REMARK  Name = BDB024723
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.757   2.619   0.142  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1       -4.298   1.295   0.273  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1       -5.367   0.278   0.268  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1       -5.962   0.115  -1.141  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1       -4.928  -1.065   0.845  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1       -3.700  -1.567   0.116  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1       -2.617  -0.529   0.181  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -1.263  -0.934   0.142  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1       -0.742  -2.193   0.013  0.00  0.00    -0.231 NA
ATOM     10  C   LIG    1        0.576  -2.082   0.044  0.00  0.00    +0.116 A 
ATOM     11  N   LIG    1        0.921  -0.746   0.178  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1       -0.245  -0.007   0.263  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1       -0.502   1.350   0.446  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1       -1.848   1.749   0.464  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -2.919   0.856   0.286  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1       -5.931   2.943   0.317  0.00  0.00    -0.226 OA
ENDROOT
BRANCH  10  17
ATOM     17  C   LIG    1        1.505  -3.290  -0.033  0.00  0.00    +0.020 C 
ATOM     18  C   LIG    1        2.189  -3.537   1.322  0.00  0.00    +0.019 C 
ATOM     19  C   LIG    1        2.543  -3.157  -1.157  0.00  0.00    +0.019 C 
ATOM     20  C   LIG    1        0.663  -4.554  -0.354  0.00  0.00    +0.019 C 
ENDBRANCH  10  17
BRANCH   1  22
ATOM     21  C   LIG    1       -4.317   4.845  -0.469  0.00  0.00    +0.282 C 
ATOM     22  O   LIG    1       -3.823   3.519  -0.274  0.00  0.00    -0.453 OA
ENDBRANCH   1  22
BRANCH  11  23
ATOM     23  C   LIG    1        2.241  -0.141   0.256  0.00  0.00    +0.139 C 
BRANCH  23  24
ATOM     24  C   LIG    1        2.663   0.515  -1.071  0.00  0.00    +0.106 C 
BRANCH  24  25
ATOM     25  N   LIG    1        3.943   1.234  -1.081  0.00  0.00    -0.296 NA
ATOM     26  C   LIG    1        3.913   2.507  -0.341  0.00  0.00    +0.112 C 
ATOM     27  C   LIG    1        5.333   3.030  -0.077  0.00  0.00    +0.175 C 
ATOM     28  O   LIG    1        6.096   2.151   0.763  0.00  0.00    -0.377 OA
ATOM     29  C   LIG    1        5.729   0.772   0.627  0.00  0.00    +0.175 C 
ATOM     30  C   LIG    1        5.126   0.427  -0.744  0.00  0.00    +0.112 C 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  11  23
TORSDOF 5