REMARK  Name = BDB025287
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.684   0.246  -0.424  0.00  0.00    -0.313 N 
ATOM      2  C   LIG    1       -2.651   1.157  -0.503  0.00  0.00    +0.143 A 
ATOM      3  C   LIG    1       -1.463   0.473  -0.730  0.00  0.00    +0.030 A 
ATOM      4  C   LIG    1       -0.277   1.242  -0.854  0.00  0.00    -0.035 A 
ATOM      5  C   LIG    1       -0.416   2.635  -0.722  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1       -1.665   3.185  -0.487  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1       -1.801  -0.920  -0.762  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -1.042  -2.101  -0.938  0.00  0.00    +0.010 A 
ATOM      9  C   LIG    1       -1.660  -3.352  -0.912  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -3.029  -3.448  -0.716  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -3.809  -2.302  -0.541  0.00  0.00    +0.026 A 
ATOM     12  N   LIG    1       -2.811   2.491  -0.364  0.00  0.00    -0.237 NA
ATOM     13  C   LIG    1       -3.188  -1.039  -0.563  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  20
ATOM     14  O   LIG    1       -7.517  -1.937   1.906  0.00  0.00    -0.275 OA
ATOM     15  C   LIG    1       -6.821  -1.100   1.339  0.00  0.00    +0.219 C 
ATOM     16  N   LIG    1       -6.998  -0.819   0.008  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1       -7.705  -1.371  -0.459  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1       -6.136  -0.140  -0.824  0.00  0.00    +0.242 C 
ATOM     19  O   LIG    1       -6.257  -0.243  -2.043  0.00  0.00    -0.273 OA
ATOM     20  C   LIG    1       -5.056   0.692  -0.161  0.00  0.00    +0.176 C 
ATOM     21  C   LIG    1       -5.336   0.904   1.332  0.00  0.00    +0.044 C 
ATOM     22  C   LIG    1       -5.674  -0.402   2.028  0.00  0.00    +0.099 C 
ENDBRANCH   1  20
BRANCH   4  23
ATOM     23  C   LIG    1        1.101   0.670  -1.089  0.00  0.00    +0.038 C 
BRANCH  23  24
ATOM     24  C   LIG    1        1.750   0.221   0.222  0.00  0.00    +0.033 C 
BRANCH  24  25
ATOM     25  C   LIG    1        3.110  -0.436  -0.009  0.00  0.00    +0.160 C 
BRANCH  25  26
ATOM     26  O   LIG    1        4.018   0.398  -0.720  0.00  0.00    -0.377 OA
BRANCH  26  27
ATOM     27  C   LIG    1        4.554   1.506   0.005  0.00  0.00    +0.188 C 
BRANCH  27  28
ATOM     28  C   LIG    1        5.450   1.113   1.188  0.00  0.00    +0.188 C 
BRANCH  28  29
ATOM     29  O   LIG    1        6.432   0.127   0.864  0.00  0.00    -0.375 OA
BRANCH  29  30
ATOM     30  C   LIG    1        7.474   0.615   0.010  0.00  0.00    +0.187 C 
BRANCH  30  31
ATOM     31  C   LIG    1        8.490  -0.508  -0.170  0.00  0.00    +0.184 C 
BRANCH  31  32
ATOM     32  O   LIG    1        7.867  -1.627  -0.800  0.00  0.00    -0.393 OA
ATOM     33  H   LIG    1        6.999  -1.718  -0.358  0.00  0.00    +0.209 HD
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   4  23
TORSDOF 11