%chk=000065837.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065837

0 1
 S    4.042100      -2.028000     -0.3742000    
 S   -1.949200       2.231300     -0.3453000    
 S   -2.378500      -2.009900      -1.019600    
 O    4.238400      0.6015000     -0.4195000    
 O   0.1542000       1.278800       1.797300    
 O   -1.284800      0.4992000      -2.201100    
 N    1.426200      0.8003000     -8.3800003E-02
 C    2.155800     -0.2997000      0.4778000    
 C    1.502200      -1.642500      0.1718000    
 C    2.550400      -2.716300      0.3983000    
 C    3.529700     -0.3549000     -0.1461000    
 C   0.4718000       1.509200      0.6321000    
 C  -0.1731000       2.613400     -0.1927000    
 C   5.1000002E-03   3.979300      0.4573000    
 C   -1.863000      0.6488000      -1.129900    
 C   -2.476100     -0.4469000     -0.3739000    
 C   -3.129600     -0.3692000      0.8092000    
 C   -3.581500      -1.655800       1.222500    
 C   -3.240200      -2.638600      0.3198000    
 H    2.273500     -0.1638000       1.559400    
 H    1.148200      -1.676500     -0.8682000    
 H   0.6247000      -1.808900      0.8065000    
 H    2.734700      -2.871400       1.465800    
 H    2.270900      -3.667900     -6.1000001E-02
 H    1.606900       1.047100      -1.052600    
 H   0.2540000       2.649300      -1.200500    
 H  -0.4247000       4.013900       1.465200    
 H    1.071300       4.212700      0.5575000    
 H  -0.4533000       4.772500     -0.1432000    
 H   -3.307700      0.5238000       1.393200    
 H   -4.129100      -1.850500       2.135500    
 H   -3.455500      -3.696000      0.3828000    


%chk=000065837-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065837

0 1
S 4.281911 -2.342171 -0.878215
S -1.609645 1.419313 0.946750
S -3.411470 -1.821644 -1.627692
O 3.136249 -0.338829 -2.388036
O 1.908711 1.948337 1.667025
O -1.042490 0.125869 -1.413609
N 1.551680 0.572731 -0.175485
C 2.764435 -0.199510 0.068574
C 2.620502 -1.355408 1.088007
C 3.901928 -2.203789 0.984467
C 3.309953 -0.798967 -1.246442
C 1.210082 1.615729 0.660005
C -0.078630 2.360225 0.259689
C -0.112140 3.792369 0.801809
C -1.869691 0.227852 -0.460985
C -3.092513 -0.562142 -0.361517
C -4.121840 -0.527733 0.584070
C -5.162241 -1.480806 0.333069
C -4.935193 -2.247220 -0.806413
H 3.532922 0.503043 0.458073
H 1.734203 -1.963602 0.830478
H 2.488168 -0.952822 2.106732
H 4.764347 -1.718019 1.468491
H 3.778272 -3.224480 1.374210
H 0.928450 0.334227 -0.960457
H -0.215067 2.323443 -0.835373
H 0.036009 3.803008 1.893841
H 0.715709 4.370646 0.353350
H -1.065470 4.286935 0.551235
H -4.128488 0.167293 1.427722
H -6.045474 -1.595645 0.964843
H -5.559379 -3.033931 -1.227815


