REMARK  Name = BDB002708
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.549   0.168  -0.541  0.00  0.00    +0.164 A 
ATOM      2  C   LIG    1        3.689  -1.037   0.180  0.00  0.00    +0.162 A 
ATOM      3  C   LIG    1        2.678  -1.437   1.056  0.00  0.00    +0.066 A 
ATOM      4  C   LIG    1        1.537  -0.640   1.207  0.00  0.00    +0.089 A 
ATOM      5  C   LIG    1        1.388   0.543   0.504  0.00  0.00    +0.085 A 
ATOM      6  N   LIG    1        0.252   1.335   0.648  0.00  0.00    -0.213 NA
ATOM      7  C   LIG    1       -0.658   0.917   1.467  0.00  0.00    +0.238 A 
ATOM      8  O   LIG    1       -0.615  -0.211   2.210  0.00  0.00    -0.404 OA
ATOM      9  C   LIG    1        0.457  -1.030   2.121  0.00  0.00    +0.348 A 
ATOM     10  O   LIG    1        0.539  -2.062   2.777  0.00  0.00    -0.244 OA
ATOM     11  C   LIG    1        2.397   0.947  -0.372  0.00  0.00    +0.078 A 
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1        4.499   1.712  -2.102  0.00  0.00    +0.277 C 
ATOM     13  O   LIG    1        4.586   0.491  -1.380  0.00  0.00    -0.491 OA
ENDBRANCH   1  13
BRANCH   2  14
ATOM     14  O   LIG    1        4.845  -1.742  -0.042  0.00  0.00    -0.491 OA
ATOM     15  C   LIG    1        5.024  -2.961   0.666  0.00  0.00    +0.277 C 
ENDBRANCH   2  14
BRANCH   7  16
ATOM     16  C   LIG    1       -1.938   1.700   1.692  0.00  0.00    +0.325 C 
BRANCH  16  17
ATOM     17  O   LIG    1       -3.114   0.918   1.550  0.00  0.00    -0.480 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -3.609   0.672   0.300  0.00  0.00    +0.151 A 
ATOM     19  C   LIG    1       -4.837  -0.001   0.212  0.00  0.00    +0.168 A 
ATOM     20  C   LIG    1       -5.416  -0.349  -1.017  0.00  0.00    +0.036 A 
ATOM     21  C   LIG    1       -4.759  -0.005  -2.194  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -3.543   0.674  -2.132  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -2.970   1.010  -0.897  0.00  0.00    +0.048 A 
BRANCH  19  24
ATOM     24  N   LIG    1       -5.562  -0.355   1.418  0.00  0.00    +0.060 N 
ATOM     25  O   LIG    1       -5.913   0.566   2.167  0.00  0.00    -0.126 OA
ATOM     26  O   LIG    1       -5.825  -1.556   1.581  0.00  0.00    -0.126 OA
ENDBRANCH  19  24
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   7  16
TORSDOF 6