REMARK  Name = BDB027184
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.512   1.433  -1.442  0.00  0.00    -0.220 N 
ATOM      2  H   LIG    1       -1.900   1.064  -2.310  0.00  0.00    +0.173 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -0.200   1.036  -1.066  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1        0.320  -0.132  -1.625  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1        1.603  -0.568  -1.279  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        2.398   0.160  -0.380  0.00  0.00    -0.018 A 
ATOM      7  C   LIG    1        1.866   1.345   0.154  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1        0.582   1.783  -0.189  0.00  0.00    +0.025 A 
BRANCH   6   9
ATOM      9  C   LIG    1        3.749  -0.297  -0.018  0.00  0.00    -0.018 A 
ATOM     10  C   LIG    1        4.860   0.554  -0.144  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1        6.144   0.120   0.199  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        6.339  -1.174   0.675  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        5.252  -2.034   0.808  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        3.969  -1.599   0.464  0.00  0.00    +0.008 A 
ENDBRANCH   6   9
ENDBRANCH   1   3
BRANCH   1  15
ATOM     15  S   LIG    1       -2.675   1.835  -0.303  0.00  0.00    +0.048 S 
ATOM     16  O   LIG    1       -3.917   1.929  -1.040  0.00  0.00    -0.155 OA
ATOM     17  O   LIG    1       -2.202   2.955   0.482  0.00  0.00    -0.155 OA
BRANCH  15  20
ATOM     18  N   LIG    1       -4.530  -1.179   0.363  0.00  0.00    -0.268 N 
ATOM     19  C   LIG    1       -3.113  -0.868   0.012  0.00  0.00    +0.144 C 
ATOM     20  C   LIG    1       -2.746   0.398   0.767  0.00  0.00    +0.171 C 
ATOM     21  C   LIG    1       -3.828   0.536   1.830  0.00  0.00    +0.049 C 
ATOM     22  C   LIG    1       -5.064  -0.062   1.180  0.00  0.00    +0.118 C 
BRANCH  18  24
ATOM     23  N   LIG    1       -5.951  -2.757  -0.951  0.00  0.00    -0.174 NA
ATOM     24  C   LIG    1       -5.301  -2.023  -0.337  0.00  0.00    +0.169 C 
ENDBRANCH  18  24
ENDBRANCH  15  20
ENDBRANCH   1  15
TORSDOF 5