REMARK  Name = BDB026836
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.765   1.948  -1.226  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.368   2.556   0.040  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -0.599   3.091   1.087  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.207   3.658   2.212  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -2.594   3.717   2.304  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -3.377   3.217   1.269  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -2.771   2.651   0.145  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -1.654   0.500  -2.923  0.00  0.00    -0.290 OA
ATOM      9  C   LIG    1       -1.391   0.615  -1.719  0.00  0.00    +0.186 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -1.654  -0.518  -0.807  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -2.210  -1.798  -1.174  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1       -2.292  -2.578  -0.020  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -2.790  -3.887  -0.016  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -3.221  -4.422  -1.232  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.155  -3.675  -2.404  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -1.808  -1.818   1.014  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1       -1.748  -2.129   1.974  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1       -2.654  -2.368  -2.388  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1       -1.422  -0.586   0.557  0.00  0.00    +0.095 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        0.717   1.949  -1.342  0.00  0.00    -0.303 NA
ATOM     21  H   LIG    1        1.070   2.874  -1.109  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.420   0.897  -0.614  0.00  0.00    +0.086 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.940   1.072  -0.756  0.00  0.00    +0.050 C 
BRANCH  23  24
ATOM     24  C   LIG    1        3.694   0.015   0.016  0.00  0.00    -0.046 A 
ATOM     25  C   LIG    1        4.190   0.289   1.300  0.00  0.00    +0.006 A 
ATOM     26  C   LIG    1        4.867  -0.698   2.018  0.00  0.00    +0.038 A 
ATOM     27  C   LIG    1        5.043  -1.957   1.456  0.00  0.00    +0.123 A 
ATOM     28  F   LIG    1        5.691  -2.903   2.149  0.00  0.00    -0.205 F 
ATOM     29  C   LIG    1        4.556  -2.249   0.188  0.00  0.00    +0.038 A 
ATOM     30  C   LIG    1        3.880  -1.264  -0.532  0.00  0.00    +0.006 A 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7