REMARK  Name = BDB007494
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.275  -0.298  -0.295  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        0.040  -1.290  -0.975  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1        1.023  -1.980  -1.656  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1        0.757  -2.649  -2.365  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.355  -1.793  -1.128  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1       -2.411  -0.891  -0.940  0.00  0.00    +0.018 A 
ATOM      7  C   LIG    1       -3.744  -1.308  -1.080  0.00  0.00    -0.033 A 
ATOM      8  C   LIG    1       -4.007  -2.650  -1.385  0.00  0.00    +0.005 A 
ATOM      9  C   LIG    1       -2.959  -3.557  -1.554  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -1.635  -3.132  -1.425  0.00  0.00    +0.013 A 
BRANCH   7  11
ATOM     11  C   LIG    1       -4.873  -0.325  -0.868  0.00  0.00    +0.116 C 
BRANCH  11  12
ATOM     12  N   LIG    1       -5.082  -0.097   0.559  0.00  0.00    -0.309 NA
ATOM     13  H   LIG    1       -5.336  -0.983   0.993  0.00  0.00    +0.123 HD
BRANCH  12  14
ATOM     14  C   LIG    1       -6.084   0.922   0.900  0.00  0.00    +0.058 C 
ATOM     15  C   LIG    1       -5.564   2.350   0.675  0.00  0.00    +0.047 C 
ATOM     16  C   LIG    1       -6.708   3.356   0.566  0.00  0.00    +0.161 C 
ATOM     17  O   LIG    1       -7.827   2.927   1.334  0.00  0.00    -0.380 OA
ATOM     18  C   LIG    1       -8.449   1.759   0.798  0.00  0.00    +0.161 C 
ATOM     19  C   LIG    1       -7.452   0.739   0.243  0.00  0.00    +0.047 C 
ENDBRANCH  12  14
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   2   5
BRANCH   3  20
ATOM     20  C   LIG    1        2.402  -1.507  -1.666  0.00  0.00    +0.137 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.127  -1.785  -0.337  0.00  0.00    +0.145 C 
BRANCH  21  22
ATOM     22  O   LIG    1        3.113  -3.204  -0.111  0.00  0.00    -0.389 OA
ATOM     23  H   LIG    1        2.181  -3.425   0.061  0.00  0.00    +0.210 HD
ENDBRANCH  21  22
BRANCH  21  24
ATOM     24  C   LIG    1        4.587  -1.277  -0.411  0.00  0.00    +0.117 C 
BRANCH  24  25
ATOM     25  N   LIG    1        5.331  -1.393   0.862  0.00  0.00    -0.295 NA
ATOM     26  C   LIG    1        4.925  -0.386   1.861  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1        5.466   1.008   1.616  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1        6.624   1.209   0.842  0.00  0.00    -0.042 A 
ATOM     29  C   LIG    1        7.125   2.506   0.662  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1        6.495   3.594   1.264  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        5.357   3.397   2.044  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        7.285   0.043   0.150  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1        4.847   2.111   2.222  0.00  0.00    +0.005 A 
ATOM     34  C   LIG    1        6.788  -1.315   0.667  0.00  0.00    +0.089 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   3  20
TORSDOF 9