REMARK  Name = BDB027983
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.185   0.014  -0.021  0.00  0.00    +0.083 C 
ATOM      2  C   LIG    1        1.209  -0.252   0.568  0.00  0.00    +0.133 C 
ATOM      3  N   LIG    1        2.112  -0.083  -0.548  0.00  0.00    -0.270 N 
ATOM      4  C   LIG    1        1.513   0.703  -1.542  0.00  0.00    +0.221 C 
ATOM      5  O   LIG    1        1.966   1.088  -2.609  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1        0.137   1.090  -1.058  0.00  0.00    +0.116 C 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1        3.451  -0.562  -0.536  0.00  0.00    +0.036 A 
ATOM      8  C   LIG    1        3.986  -1.164   0.615  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1        5.301  -1.645   0.642  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        6.107  -1.533  -0.485  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1        5.598  -0.940  -1.634  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        4.283  -0.459  -1.658  0.00  0.00    +0.023 A 
ENDBRANCH   3   7
BRANCH   1  14
ATOM     13  C   LIG    1       -1.412  -0.675   1.964  0.00  0.00    +0.106 C 
ATOM     14  N   LIG    1       -1.217   0.384   0.968  0.00  0.00    -0.290 NA
BRANCH  14  15
ATOM     15  C   LIG    1       -2.490   0.868   0.370  0.00  0.00    +0.144 C 
ATOM     16  C   LIG    1       -3.365   1.578   1.432  0.00  0.00    +0.236 C 
ATOM     17  O   LIG    1       -2.921   2.165   2.418  0.00  0.00    -0.274 OA
ATOM     18  N   LIG    1       -4.721   1.585   1.194  0.00  0.00    -0.255 N 
ATOM     19  H   LIG    1       -5.281   2.072   1.880  0.00  0.00    +0.158 HD
ATOM     20  C   LIG    1       -5.396   1.085   0.111  0.00  0.00    +0.219 C 
ATOM     21  O   LIG    1       -6.608   1.236  -0.008  0.00  0.00    -0.275 OA
ATOM     22  C   LIG    1       -4.561   0.408  -0.947  0.00  0.00    +0.098 C 
ATOM     23  C   LIG    1       -3.310  -0.214  -0.345  0.00  0.00    +0.037 C 
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 3