REMARK  Name = BDB018330
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.042  -3.603   2.351  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -2.336  -2.402   1.585  0.00  0.00    -0.318 N 
ATOM      3  C   LIG    1       -3.660  -2.038   1.377  0.00  0.00    +0.252 A 
ATOM      4  O   LIG    1       -4.635  -2.642   1.815  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1       -3.869  -0.810   0.576  0.00  0.00    +0.081 A 
ATOM      6  C   LIG    1       -2.833  -0.112   0.075  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1       -1.455  -0.582   0.292  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1       -1.282  -1.692   1.038  0.00  0.00    +0.098 A 
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1       -3.198   1.124  -0.650  0.00  0.00    +0.072 A 
ATOM     10  N   LIG    1       -3.956   0.964  -1.762  0.00  0.00    -0.255 NA
ATOM     11  C   LIG    1       -4.300   2.080  -2.440  0.00  0.00    +0.111 A 
ATOM     12  C   LIG    1       -3.929   3.359  -2.060  0.00  0.00    +0.020 A 
ATOM     13  C   LIG    1       -3.159   3.505  -0.912  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1       -2.788   2.373  -0.191  0.00  0.00    +0.028 A 
ENDBRANCH   6   9
BRANCH   7  15
ATOM     15  C   LIG    1       -0.326   0.084  -0.290  0.00  0.00    +0.022 A 
ATOM     16  C   LIG    1        0.847   0.418   0.351  0.00  0.00    +0.117 A 
ATOM     17  N   LIG    1        1.643   1.006  -0.594  0.00  0.00    -0.267 N 
ATOM     18  N   LIG    1        1.051   1.103  -1.803  0.00  0.00    -0.179 NA
ATOM     19  C   LIG    1       -0.141   0.526  -1.619  0.00  0.00    +0.143 A 
BRANCH  17  20
ATOM     20  C   LIG    1        2.983   1.544  -0.393  0.00  0.00    +0.178 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.996   0.452  -0.150  0.00  0.00    -0.026 A 
ATOM     22  C   LIG    1        4.646   0.341   1.088  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1        5.583  -0.670   1.307  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        5.882  -1.578   0.293  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        5.245  -1.477  -0.942  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        4.308  -0.467  -1.164  0.00  0.00    +0.005 A 
ENDBRANCH  20  21
ENDBRANCH  17  20
ENDBRANCH   7  15
TORSDOF 4