REMARK  Name = BDB026422
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.643  -3.622   1.496  0.00  0.00    +0.033 C 
ATOM      2  C   LIG    1       -2.396  -2.143   1.160  0.00  0.00    +0.049 C 
ATOM      3  N   LIG    1       -2.732  -1.880  -0.242  0.00  0.00    -0.274 N 
ATOM      4  C   LIG    1       -1.594  -1.862  -1.042  0.00  0.00    +0.306 C 
ATOM      5  O   LIG    1       -1.548  -1.707  -2.253  0.00  0.00    -0.252 OA
ATOM      6  N   LIG    1       -0.483  -1.999  -0.206  0.00  0.00    -0.281 N 
ATOM      7  C   LIG    1       -0.880  -1.843   1.178  0.00  0.00    +0.134 C 
ATOM      8  C   LIG    1       -3.133  -1.248   2.158  0.00  0.00    +0.033 C 
ENDROOT
BRANCH   3   9
ATOM      9  C   LIG    1       -4.075  -1.753  -0.778  0.00  0.00    +0.145 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -4.645  -0.360  -0.632  0.00  0.00    -0.030 A 
ATOM     11  C   LIG    1       -3.942   0.759  -1.108  0.00  0.00    +0.006 A 
ATOM     12  C   LIG    1       -4.476   2.044  -0.981  0.00  0.00    +0.019 A 
ATOM     13  C   LIG    1       -5.725   2.228  -0.384  0.00  0.00    +0.052 A 
ATOM     14  C   LIG    1       -6.439   1.119   0.081  0.00  0.00    +0.019 A 
ATOM     15  C   LIG    1       -5.904  -0.166  -0.046  0.00  0.00    +0.006 A 
BRANCH  13  16
ATOM     16  C   LIG    1       -6.274   3.545  -0.249  0.00  0.00    +0.099 C 
ATOM     17  N   LIG    1       -6.725   4.608  -0.132  0.00  0.00    -0.191 NA
ENDBRANCH  13  16
ENDBRANCH   9  10
ENDBRANCH   3   9
BRANCH   6  18
ATOM     18  C   LIG    1        0.861  -1.704  -0.675  0.00  0.00    +0.142 C 
BRANCH  18  19
ATOM     19  C   LIG    1        1.169  -0.191  -0.768  0.00  0.00    +0.146 C 
BRANCH  19  20
ATOM     20  O   LIG    1        0.188   0.498  -1.554  0.00  0.00    -0.389 OA
ATOM     21  H   LIG    1       -0.162  -0.126  -2.220  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        2.583   0.009  -1.374  0.00  0.00    +0.117 C 
BRANCH  22  23
ATOM     23  N   LIG    1        3.011   1.410  -1.566  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1        3.097   2.189  -0.321  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        4.295   1.856   0.543  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        5.463   1.317  -0.027  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        6.576   1.057   0.783  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        6.538   1.349   2.146  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.389   1.899   2.710  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        5.500   0.960  -1.494  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        4.274   2.157   1.912  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        4.295   1.505  -2.280  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 8