%chk=000174421.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000174421

0 1
 S  -0.1033000       3.045100      7.3399998E-02
 S   -3.266100      -1.321800      7.9099998E-02
 O   0.4375000       3.444700      -1.413600    
 O   -3.685200      -1.473800      -1.493700    
 O   -1.454400       3.563500      0.1946000    
 O   0.9219000       3.388700       1.041500    
 O   -3.176100      -2.667600      0.6265000    
 O   -4.140900     -0.3309000      0.6860000    
 N    1.750900      -3.185800     -1.6899999E-02
 N    4.317100      -2.051300     -4.4100001E-02
 C   0.9252000      0.4612000      3.2499999E-02
 C   0.7546000     -0.9436000      2.1000000E-02
 C  -0.2079000       1.290700      5.7799999E-02
 C   -1.658900     -0.6386000      6.1099999E-02
 C  -0.5443000      -1.477600      3.5500001E-02
 C    1.887700      -1.772800     -4.6999999E-03
 C   -1.491000      0.7429000      7.1999997E-02
 C    2.223900      0.9954000      1.7800000E-02
 C    3.170600      -1.225000     -1.8600000E-02
 C    3.338500      0.1566000     -7.3000002E-03
 H  -0.7194000      -2.547800      1.6899999E-02
 H   -2.370600       1.378700      7.8299999E-02
 H    2.440000       2.055500     -2.4800001E-02
 H    4.332900      0.5959000     -2.8700000E-02
 H   0.8501000      -3.638100     -3.9999999E-04
 H    2.568300      -3.777700     -3.7300002E-02
 H    4.246700      -3.057300     -5.1800001E-02
 H    5.234800      -1.624800     -5.3599998E-02
 H  -0.1500000       3.185300      -2.161800    
 H   -3.114400      -2.075500      -2.027200    


%chk=000174421-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174421

0 1
S -0.191116 3.085697 0.009926
S -3.275274 -1.545499 0.082486
O 0.357566 3.252671 -1.758864
O -3.612558 -1.366444 -1.735173
O -1.701838 3.641607 0.158479
O 0.975623 3.699551 0.948016
O -3.097698 -3.115185 0.437193
O -4.345302 -0.631582 0.878853
N 1.927510 -3.265088 0.103295
N 4.420255 -2.083844 0.084933
C 0.978496 0.432541 -0.022865
C 0.828818 -1.024617 0.031689
C -0.232455 1.194014 0.003278
C -1.592573 -0.740151 0.049554
C -0.489212 -1.579193 0.040984
C 1.996830 -1.862666 0.046466
C -1.519246 0.674246 0.039376
C 2.287236 0.991040 -0.104638
C 3.287355 -1.263583 0.022038
C 3.404192 0.153825 -0.083987
H -0.666970 -2.659939 0.045222
H -2.406717 1.314451 0.074699
H 2.421595 2.073272 -0.153943
H 4.407371 0.595492 -0.115766
H 1.041309 -3.731444 0.279716
H 2.615028 -3.801036 -0.427676
H 4.348768 -2.977288 0.572038
H 5.342451 -1.654557 0.049709
H 0.396903 4.231661 -1.967630
H -4.588146 -1.543751 -1.877908


