REMARK  Name = BDB002668
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.051   1.294   0.854  0.00  0.00    -0.263 N 
ATOM      2  C   LIG    1       -1.692   0.336   0.056  0.00  0.00    +0.234 C 
ATOM      3  O   LIG    1       -1.179  -0.771  -0.138  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   1   4
ATOM      4  C   LIG    1       -1.382   2.679   0.880  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -1.449   3.358   2.103  0.00  0.00    +0.023 A 
ATOM      6  C   LIG    1       -1.770   4.718   2.143  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -2.011   5.413   0.961  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1       -1.924   4.752  -0.262  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -1.608   3.392  -0.303  0.00  0.00    +0.023 A 
ENDBRANCH   1   4
BRANCH   1  10
ATOM     10  C   LIG    1        0.211   0.893   1.490  0.00  0.00    +0.191 C 
BRANCH  10  20
ATOM     11  C   LIG    1        3.710  -3.062   1.920  0.00  0.00    +0.068 C 
ATOM     12  C   LIG    1        3.501  -1.857   1.031  0.00  0.00    +0.067 A 
ATOM     13  C   LIG    1        4.475  -1.623  -0.091  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        4.266  -0.489  -0.892  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1        5.133  -0.203  -1.948  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1        6.211  -1.050  -2.207  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        6.420  -2.180  -1.413  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        3.131   0.342  -0.572  0.00  0.00    +0.186 A 
ATOM     19  N   LIG    1        2.315  -0.018   0.472  0.00  0.00    -0.195 N 
ATOM     20  C   LIG    1        1.331   0.937   0.509  0.00  0.00    +0.173 A 
ATOM     21  N   LIG    1        1.568   1.840  -0.428  0.00  0.00    -0.131 NA
ATOM     22  N   LIG    1        2.701   1.459  -1.115  0.00  0.00    -0.127 NA
ATOM     23  C   LIG    1        5.555  -2.470  -0.354  0.00  0.00    +0.010 A 
ATOM     24  N   LIG    1        2.479  -1.091   1.304  0.00  0.00    -0.168 NA
ENDBRANCH  10  20
ENDBRANCH   1  10
BRANCH   2  25
ATOM     25  C   LIG    1       -3.099   0.690  -0.481  0.00  0.00    +0.181 C 
BRANCH  25  26
ATOM     26  N   LIG    1       -3.998  -0.462  -0.692  0.00  0.00    -0.290 NA
ATOM     27  C   LIG    1       -4.209  -1.306   0.495  0.00  0.00    +0.113 C 
ATOM     28  C   LIG    1       -3.796  -2.775   0.295  0.00  0.00    +0.175 C 
ATOM     29  O   LIG    1       -4.438  -3.389  -0.829  0.00  0.00    -0.377 OA
ATOM     30  C   LIG    1       -4.583  -2.505  -1.949  0.00  0.00    +0.175 C 
ATOM     31  C   LIG    1       -3.686  -1.256  -1.888  0.00  0.00    +0.113 C 
ENDBRANCH  25  26
ENDBRANCH   2  25
TORSDOF 5