REMARK  Name = BDB018319
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.039  -1.482   0.286  0.00  0.00    -0.004 A 
ATOM      2  C   LIG    1       -0.571  -1.501   0.165  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        0.027  -2.699  -0.005  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1       -0.675  -3.890  -0.065  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        0.071  -5.127  -0.235  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -2.057  -3.940   0.052  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1       -2.733  -4.964   0.017  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -2.734  -2.633   0.228  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -4.393   2.085   0.691  0.00  0.00    +0.120 A 
ATOM     10  C   LIG    1       -4.262   1.198   1.762  0.00  0.00    +0.046 A 
ATOM     11  C   LIG    1       -3.499   0.035   1.637  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -2.855  -0.257   0.428  0.00  0.00    -0.017 A 
ATOM     13  C   LIG    1       -2.990   0.631  -0.646  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1       -3.754   1.797  -0.515  0.00  0.00    +0.046 A 
BRANCH   9  16
ATOM     15  C   LIG    1       -5.291   4.141  -0.093  0.00  0.00    +0.277 C 
ATOM     16  O   LIG    1       -5.165   3.183   0.951  0.00  0.00    -0.495 OA
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   2  17
ATOM     17  C   LIG    1        0.217  -0.303   0.228  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1        1.235   0.046  -0.633  0.00  0.00    +0.117 A 
ATOM     19  N   LIG    1        1.722   1.243  -0.182  0.00  0.00    -0.267 N 
ATOM     20  N   LIG    1        1.073   1.705   0.906  0.00  0.00    -0.179 NA
ATOM     21  C   LIG    1        0.162   0.759   1.156  0.00  0.00    +0.143 A 
BRANCH  19  22
ATOM     22  C   LIG    1        2.795   2.028  -0.780  0.00  0.00    +0.178 C 
BRANCH  22  23
ATOM     23  C   LIG    1        4.141   1.368  -0.600  0.00  0.00    -0.026 A 
ATOM     24  C   LIG    1        4.854   0.882  -1.706  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1        6.098   0.274  -1.533  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        6.643   0.147  -0.256  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        5.946   0.628   0.850  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        4.702   1.237   0.680  0.00  0.00    +0.005 A 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH   2  17
TORSDOF 5