REMARK  Name = BDB015760
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.786  -0.887  -0.171  0.00  0.00    +0.326 A 
ATOM      2  N   LIG    1       -1.505   0.115   0.358  0.00  0.00    -0.194 NA
ATOM      3  C   LIG    1       -0.841   1.252   0.623  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1        0.502   1.400   0.334  0.00  0.00    +0.072 A 
ATOM      5  C   LIG    1        1.156   0.317  -0.221  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1        0.514  -0.827  -0.490  0.00  0.00    -0.180 NA
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -1.662   2.348   1.198  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1       -1.151   3.166   2.140  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1       -1.889   4.194   2.712  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1       -1.254   5.028   3.720  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -3.215   4.443   2.364  0.00  0.00    +0.251 A 
ATOM     12  O   LIG    1       -3.913   5.339   2.832  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -3.796   3.529   1.349  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1       -3.053   2.550   0.817  0.00  0.00    +0.017 A 
ENDBRANCH   3   7
BRANCH   5  15
ATOM     15  N   LIG    1        2.517   0.469  -0.552  0.00  0.00    -0.329 N 
ATOM     16  H   LIG    1        3.023   0.813   0.259  0.00  0.00    +0.147 HD
BRANCH  15  17
ATOM     17  C   LIG    1        3.143  -0.730  -1.111  0.00  0.00    +0.103 C 
BRANCH  17  18
ATOM     18  C   LIG    1        4.601  -0.412  -1.460  0.00  0.00    +0.021 C 
BRANCH  18  19
ATOM     19  C   LIG    1        5.321  -1.557  -2.196  0.00  0.00    -0.016 C 
ATOM     20  C   LIG    1        5.430  -2.821  -1.342  0.00  0.00    +0.007 C 
ATOM     21  C   LIG    1        6.717  -1.101  -2.626  0.00  0.00    +0.007 C 
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  15  17
ENDBRANCH   5  15
BRANCH   1  22
ATOM     22  O   LIG    1       -1.413  -2.082  -0.503  0.00  0.00    -0.420 OA
BRANCH  22  25
ATOM     23  C   LIG    1       -3.707  -2.069  -2.192  0.00  0.00    +0.047 C 
ATOM     24  C   LIG    1       -3.786  -2.334  -0.717  0.00  0.00    -0.005 A 
ATOM     25  C   LIG    1       -2.635  -2.304   0.085  0.00  0.00    +0.170 A 
ATOM     26  C   LIG    1       -2.722  -2.567   1.454  0.00  0.00    +0.166 A 
ATOM     27  F   LIG    1       -1.617  -2.586   2.213  0.00  0.00    -0.202 F 
ATOM     28  C   LIG    1       -3.952  -2.823   2.050  0.00  0.00    +0.042 A 
ATOM     29  C   LIG    1       -5.106  -2.829   1.269  0.00  0.00    +0.003 A 
ATOM     30  C   LIG    1       -5.024  -2.587  -0.106  0.00  0.00    +0.007 A 
ENDBRANCH  22  25
ENDBRANCH   1  22
TORSDOF 7