REMARK  Name = BDB026863
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.438  -0.501  -0.020  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.971  -1.893   0.305  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.482  -2.760  -0.672  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.950  -4.031  -0.327  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -1.907  -4.457   0.998  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -1.391  -3.617   1.981  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.923  -2.348   1.637  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  N   LIG    1        1.050  -0.464  -0.058  0.00  0.00    -0.303 NA
ATOM      9  H   LIG    1        1.403  -0.913   0.785  0.00  0.00    +0.123 HD
BRANCH   8  10
ATOM     10  C   LIG    1        1.666  -1.088  -1.234  0.00  0.00    +0.086 C 
BRANCH  10  11
ATOM     11  C   LIG    1        3.172  -1.342  -1.035  0.00  0.00    +0.053 C 
BRANCH  11  16
ATOM     12  C   LIG    1        6.283   2.157   0.787  0.00  0.00    +0.172 C 
ATOM     13  N   LIG    1        5.355   1.417  -0.032  0.00  0.00    -0.274 N 
ATOM     14  N   LIG    1        4.936   1.942  -1.196  0.00  0.00    -0.180 NA
ATOM     15  C   LIG    1        4.098   1.018  -1.672  0.00  0.00    +0.138 A 
ATOM     16  C   LIG    1        3.988  -0.110  -0.825  0.00  0.00    -0.009 A 
ATOM     17  C   LIG    1        4.826   0.187   0.231  0.00  0.00    +0.111 A 
ENDBRANCH  11  16
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   1  18
ATOM     18  C   LIG    1       -1.098   0.184  -1.248  0.00  0.00    +0.186 C 
ATOM     19  O   LIG    1       -0.839  -0.158  -2.407  0.00  0.00    -0.290 OA
BRANCH  18  20
ATOM     20  C   LIG    1       -2.047   1.283  -1.021  0.00  0.00    +0.044 A 
ATOM     21  C   LIG    1       -2.994   1.509   0.037  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1       -3.626   2.728  -0.227  0.00  0.00    +0.047 A 
ATOM     23  C   LIG    1       -4.606   3.279   0.609  0.00  0.00    +0.026 A 
ATOM     24  C   LIG    1       -4.973   2.558   1.746  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -4.387   1.330   2.029  0.00  0.00    +0.001 A 
ATOM     26  N   LIG    1       -3.111   3.211  -1.406  0.00  0.00    -0.360 N 
ATOM     27  H   LIG    1       -3.396   4.075  -1.846  0.00  0.00    +0.165 HD
ATOM     28  C   LIG    1       -3.406   0.795   1.185  0.00  0.00    +0.011 A 
ATOM     29  C   LIG    1       -2.184   2.342  -1.903  0.00  0.00    +0.095 A 
ENDBRANCH  18  20
ENDBRANCH   1  18
TORSDOF 7