REMARK  Name = BDB003993
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.797   0.411   0.593  0.00  0.00    +0.118 C 
ATOM      2  C   LIG    1       -2.173   0.324  -0.072  0.00  0.00    +0.033 C 
ENDROOT
BRANCH   1   6
ATOM      3  C   LIG    1        2.490  -1.664  -2.317  0.00  0.00    +0.067 C 
ATOM      4  C   LIG    1        1.706  -0.577  -1.682  0.00  0.00    +0.060 A 
ATOM      5  N   LIG    1        0.780  -0.860  -0.758  0.00  0.00    -0.176 NA
ATOM      6  N   LIG    1        0.266   0.345  -0.417  0.00  0.00    -0.265 N 
ATOM      7  C   LIG    1        0.857   1.387  -1.087  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1        0.497   2.814  -0.900  0.00  0.00    +0.065 C 
ATOM      9  C   LIG    1        1.794   0.810  -1.918  0.00  0.00    +0.047 A 
ENDBRANCH   1   6
BRANCH   1  10
ATOM     10  C   LIG    1       -0.578  -0.604   1.742  0.00  0.00    +0.119 C 
ATOM     11  C   LIG    1       -1.155  -0.057   3.055  0.00  0.00    +0.021 C 
BRANCH  10  12
ATOM     12  C   LIG    1       -1.177  -1.973   1.456  0.00  0.00    +0.310 C 
ATOM     13  O   LIG    1       -2.129  -2.442   2.066  0.00  0.00    -0.251 OA
BRANCH  12  14
ATOM     14  O   LIG    1       -0.565  -2.664   0.474  0.00  0.00    -0.480 OA
ATOM     15  H   LIG    1        0.121  -2.133  -0.014  0.00  0.00    +0.295 HD
ENDBRANCH  12  14
ENDBRANCH  10  12
ENDBRANCH   1  10
TORSDOF 4