REMARK  Name = BDB026656
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.808  -0.314  -0.413  0.00  0.00    -0.312 N 
ATOM      2  C   LIG    1       -0.115  -1.438  -1.079  0.00  0.00    +0.128 C 
ATOM      3  C   LIG    1        1.268  -0.959  -1.647  0.00  0.00    +0.032 C 
ATOM      4  C   LIG    1        0.989   0.062  -2.780  0.00  0.00    +0.029 C 
ATOM      5  C   LIG    1        1.970  -2.183  -2.270  0.00  0.00    +0.029 C 
ATOM      6  N   LIG    1        2.176  -0.466  -0.563  0.00  0.00    -0.290 NA
ATOM      7  C   LIG    1        1.446  -0.180   0.692  0.00  0.00    +0.104 C 
ATOM      8  C   LIG    1        0.047   0.451   0.522  0.00  0.00    +0.122 C 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -3.748  -3.710   1.266  0.00  0.00    +0.088 C 
ATOM     10  C   LIG    1       -3.482  -2.264   0.985  0.00  0.00    +0.128 A 
ATOM     11  N   LIG    1       -2.307  -1.951   0.409  0.00  0.00    -0.217 NA
ATOM     12  C   LIG    1       -2.057  -0.657   0.133  0.00  0.00    +0.128 A 
ATOM     13  C   LIG    1       -3.015   0.319   0.377  0.00  0.00    +0.014 A 
ATOM     14  C   LIG    1       -2.870   1.778   0.054  0.00  0.00    +0.040 C 
ATOM     15  C   LIG    1       -4.165   2.360  -0.524  0.00  0.00    +0.005 C 
ATOM     16  C   LIG    1       -5.454   1.887   0.163  0.00  0.00    +0.006 C 
ATOM     17  C   LIG    1       -5.229   0.930   1.330  0.00  0.00    +0.056 C 
ATOM     18  C   LIG    1       -4.192  -0.103   0.981  0.00  0.00    +0.050 A 
ATOM     19  N   LIG    1       -4.445  -1.384   1.296  0.00  0.00    -0.237 NA
ENDBRANCH   1  12
BRANCH   6  20
ATOM     20  C   LIG    1        3.098   0.608  -0.950  0.00  0.00    +0.120 C 
BRANCH  20  21
ATOM     21  C   LIG    1        4.256   0.791   0.014  0.00  0.00    -0.033 A 
ATOM     22  C   LIG    1        5.054  -0.301   0.389  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1        6.132  -0.128   1.258  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        6.429   1.139   1.756  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        5.651   2.234   1.383  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        4.572   2.062   0.514  0.00  0.00    +0.005 A 
ENDBRANCH  20  21
ENDBRANCH   6  20
TORSDOF 3