REMARK  Name = BDB000834
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.843  -0.581  -0.984  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1        1.951   0.249  -1.075  0.00  0.00    +0.117 A 
ATOM      3  N   LIG    1        3.056   0.136  -0.302  0.00  0.00    -0.240 NA
ATOM      4  C   LIG    1        3.100  -0.857   0.609  0.00  0.00    +0.124 A 
ATOM      5  C   LIG    1        2.032  -1.742   0.762  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1        0.900  -1.605  -0.040  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        4.221  -1.034   1.448  0.00  0.00    -0.279 N 
ATOM      8  H   LIG    1        3.927  -1.099   2.413  0.00  0.00    +0.155 HD
BRANCH   7   9
ATOM      9  C   LIG    1        5.419  -0.440   1.236  0.00  0.00    +0.165 A 
ATOM     10  S   LIG    1        6.378   0.021   2.602  0.00  0.00    -0.042 S 
ATOM     11  C   LIG    1        7.595   0.607   1.556  0.00  0.00    +0.110 A 
ATOM     12  C   LIG    1        7.221   0.397   0.249  0.00  0.00    +0.139 A 
ATOM     13  N   LIG    1        5.997  -0.214   0.075  0.00  0.00    -0.232 NA
BRANCH  11  14
ATOM     14  C   LIG    1        8.807   1.211   1.985  0.00  0.00    +0.108 C 
ATOM     15  N   LIG    1        9.800   1.704   2.328  0.00  0.00    -0.190 NA
ENDBRANCH  11  14
ENDBRANCH   7   9
ENDBRANCH   4   7
BRANCH   1  16
ATOM     16  C   LIG    1       -0.342  -0.406  -1.900  0.00  0.00    +0.121 C 
BRANCH  16  20
ATOM     17  N   LIG    1       -4.229   0.022  -0.163  0.00  0.00    -0.300 NA
ATOM     18  C   LIG    1       -4.119   0.010  -1.627  0.00  0.00    +0.100 C 
ATOM     19  C   LIG    1       -2.756  -0.544  -2.125  0.00  0.00    +0.100 C 
ATOM     20  N   LIG    1       -1.625  -0.370  -1.191  0.00  0.00    -0.296 NA
ATOM     21  C   LIG    1       -1.815   0.850  -0.394  0.00  0.00    +0.100 C 
ATOM     22  C   LIG    1       -3.134   0.821   0.426  0.00  0.00    +0.100 C 
BRANCH  17  24
ATOM     23  C   LIG    1       -5.766   0.276   1.779  0.00  0.00    +0.020 C 
ATOM     24  C   LIG    1       -5.557   0.455   0.279  0.00  0.00    +0.081 C 
ENDBRANCH  17  24
ENDBRANCH  16  20
ENDBRANCH   1  16
TORSDOF 6