REMARK  Name = BDB048361
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.411  -1.063   0.581  0.00  0.00    +0.150 A 
ATOM      2  C   LIG    1        1.711  -0.576   0.269  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1        2.159   0.655  -0.432  0.00  0.00    +0.148 C 
ATOM      4  N   LIG    1        3.620   0.634  -0.651  0.00  0.00    -0.297 N 
ATOM      5  C   LIG    1        4.461   0.003   0.394  0.00  0.00    +0.114 C 
ATOM      6  C   LIG    1        4.049  -1.452   0.707  0.00  0.00    +0.074 C 
ATOM      7  C   LIG    1        4.104   1.566  -1.561  0.00  0.00    +0.213 C 
ATOM      8  O   LIG    1        3.360   2.303  -2.210  0.00  0.00    -0.276 OA
ATOM      9  C   LIG    1        5.597   1.646  -1.746  0.00  0.00    +0.109 C 
ATOM     10  C   LIG    1        2.576  -1.511   0.788  0.00  0.00    +0.044 A 
ATOM     11  N   LIG    1        1.810  -2.476   1.350  0.00  0.00    -0.279 N 
ATOM     12  H   LIG    1        2.098  -3.329   1.819  0.00  0.00    +0.189 HD
ATOM     13  N   LIG    1        0.498  -2.221   1.249  0.00  0.00    -0.158 NA
ENDROOT
BRANCH   1  14
ATOM     14  N   LIG    1       -0.710  -0.390   0.220  0.00  0.00    -0.298 N 
ATOM     15  H   LIG    1       -0.588   0.455  -0.324  0.00  0.00    +0.154 HD
BRANCH  14  18
ATOM     16  C   LIG    1       -4.413   0.030   0.065  0.00  0.00    -0.046 A 
ATOM     17  C   LIG    1       -3.032   0.231  -0.101  0.00  0.00    +0.027 A 
ATOM     18  C   LIG    1       -2.082  -0.661   0.431  0.00  0.00    +0.033 A 
ATOM     19  C   LIG    1       -2.557  -1.764   1.145  0.00  0.00    +0.023 A 
ATOM     20  C   LIG    1       -3.928  -1.974   1.325  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1       -4.852  -1.080   0.790  0.00  0.00    +0.004 A 
BRANCH  16  23
ATOM     22  C   LIG    1       -5.702   2.142   0.471  0.00  0.00    +0.009 C 
ATOM     23  C   LIG    1       -5.403   1.014  -0.504  0.00  0.00    +0.032 C 
ENDBRANCH  16  23
ENDBRANCH  14  18
ENDBRANCH   1  14
TORSDOF 3