REMARK  Name = BDB048103
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.464   1.837  -0.226  0.00  0.00    +0.237 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.013   1.013  -1.391  0.00  0.00    +0.100 C 
BRANCH   2   5
ATOM      3  C   LIG    1        1.616  -2.009  -0.032  0.00  0.00    +0.088 C 
ATOM      4  C   LIG    1        2.492  -0.919  -0.492  0.00  0.00    +0.126 A 
ATOM      5  C   LIG    1        2.288   0.326  -1.047  0.00  0.00    +0.086 A 
ATOM      6  N   LIG    1        3.504   0.933  -1.272  0.00  0.00    -0.214 NA
ATOM      7  C   LIG    1        4.392   0.052  -0.850  0.00  0.00    +0.228 A 
ATOM      8  O   LIG    1        3.839  -1.103  -0.359  0.00  0.00    -0.440 OA
BRANCH   7   9
ATOM      9  C   LIG    1        5.850   0.144  -0.838  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        6.657  -0.893  -0.347  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        8.050  -0.776  -0.347  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        8.654   0.379  -0.839  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        7.867   1.418  -1.330  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        6.475   1.301  -1.329  0.00  0.00    +0.013 A 
ENDBRANCH   7   9
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  O   LIG    1        0.031   1.017   0.868  0.00  0.00    -0.476 OA
BRANCH  15  16
ATOM     16  C   LIG    1       -1.244   0.509   0.743  0.00  0.00    +0.215 A 
ATOM     17  N   LIG    1       -1.934   0.686  -0.401  0.00  0.00    -0.221 NA
ATOM     18  C   LIG    1       -3.170   0.142  -0.459  0.00  0.00    +0.118 A 
ATOM     19  C   LIG    1       -3.753  -0.583   0.578  0.00  0.00    -0.028 A 
ATOM     20  C   LIG    1       -3.006  -0.748   1.747  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1       -1.730  -0.198   1.830  0.00  0.00    +0.067 A 
BRANCH  19  22
ATOM     22  C   LIG    1       -5.146  -1.147   0.457  0.00  0.00    +0.051 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -6.218  -0.194   1.012  0.00  0.00    +0.099 C 
ATOM     24  C   LIG    1       -7.538  -0.931   1.229  0.00  0.00    +0.019 C 
BRANCH  23  25
ATOM     25  C   LIG    1       -6.469   0.955   0.054  0.00  0.00    +0.308 C 
ATOM     26  O   LIG    1       -6.385   0.874  -1.162  0.00  0.00    -0.251 OA
BRANCH  25  27
ATOM     27  O   LIG    1       -6.840   2.098   0.672  0.00  0.00    -0.480 OA
ATOM     28  H   LIG    1       -6.872   2.043   1.646  0.00  0.00    +0.295 HD
ENDBRANCH  25  27
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 9