%chk=000143658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000143658

0 1
 S    3.043000       1.392200     -0.6090000    
 O   -3.042500     -0.1878000      0.9822000    
 C   0.3861000      0.9643000     -4.0399998E-02
 C  -0.6999000      7.1199998E-02  0.5593000    
 C    1.762000      0.3209000      0.1031000    
 C   -2.084700      0.6808000      0.3931000    
 C    4.519100      0.4243000     -0.3147000    
 C   -4.293300     -0.2005000      0.4216000    
 C    4.631700     -0.8481000     -0.8663000    
 C    5.545600      0.9500000      0.4638000    
 C   -4.785200      0.9474000     -0.1887000    
 C   -5.056500      -1.361200      0.4700000    
 C    5.782300      -1.602600     -0.6370000    
 C    6.696200      0.1954000      0.6929000    
 C   -6.058300      0.9346000     -0.7585000    
 C   -6.329600      -1.374000     -9.9900000E-02
 C    6.814400      -1.080800      0.1425000    
 C   -6.830500     -0.2261000     -0.7141000    
 H   0.3697000       1.938500      0.4643000    
 H   0.1637000       1.140400      -1.100500    
 H  -0.6816000     -0.9190000      8.6700000E-02
 H  -0.5032000     -0.1014000       1.624800    
 H    1.768700     -0.6475000     -0.4075000    
 H    1.991400      0.1497000       1.160400    
 H   -2.130800       1.655300      0.8928000    
 H   -2.260700      0.8143000     -0.6823000    
 H    3.844600      -1.271200      -1.484900    
 H    5.470200       1.942400      0.9007000    
 H   -4.229200       1.879500     -0.2181000    
 H   -4.670100      -2.257200      0.9474000    
 H    5.875500      -2.595400      -1.067200    
 H    7.500200      0.6014000       1.299900    
 H   -6.451600       1.830200      -1.230700    
 H   -6.931200      -2.277600     -6.5099999E-02
 H    7.710600      -1.668100      0.3205000    
 H   -7.822400     -0.2356000      -1.156300    


%chk=000143658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000143658

0 1
S 3.167918 1.447383 -0.592841
O -3.051324 -0.606667 0.268983
C 0.441491 0.791194 -0.324513
C -0.683911 -0.179673 0.107541
C 1.831895 0.206490 -0.029245
C -2.072660 0.408156 -0.157479
C 4.688315 0.477174 -0.189656
C -4.416849 -0.303778 0.129604
C 5.008641 -0.694536 -0.916823
C 5.557771 0.942494 0.824941
C -4.918659 0.917352 -0.387034
C -5.308745 -1.322855 0.549447
C 6.190326 -1.409223 -0.615164
C 6.748047 0.233021 1.111815
C -6.318112 1.105984 -0.478244
C -6.698816 -1.118806 0.451678
C 7.063539 -0.945827 0.397552
C -7.214117 0.097255 -0.062779
H 0.328672 1.757621 0.206590
H 0.356320 1.008343 -1.408105
H -0.592912 -1.137599 -0.438986
H -0.595412 -0.412470 1.185781
H 1.995121 -0.737533 -0.576925
H 1.977070 0.028327 1.049705
H -2.224993 1.343592 0.421256
H -2.211387 0.632318 -1.236282
H 4.347284 -1.034065 -1.721645
H 5.299530 1.848099 1.383396
H -4.244308 1.713724 -0.715344
H -4.891970 -2.254744 0.944104
H 6.434106 -2.316844 -1.178675
H 7.421104 0.598502 1.895439
H -6.704084 2.050741 -0.878029
H -7.382868 -1.910426 0.777608
H 7.983132 -1.496715 0.624277
H -8.295454 0.252692 -0.137147


