REMARK  Name = BDB028470
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.399   0.317  -0.066  0.00  0.00    +0.146 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1       -0.592   1.351  -0.014  0.00  0.00    -0.389 OA
ATOM      3  H   LIG    1       -1.319   1.021   0.543  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1       -0.223  -0.968  -0.654  0.00  0.00    +0.138 C 
BRANCH   4  14
ATOM      5  O   LIG    1       -2.041  -1.633   2.264  0.00  0.00    -0.253 OA
ATOM      6  C   LIG    1       -2.035  -1.296   1.080  0.00  0.00    +0.302 C 
ATOM      7  N   LIG    1       -2.990  -0.473   0.524  0.00  0.00    -0.286 N 
ATOM      8  C   LIG    1       -3.325  -0.500  -0.901  0.00  0.00    +0.109 C 
ATOM      9  C   LIG    1       -4.801  -0.339  -1.272  0.00  0.00    +0.019 C 
ATOM     10  C   LIG    1       -5.728  -1.318  -0.558  0.00  0.00    +0.002 C 
ATOM     11  C   LIG    1       -6.189  -0.811   0.807  0.00  0.00    +0.002 C 
ATOM     12  C   LIG    1       -5.086  -0.704   1.856  0.00  0.00    +0.019 C 
ATOM     13  C   LIG    1       -3.916   0.188   1.444  0.00  0.00    +0.109 C 
ATOM     14  N   LIG    1       -1.001  -1.738   0.320  0.00  0.00    -0.297 N 
ATOM     15  H   LIG    1       -0.434  -2.346   0.899  0.00  0.00    +0.150 HD
ENDBRANCH   4  14
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1        1.578   0.786  -0.958  0.00  0.00    +0.117 C 
BRANCH  16  17
ATOM     17  N   LIG    1        2.287   1.990  -0.476  0.00  0.00    -0.295 NA
ATOM     18  C   LIG    1        3.058   1.770   0.759  0.00  0.00    +0.120 C 
ATOM     19  C   LIG    1        4.350   1.002   0.568  0.00  0.00    -0.030 A 
ATOM     20  C   LIG    1        5.001   0.989  -0.680  0.00  0.00    -0.042 A 
ATOM     21  C   LIG    1        6.216   0.305  -0.823  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1        6.791  -0.344   0.269  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        6.158  -0.318   1.509  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        4.365   1.653  -1.877  0.00  0.00    +0.051 C 
ATOM     25  C   LIG    1        4.945   0.356   1.660  0.00  0.00    +0.005 A 
ATOM     26  C   LIG    1        3.179   2.556  -1.502  0.00  0.00    +0.089 C 
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 5