%chk=000169291.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169291

0 1
 S   -5.983600      0.1811000     -0.2344000    
 O   -1.039400      0.4794000       1.010100    
 O   -6.807500      -1.014300     -0.9783000    
 O   -5.844900       1.294900      -1.155100    
 O   -6.529200      0.3626000       1.098900    
 O    2.697900       3.365100     -0.4460000    
 O    3.811300      -2.758300      4.0600002E-02
 O    4.581500       2.168000      0.1182000    
 O    1.761800      -3.545800     -0.6512000    
 C   -3.347100      0.2748000      0.4085000    
 C   -4.433900     -0.6527000     -0.1063000    
 C   -2.012600     -0.4432000      0.5403000    
 C   0.2584000      0.2569000      0.6290000    
 C   0.6939000      -1.042200      0.3944000    
 C    1.125500       1.333300      0.4811000    
 C    2.014500      -1.267900      6.5000001E-03
 C    2.446100       1.107500      9.3099996E-02
 C    2.890700     -0.1931000     -0.1443000    
 C    3.358600       2.229000     -6.5499999E-02
 C    2.478700      -2.624100     -0.2392000    
 C    3.491100       4.541500     -0.6366000    
 C    4.388100      -4.052600     -0.1637000    
 H   -3.230200       1.138500     -0.2583000    
 H   -3.631600      0.6961000       1.381000    
 H   -4.572400      -1.508900      0.5613000    
 H   -4.175500      -1.019300      -1.105200    
 H   -2.100200      -1.269000       1.256000    
 H   -1.749200     -0.8424000     -0.4480000    
 H   3.9900001E-02  -1.897800      0.5371000    
 H   0.7577000       2.336000      0.6833000    
 H    3.918300     -0.3543000     -0.4620000    
 H   -6.563000      -1.175900      -1.919900    
 H    2.826100       5.355900     -0.9358000    
 H    3.987500       4.817000      0.2986000    
 H    4.225900       4.376400      -1.430100    
 H    5.447400      -3.999000      0.1011000    
 H    3.899900      -4.788900      0.4815000    
 H    4.301500      -4.342000      -1.215100    


%chk=000169291-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169291

0 1
S -6.262918 0.098315 -0.160034
O -1.086347 0.674481 -0.087256
O -7.185910 -1.508817 0.041681
O -6.561371 0.725046 -1.620641
O -6.450375 1.016783 1.156980
O 2.929726 3.545081 -0.001661
O 3.998948 -2.765296 -0.040855
O 4.801698 2.158586 0.003330
O 1.845222 -3.652024 -0.077025
C -3.444938 0.267443 -0.131056
C -4.556246 -0.783551 -0.128654
C -2.070184 -0.418522 -0.106180
C 0.273522 0.326044 -0.069737
C 0.757464 -0.999940 -0.071738
C 1.174098 1.417374 -0.049251
C 2.158214 -1.230449 -0.054444
C 2.565345 1.174848 -0.031467
C 3.066760 -0.151470 -0.034448
C 3.554381 2.295515 -0.008805
C 2.610402 -2.654686 -0.058941
C 3.842204 4.712559 0.021566
C 4.530987 -4.148567 -0.045038
H -3.509796 0.903074 -1.032725
H -3.531996 0.924509 0.752946
H -4.610805 -1.389008 0.789736
H -4.593737 -1.419935 -1.026788
H -1.950963 -1.050262 0.798500
H -1.917713 -1.049733 -1.006011
H 0.099112 -1.873417 -0.086579
H 0.787358 2.439043 -0.046996
H 4.145072 -0.325289 -0.021233
H -8.165751 -1.311683 0.014865
H 3.177514 5.587439 0.024342
H 4.471474 4.686094 0.926941
H 4.491127 4.706616 -0.870186
H 5.622782 -4.027556 -0.028879
H 4.176334 -4.695722 0.844460
H 4.201302 -4.680619 -0.953120


