REMARK  Name = BDB026664
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.748   0.528   0.779  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        3.478  -0.824   0.528  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.174  -1.203   0.178  0.00  0.00    +0.090 A 
ATOM      4  N   LIG    1        1.703  -2.447  -0.126  0.00  0.00    -0.232 NA
ATOM      5  C   LIG    1        0.427  -2.288  -0.402  0.00  0.00    +0.118 A 
ATOM      6  N   LIG    1        0.028  -0.963  -0.276  0.00  0.00    -0.296 N 
ATOM      7  C   LIG    1        1.165  -0.245   0.095  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        1.432   1.121   0.293  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        2.738   1.488   0.644  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -1.284  -0.442  -0.465  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -1.767   0.571   0.375  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -3.056   1.089   0.190  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -3.636   2.095   1.146  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -4.662   2.980   0.458  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -5.651   2.176  -0.355  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -5.155   1.079  -1.008  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -5.793   0.627  -1.650  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -6.817   2.531  -0.510  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.862   0.579  -0.832  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1       -3.398  -0.441  -1.658  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -2.108  -0.948  -1.480  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   1  25
ATOM     22  C   LIG    1        6.566   2.387   2.477  0.00  0.00    +0.128 C 
ATOM     23  N   LIG    1        5.272   2.014   1.963  0.00  0.00    -0.314 N 
ATOM     24  H   LIG    1        4.457   2.347   2.459  0.00  0.00    +0.149 HD
ATOM     25  C   LIG    1        5.139   0.908   1.146  0.00  0.00    +0.244 C 
ATOM     26  O   LIG    1        6.087   0.238   0.755  0.00  0.00    -0.270 OA
ENDBRANCH   1  25
BRANCH   5  27
ATOM     27  C   LIG    1       -0.491  -3.526  -0.687  0.00  0.00    +0.056 C 
ATOM     28  C   LIG    1       -0.436  -4.173  -2.048  0.00  0.00    +0.012 C 
ATOM     29  C   LIG    1        0.141  -4.885  -0.861  0.00  0.00    +0.012 C 
ENDBRANCH   5  27
TORSDOF 3