REMARK  Name = BDB015225
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.546  -0.768   0.491  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        2.555  -0.439  -0.445  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1        1.220  -0.819  -0.253  0.00  0.00    +0.122 A 
ATOM      4  C   LIG    1        0.872  -1.560   0.879  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        1.855  -1.904   1.808  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        3.183  -1.506   1.620  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        5.995  -0.498   0.980  0.00  0.00    +0.266 C 
ATOM      8  N   LIG    1        4.853  -0.307   0.223  0.00  0.00    -0.280 N 
ATOM      9  H   LIG    1        4.957   0.211  -0.639  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        6.048  -1.167   2.007  0.00  0.00    -0.268 OA
BRANCH   7  13
ATOM     11  C   LIG    1        8.918  -0.949   1.908  0.00  0.00    +0.150 C 
ATOM     12  N   LIG    1        8.476  -0.049   0.865  0.00  0.00    -0.330 N 
ATOM     13  C   LIG    1        7.176   0.157   0.440  0.00  0.00    +0.124 A 
ATOM     14  C   LIG    1        7.319   1.108  -0.558  0.00  0.00    +0.143 A 
ATOM     15  N   LIG    1        8.632   1.442  -0.764  0.00  0.00    -0.243 NA
ATOM     16  C   LIG    1        9.306   0.731   0.106  0.00  0.00    +0.199 A 
ENDBRANCH   7  13
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  O   LIG    1        0.364  -0.438  -1.250  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -1.022  -0.321  -0.888  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.771   0.200  -2.118  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -1.605  -0.750  -3.188  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -0.641  -0.900  -3.254  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -3.282   0.403  -1.890  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.586   1.461  -0.908  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -4.016   0.925   0.398  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -5.433   0.397   0.444  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -6.390   0.812  -0.501  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -7.699   0.316  -0.427  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -8.070  -0.558   0.597  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -7.133  -0.950   1.550  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.993   1.749  -1.617  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -5.822  -0.475   1.475  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -4.618   2.393  -1.395  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 8