REMARK  Name = BDB015769
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.769  -1.366   0.413  0.00  0.00    +0.326 A 
ATOM      2  N   LIG    1       -1.334  -0.346  -0.250  0.00  0.00    -0.194 NA
ATOM      3  C   LIG    1       -0.574   0.750  -0.426  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1        0.719   0.827   0.052  0.00  0.00    +0.072 A 
ATOM      5  C   LIG    1        1.210  -0.279   0.713  0.00  0.00    +0.127 A 
ATOM      6  N   LIG    1        0.472  -1.375   0.916  0.00  0.00    -0.180 NA
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -1.202   1.884  -1.150  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1       -2.525   2.094  -0.997  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1       -3.193   3.133  -1.631  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1       -4.619   3.285  -1.393  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -2.545   4.031  -2.473  0.00  0.00    +0.251 A 
ATOM     12  O   LIG    1       -3.076   4.977  -3.047  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -1.092   3.788  -2.673  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1       -0.479   2.775  -2.047  0.00  0.00    +0.017 A 
ENDBRANCH   3   7
BRANCH   5  15
ATOM     15  N   LIG    1        2.496  -0.315   1.241  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1        2.590  -1.221   1.698  0.00  0.00    +0.148 HD
BRANCH  15  17
ATOM     17  C   LIG    1        3.609  -0.077   0.317  0.00  0.00    +0.099 C 
ATOM     18  C   LIG    1        3.704  -1.186  -0.740  0.00  0.00    +0.033 C 
BRANCH  17  19
ATOM     19  C   LIG    1        4.874   0.077   1.151  0.00  0.00    -0.028 A 
ATOM     20  C   LIG    1        5.680  -1.013   1.519  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1        6.828  -0.824   2.294  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        7.180   0.452   2.724  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        6.381   1.542   2.389  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        5.234   1.355   1.614  0.00  0.00    +0.005 A 
ENDBRANCH  17  19
ENDBRANCH  15  17
ENDBRANCH   5  15
BRANCH   1  25
ATOM     25  O   LIG    1       -1.491  -2.539   0.614  0.00  0.00    -0.422 OA
BRANCH  25  28
ATOM     26  C   LIG    1       -3.706  -2.058   2.324  0.00  0.00    +0.047 C 
ATOM     27  C   LIG    1       -3.865  -2.371   0.863  0.00  0.00    -0.007 A 
ATOM     28  C   LIG    1       -2.744  -2.583   0.041  0.00  0.00    +0.152 A 
ATOM     29  C   LIG    1       -2.899  -2.899  -1.319  0.00  0.00    +0.094 A 
ATOM     30  C   LIG    1       -4.186  -2.958  -1.867  0.00  0.00    +0.022 A 
ATOM     31  C   LIG    1       -5.302  -2.720  -1.065  0.00  0.00    +0.002 A 
ATOM     32  C   LIG    1       -5.143  -2.430   0.291  0.00  0.00    +0.007 A 
BRANCH  29  33
ATOM     33  C   LIG    1       -1.768  -3.164  -2.159  0.00  0.00    +0.103 C 
ATOM     34  N   LIG    1       -0.859  -3.381  -2.848  0.00  0.00    -0.191 NA
ENDBRANCH  29  33
ENDBRANCH  25  28
ENDBRANCH   1  25
TORSDOF 7