LIG    1       -5.878   1.527  -1.749  0.00  0.00    -0.252 OA
ENDBRANCH   1  14
BRANCH   3  20
ATOM     20  C   LIG    1        2.320  -0.586  -0.483  0.00  0.00    +0.038 A 
ATOM     21  C   LIG    1        3.490  -0.211   0.191  0.00  0.00    +0.021 A 
ATOM     22  C   LIG    1        4.614   0.254  -0.511  0.00  0.00    -0.017 A 
ATOM     23  C   LIG    1        4.533   0.322  -1.913  0.00  0.00    +0.008 A 
ATOM     24  C   LIG    1        3.376  -0.069  -2.592  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        2.269  -0.527  -1.880  0.00  0.00    +0.013 A 
BRANCH  22  26
ATOM     26  C   LIG    1        5.842   0.653   0.199  0.00  0.00    -0.018 A 
ATOM     27  C   LIG    1        6.451   1.896  -0.046  0.00  0.00    +0.008 A 
ATOM     28  C   LIG    1        7.615   2.275   0.629  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        8.192   1.416   1.560  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.605   0.180   1.819  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1        6.441  -0.197   1.144  0.00  0.00    +0.008 A 
ENDBRANCH  22  26
ENDBRANCH   3  20
TORSDOF 3