REMARK  Name = BDB026497
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.424  -0.643   0.343  0.00  0.00    -0.295 N 
ATOM      2  C   LIG    1        1.770   0.562   0.663  0.00  0.00    +0.330 A 
ATOM      3  O   LIG    1        1.820   1.203   1.699  0.00  0.00    -0.246 OA
ATOM      4  N   LIG    1        1.010   0.862  -0.485  0.00  0.00    -0.297 N 
ATOM      5  C   LIG    1        1.222  -0.118  -1.433  0.00  0.00    +0.108 A 
ATOM      6  C   LIG    1        2.076  -1.022  -0.935  0.00  0.00    +0.108 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1        3.348  -1.323   1.214  0.00  0.00    +0.161 C 
BRANCH   7  11
ATOM      8  C   LIG    1        7.447  -0.327   0.272  0.00  0.00    +0.052 A 
ATOM      9  C   LIG    1        6.647   0.578   0.974  0.00  0.00    +0.019 A 
ATOM     10  C   LIG    1        5.324   0.251   1.281  0.00  0.00    +0.006 A 
ATOM     11  C   LIG    1        4.786  -0.986   0.893  0.00  0.00    -0.028 A 
ATOM     12  C   LIG    1        5.593  -1.887   0.185  0.00  0.00    +0.006 A 
ATOM     13  C   LIG    1        6.917  -1.560  -0.122  0.00  0.00    +0.019 A 
BRANCH   8  15
ATOM     14  N   LIG    1        9.904   0.272  -0.306  0.00  0.00    -0.191 NA
ATOM     15  C   LIG    1        8.805   0.007  -0.046  0.00  0.00    +0.099 C 
ENDBRANCH   8  15
ENDBRANCH   7  11
ENDBRANCH   1   7
BRANCH   4  16
ATOM     16  C   LIG    1        0.181   2.039  -0.663  0.00  0.00    +0.159 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -1.005   2.153   0.317  0.00  0.00    +0.148 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -0.570   2.561   1.623  0.00  0.00    -0.389 OA
ATOM     19  H   LIG    1        0.252   2.071   1.841  0.00  0.00    +0.210 HD
ENDBRANCH  17  18
BRANCH  17  20
ATOM     20  C   LIG    1       -1.859   0.871   0.434  0.00  0.00    +0.117 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -2.406   0.369  -0.842  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1       -2.999  -0.973  -0.674  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1       -4.368  -0.996  -0.029  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1       -5.197   0.141  -0.049  0.00  0.00    -0.042 A 
ATOM     25  C   LIG    1       -6.474   0.081   0.524  0.00  0.00    +0.004 A 
ATOM     26  C   LIG    1       -6.936  -1.104   1.094  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -6.125  -2.237   1.100  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -4.692   1.439  -0.627  0.00  0.00    +0.051 C 
ATOM     29  C   LIG    1       -4.849  -2.185   0.539  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1       -3.409   1.259  -1.453  0.00  0.00    +0.089 C 
ENDBRANCH  20  21
ENDBRANCH  17  20
ENDBRANCH  16  17
ENDBRANCH   4  16
TORSDOF 8