%chk=000162250.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162250

0 1
 S   -2.775700     -9.6299998E-02 -0.7448000    
 S    2.886400      0.1208000      0.7531000    
 O  -0.1663000      -1.721900     -0.4906000    
 O   0.1373000       1.753900      0.6236000    
 O   1.4900000E-02  -3.196900       1.278100    
 O  -2.8700000E-02   3.145800      -1.212700    
 O   -4.622200     -0.1751000       1.147500    
 O    4.523000      0.1463000      -1.324600    
 C  -0.3123000     -0.6339000      0.4212000    
 C   0.2887000      0.6251000     -0.2354000    
 C   -1.799500     -0.4499000      0.7526000    
 C    1.769400      0.5152000     -0.6306000    
 C  -9.9999998E-03  -2.952600      7.9400003E-02
 C  -1.3100000E-02   2.957300     -3.8000001E-03
 C   -4.388600     -1.3400000E-02 -4.4100001E-02
 C    4.412500     -1.1600000E-02 -0.1148000    
 C   0.1299000      -3.991200     -0.9918000    
 C  -0.1608000       4.044500       1.017100    
 C   -5.459900      0.2751000      -1.057100    
 C    5.575000     -0.3414000      0.7778000    
 H   0.2111000     -0.8262000       1.366100    
 H  -0.2364000      0.7977000      -1.183200    
 H   -2.192800      -1.370900       1.196000    
 H   -1.936000      0.3623000       1.473900    
 H    1.881600     -0.2635000      -1.393000    
 H    2.113700       1.459300      -1.066200    
 H    1.010300      -3.776400      -1.602700    
 H   0.2577000      -4.974200     -0.5296000    
 H  -0.7720000      -4.010500      -1.608700    
 H   0.7354000       4.091000       1.640700    
 H  -0.2822000       5.005400      0.5089000    
 H   -1.047200       3.859600       1.629000    
 H   -5.280600       1.242500      -1.534500    
 H   -6.430700      0.3151000     -0.5538000    
 H   -5.495100     -0.5183000      -1.808900    
 H    5.713600      0.4436000       1.526500    
 H    6.485800     -0.4056000      0.1747000    
 H    5.417100      -1.307300       1.265600    


%chk=000162250-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162250

0 1
S -2.871586 -0.812084 -0.292671
S 2.879792 0.818668 0.266893
O 0.175015 -1.778373 -0.483697
O -0.164847 1.787179 0.453910
O 1.430005 -2.816504 1.194041
O -1.427039 2.820813 -1.221285
O -3.465754 1.458149 1.147974
O 3.475332 -1.452878 -1.171596
C -0.101010 -0.623508 0.419640
C 0.110686 0.631840 -0.448442
C -1.504760 -0.768157 1.014165
C 1.515165 0.775165 -1.041760
C 0.980306 -2.817744 0.026395
C -0.974126 2.824294 -0.054927
C -3.762836 0.766553 0.147977
C 3.770578 -0.761017 -0.171276
C 1.226500 -3.857377 -1.036785
C -1.218634 3.864730 1.007826
C -4.831550 1.126415 -0.859891
C 4.837474 -1.121036 0.838527
H 0.632144 -0.644891 1.249560
H -0.622111 0.652994 -1.278654
H -1.576417 -1.704452 1.588225
H -1.741919 0.090693 1.668273
H 1.752240 -0.084697 -1.694544
H 1.588096 1.710624 -1.617082
H 2.109279 -3.539499 -1.621943
H 1.445674 -4.828843 -0.568851
H 0.367952 -3.937481 -1.720787
H -0.356353 3.949723 1.686585
H -1.444667 4.834457 0.539664
H -2.096466 3.543905 1.598746
H -4.389611 1.840420 -1.581392
H -5.672611 1.627718 -0.353032
H -5.192040 0.247590 -1.418344
H 5.194874 -0.242834 1.399900
H 5.680865 -1.619246 0.332368
H 4.395658 -1.837909 1.557190


