REMARK  Name = BDB056836
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.315  -1.132   0.793  0.00  0.00    +0.166 A 
ATOM      2  C   LIG    1        2.062  -1.431   1.914  0.00  0.00    +0.083 A 
ATOM      3  C   LIG    1        1.615  -1.643   3.306  0.00  0.00    +0.069 C 
ATOM      4  N   LIG    1        3.393  -1.517   1.572  0.00  0.00    -0.214 NA
ATOM      5  C   LIG    1        3.414  -1.271   0.275  0.00  0.00    +0.228 A 
ATOM      6  O   LIG    1        2.176  -1.035  -0.266  0.00  0.00    -0.437 OA
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        4.553  -1.228  -0.636  0.00  0.00    +0.040 A 
ATOM      8  C   LIG    1        4.407  -0.919  -1.997  0.00  0.00    +0.058 A 
ATOM      9  C   LIG    1        5.511  -0.881  -2.857  0.00  0.00    +0.121 A 
ATOM     10  C   LIG    1        6.782  -1.156  -2.352  0.00  0.00    +0.045 A 
ATOM     11  C   LIG    1        6.946  -1.465  -1.000  0.00  0.00    +0.004 A 
ATOM     12  C   LIG    1        5.839  -1.500  -0.150  0.00  0.00    +0.013 A 
BRANCH   9  13
ATOM     13  O   LIG    1        5.212  -0.566  -4.154  0.00  0.00    -0.495 OA
ATOM     14  C   LIG    1        6.300  -0.501  -5.068  0.00  0.00    +0.277 C 
ENDBRANCH   9  13
ENDBRANCH   5   7
BRANCH   1  15
ATOM     15  C   LIG    1       -0.126  -0.937   0.513  0.00  0.00    +0.305 C 
BRANCH  15  16
ATOM     16  O   LIG    1       -0.668  -0.193   1.603  0.00  0.00    -0.484 OA
BRANCH  16  20
ATOM     17  C   LIG    1       -4.716   0.845   1.704  0.00  0.00    -0.037 A 
ATOM     18  C   LIG    1       -3.811   1.254   2.690  0.00  0.00    +0.008 A 
ATOM     19  C   LIG    1       -2.467   0.879   2.613  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1       -2.003   0.098   1.553  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1       -2.898  -0.310   0.566  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1       -4.246   0.059   0.643  0.00  0.00    +0.008 A 
BRANCH  17  23
ATOM     23  C   LIG    1       -6.171   1.243   1.782  0.00  0.00    +0.155 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -6.588   2.298   0.779  0.00  0.00    +0.311 C 
ATOM     25  O   LIG    1       -5.947   2.668  -0.195  0.00  0.00    -0.250 OA
BRANCH  24  27
ATOM     26  C   LIG    1       -8.337   3.753   0.212  0.00  0.00    +0.280 C 
ATOM     27  O   LIG    1       -7.833   2.760   1.107  0.00  0.00    -0.468 OA
ENDBRANCH  24  27
ENDBRANCH  23  24
ENDBRANCH  17  23
ENDBRANCH  16  20
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 8