%chk=000128503.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128503

0 1
 S   -2.727700       2.836400     -0.4153000    
 O    2.506400       1.965600     -0.4039000    
 O   -1.636400      -2.957700      0.3031000    
 N    3.113600     -0.7749000      0.1192000    
 C    1.751900     -0.2387000      0.3512000    
 C    1.499600      0.9650000     -0.5807000    
 C   0.6595000      -1.297800      9.5500000E-02
 C   0.1529000       1.617000     -0.2581000    
 C  -0.7414000     -0.7369000      3.9500002E-02
 C  -0.9797000      0.6326000     -0.1624000    
 C    4.113500      0.2956000      0.2638000    
 C    3.800000       1.441500     -0.6872000    
 C    3.445800      -1.878600       1.022900    
 C   -1.830400      -1.616900      0.1387000    
 C   -2.300800       1.101600     -0.2233000    
 C   -3.139000      -1.140900      6.5899998E-02
 C   -3.374200      0.2189000     -0.1123000    
 C   -1.535800      -3.745400     -0.8803000    
 C   -2.777600       3.313700       1.323500    
 H    1.681400      0.1085000       1.393200    
 H    1.502600      0.6435000      -1.632500    
 H   0.7036000      -2.050900      0.8913000    
 H   0.8591000      -1.800700     -0.8593000    
 H  -3.3100002E-02   2.362100      -1.041000    
 H   0.2308000       2.165100      0.6900000    
 H    5.114600     -8.6700000E-02  3.3000000E-02
 H    4.121700      0.6684000       1.296500    
 H    4.524700       2.250200     -0.5483000    
 H    3.851600       1.127100      -1.736600    
 H    4.477300      -2.212500      0.8600000    
 H    2.817500      -2.753500      0.8298000    
 H    3.340900      -1.595800       2.076400    
 H   -3.979200      -1.825100      0.1483000    
 H   -4.403300      0.5675000     -0.1585000    
 H   -1.254600      -4.761900     -0.5918000    
 H  -0.7736000      -3.352400      -1.559500    
 H   -2.503500      -3.783100      -1.390500    
 H   -1.806500       3.154000       1.799400    
 H   -3.538900       2.739500       1.858800    
 H   -3.028800       4.375100       1.398900    


%chk=000128503-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128503

0 1
S -2.810833 2.802441 -0.480678
O 2.508825 2.181091 -0.139156
O -1.232596 -3.052035 -0.323672
N 3.230803 -0.619793 0.127784
C 1.824924 -0.173496 0.353337
C 1.545932 1.111069 -0.457004
C 0.817021 -1.255600 -0.086580
C 0.163301 1.674050 -0.123714
C -0.613877 -0.748240 -0.210948
C -0.940588 0.633846 -0.232007
C 4.189385 0.469289 0.447840
C 3.879423 1.713231 -0.394562
C 3.578432 -1.864290 0.846828
C -1.658988 -1.710049 -0.337746
C -2.307189 1.027057 -0.359101
C -3.009148 -1.319230 -0.469143
C -3.322677 0.057095 -0.474989
C -2.256791 -4.091182 -0.447304
C -2.615455 3.362215 1.317667
H 1.657581 0.072663 1.436335
H 1.628055 0.857147 -1.538491
H 0.824389 -2.109214 0.613647
H 1.151562 -1.665469 -1.061736
H -0.065908 2.534239 -0.777858
H 0.212728 2.077009 0.908610
H 5.213743 0.116017 0.220980
H 4.154365 0.747431 1.532519
H 4.537629 2.555747 -0.123722
H 4.000536 1.474602 -1.472941
H 4.635457 -2.113925 0.644471
H 2.962483 -2.705004 0.488221
H 3.448194 -1.782454 1.955822
H -3.810935 -2.056243 -0.566770
H -4.362547 0.383071 -0.575497
H -1.706607 -5.042988 -0.409810
H -2.796951 -4.010458 -1.410498
H -2.981529 -4.045390 0.388722
H -1.555475 3.356480 1.613045
H -3.205130 2.706660 1.975963
H -3.007045 4.391110 1.359539


