REMARK  Name = BDB000832
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.262  -1.040  -0.364  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1        2.226  -0.348  -1.085  0.00  0.00    +0.117 A 
ATOM      3  N   LIG    1        3.439   0.003  -0.598  0.00  0.00    -0.240 NA
ATOM      4  C   LIG    1        3.740  -0.330   0.673  0.00  0.00    +0.124 A 
ATOM      5  C   LIG    1        2.835  -1.039   1.464  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1        1.594  -1.401   0.941  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        4.983   0.014   1.247  0.00  0.00    -0.279 N 
ATOM      8  H   LIG    1        5.417  -0.802   1.656  0.00  0.00    +0.155 HD
BRANCH   7   9
ATOM      9  C   LIG    1        5.829   0.925   0.712  0.00  0.00    +0.165 A 
ATOM     10  S   LIG    1        7.535   0.690   0.892  0.00  0.00    -0.042 S 
ATOM     11  C   LIG    1        7.829   2.143   0.043  0.00  0.00    +0.110 A 
ATOM     12  C   LIG    1        6.633   2.729  -0.298  0.00  0.00    +0.139 A 
ATOM     13  N   LIG    1        5.504   2.044   0.101  0.00  0.00    -0.232 NA
BRANCH  11  14
ATOM     14  C   LIG    1        9.120   2.659  -0.252  0.00  0.00    +0.108 C 
ATOM     15  N   LIG    1       10.171   3.087  -0.494  0.00  0.00    -0.190 NA
ENDBRANCH  11  14
ENDBRANCH   7   9
ENDBRANCH   4   7
BRANCH   1  16
ATOM     16  C   LIG    1       -0.054  -1.419  -0.996  0.00  0.00    +0.121 C 
BRANCH  16  24
ATOM     17  C   LIG    1       -7.561   0.326   0.308  0.00  0.00    +0.129 C 
ATOM     18  N   LIG    1       -6.222  -0.207   0.244  0.00  0.00    -0.302 N 
ATOM     19  H   LIG    1       -5.958  -0.827   0.993  0.00  0.00    +0.150 HD
ATOM     20  C   LIG    1       -5.199   0.589  -0.209  0.00  0.00    +0.302 C 
ATOM     21  N   LIG    1       -3.953  -0.004  -0.171  0.00  0.00    -0.283 N 
ATOM     22  C   LIG    1       -2.789   0.796  -0.547  0.00  0.00    +0.124 C 
ATOM     23  C   LIG    1       -1.487   0.265   0.081  0.00  0.00    +0.104 C 
ATOM     24  N   LIG    1       -1.215  -1.178  -0.126  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -2.400  -1.898  -0.630  0.00  0.00    +0.104 C 
ATOM     26  C   LIG    1       -3.712  -1.435   0.027  0.00  0.00    +0.124 C 
ATOM     27  O   LIG    1       -5.384   1.732  -0.617  0.00  0.00    -0.253 OA
ENDBRANCH  16  24
ENDBRANCH   1  16
TORSDOF 5