REMARK  Name = BDB048487
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.350   1.560  -0.446  0.00  0.00    +0.139 A 
ATOM      2  C   LIG    1       -2.139   2.710  -0.576  0.00  0.00    +0.094 A 
ATOM      3  C   LIG    1       -3.535   2.574  -0.637  0.00  0.00    -0.027 A 
ATOM      4  C   LIG    1       -4.444   3.761  -0.805  0.00  0.00    +0.045 C 
ATOM      5  C   LIG    1       -4.084   1.289  -0.547  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1       -3.255   0.189  -0.389  0.00  0.00    +0.126 A 
ATOM      7  N   LIG    1       -1.912   0.333  -0.354  0.00  0.00    -0.216 NA
ENDROOT
BRANCH   1   8
ATOM      8  N   LIG    1        0.053   1.667  -0.355  0.00  0.00    -0.325 N 
ATOM      9  H   LIG    1        0.405   2.228  -1.129  0.00  0.00    +0.148 HD
BRANCH   8  10
ATOM     10  C   LIG    1        0.767   0.391  -0.242  0.00  0.00    +0.144 C 
BRANCH  10  11
ATOM     11  C   LIG    1        2.263   0.636  -0.016  0.00  0.00    +0.247 C 
BRANCH  11  12
ATOM     12  O   LIG    1        2.934  -0.625   0.009  0.00  0.00    -0.489 OA
BRANCH  12  16
ATOM     13  C   LIG    1        7.012  -0.748   0.608  0.00  0.00    +0.041 A 
ATOM     14  N   LIG    1        6.425   0.472   0.600  0.00  0.00    -0.256 NA
ATOM     15  C   LIG    1        5.082   0.518   0.408  0.00  0.00    +0.156 A 
ATOM     16  C   LIG    1        4.283  -0.599   0.211  0.00  0.00    +0.139 A 
ATOM     17  C   LIG    1        4.913  -1.840   0.217  0.00  0.00    +0.049 A 
ATOM     18  C   LIG    1        6.290  -1.922   0.415  0.00  0.00    +0.027 A 
BRANCH  13  20
ATOM     19  C   LIG    1        9.246  -0.768  -0.522  0.00  0.00    +0.010 C 
ATOM     20  C   LIG    1        8.504  -0.788   0.805  0.00  0.00    +0.052 C 
ENDBRANCH  13  20
ENDBRANCH  12  16
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   2  21
ATOM     21  C   LIG    1       -1.527   4.004  -0.659  0.00  0.00    +0.103 C 
ATOM     22  N   LIG    1       -1.044   5.055  -0.758  0.00  0.00    -0.191 NA
ENDBRANCH   2  21
BRANCH   6  23
ATOM     23  N   LIG    1       -3.705  -1.123  -0.284  0.00  0.00    -0.283 N 
ATOM     24  H   LIG    1       -2.904  -1.743  -0.328  0.00  0.00    +0.155 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -4.883  -1.726  -0.047  0.00  0.00    +0.146 A 
ATOM     26  N   LIG    1       -5.037  -3.044  -0.205  0.00  0.00    -0.158 NA
ATOM     27  N   LIG    1       -6.311  -3.282   0.134  0.00  0.00    -0.280 N 
ATOM     28  H   LIG    1       -6.653  -4.236   0.071  0.00  0.00    +0.189 HD
ATOM     29  C   LIG    1       -6.984  -2.169   0.548  0.00  0.00    +0.035 A 
ATOM     30  C   LIG    1       -8.391  -2.211   0.997  0.00  0.00    +0.065 C 
ATOM     31  C   LIG    1       -6.071  -1.141   0.450  0.00  0.00    +0.068 A 
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 9