%chk=000130920.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130920

0 1
 S   -1.490900      -2.375700      -3.157600    
 O   0.3508000      -4.115500       1.015600    
 O   0.9438000     -0.8020000      -1.942200    
 O   -4.383300      0.3202000       1.252600    
 O    4.320400       2.480400       1.026200    
 O    9.222100       2.262500     -0.8146000    
 C  -0.3260000      -2.911300      0.6715000    
 C   -1.158400      -2.429800       1.857800    
 C   -1.903800      -1.140800       1.523800    
 C   0.6717000      -1.895300      0.1959000    
 C   -1.174800      -3.151100     -0.5463000    
 C   -2.760200     -0.6802000       2.701300    
 C   0.3532000      -1.588500      -1.225800    
 C  -0.8108000      -2.416900      -1.602500    
 C    1.681400      -1.314000      0.8534000    
 C   -3.542400      0.5823000       2.367500    
 C    2.559400     -0.3361000      0.2549000    
 C    4.489900       1.263400      0.3039000    
 C    3.571000      0.2447000      0.9179000    
 C    5.949900      0.7977000      0.3870000    
 C    6.922400       1.799000     -0.2514000    
 C   -1.985300     -0.6366000      -3.264200    
 C   -4.678200       1.381900      0.4372000    
 C    8.366300       1.312200     -0.1971000    
 C   -4.731700       2.664500      0.9699000    
 C   -4.921800       1.163600     -0.9138000    
 C   -5.033100       3.744300      0.1399000    
 C   -5.223000       2.243400      -1.743900    
 C   -5.278600       3.533800      -1.217000    
 H   -1.871900      -3.212700       2.149300    
 H  -0.5161000      -2.280400       2.735800    
 H   -1.204200     -0.3362000       1.271100    
 H   -2.552600      -1.292600      0.6546000    
 H   -1.997100      -3.855700     -0.5511000    
 H   -3.466000      -1.479300       2.959700    
 H   -2.129800     -0.4986000       3.579200    
 H    1.859700      -1.581700       1.891500    
 H   0.8741000      -4.409000      0.2497000    
 H   -4.160000      0.8675000       3.226700    
 H   -2.818100       1.380900       2.160400    
 H    2.457400     -1.5000000E-02 -0.7680000    
 H    4.230400       1.460000     -0.7430000    
 H    6.237000      0.6656000       1.438700    
 H    6.056700     -0.1762000     -0.1071000    
 H    3.750700     -1.2300000E-02   1.960100    
 H    6.642400       1.979400      -1.296800    
 H    6.853700       2.772600      0.2490000    
 H   -1.112300      1.2800000E-02  -3.365500    
 H   -2.555000     -0.3426000      -2.379000    
 H   -2.618100     -0.4989000      -4.145200    
 H    8.471800      0.3588000     -0.7247000    
 H    8.689000       1.178200      0.8404000    
 H    3.400700       2.772300      0.9031000    
 H   -4.575700       2.867500       2.024800    
 H   -4.881700      0.1599000      -1.327000    
 H    10.12720       1.911800     -0.7565000    
 H   -5.083200       4.748400      0.5509000    
 H   -5.414600       2.079200      -2.800300    
 H   -5.514600       4.374300      -1.862900    


%chk=000130920-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000130920

0 1
S -1.253825 -2.622022 -3.510000
O 0.426532 -3.789828 1.137021
O 1.232468 -0.720038 -2.346664
O -4.560639 0.554610 1.176943
O 5.104731 2.367547 1.235351
O 9.930979 1.748623 -0.470308
C -0.193085 -2.587182 0.508492
C -1.053571 -1.991959 1.649833
C -1.870485 -0.743813 1.259304
C 0.856290 -1.631635 -0.069864
C -1.011155 -2.967711 -0.718331
C -2.649894 -0.175291 2.465050
C 0.589146 -1.445900 -1.527511
C -0.593721 -2.322892 -1.855095
C 1.908187 -1.114271 0.648290
C -3.521753 1.031248 2.109556
C 2.950256 -0.241889 0.130587
C 5.073201 1.130871 0.409430
C 3.978684 0.221856 0.910321
C 6.475793 0.507349 0.545834
C 7.579966 1.411496 -0.044534
C -1.144753 -0.910589 -4.315806
C -5.489938 1.489605 0.692319
C 8.977195 0.823775 0.167132
C -5.496313 2.865198 1.036062
C -6.466754 0.970385 -0.194798
C -6.486955 3.711489 0.484247
C -7.445786 1.826586 -0.735015
C -7.463458 3.203647 -0.399732
H -1.730002 -2.794042 2.003666
H -0.370869 -1.757931 2.490739
H -1.194888 0.038770 0.857729
H -2.587526 -0.990168 0.454869
H -1.839349 -3.677902 -0.646699
H -3.296468 -0.961663 2.901111
H -1.940838 0.135991 3.259456
H 1.981651 -1.398104 1.709694
H 1.011004 -4.224195 0.462371
H -4.005651 1.453877 3.014259
H -2.920814 1.826756 1.619901
H 2.886803 0.035726 -0.929256
H 4.886426 1.393216 -0.654803
H 6.664906 0.323318 1.622518
H 6.470714 -0.477190 0.037604
H 4.038508 -0.049936 1.976233
H 7.418007 1.547282 -1.131718
H 7.529987 2.409945 0.423342
H -0.121950 -0.526605 -4.213473
H -1.872566 -0.233203 -3.845712
H -1.404820 -1.077174 -5.372432
H 9.043174 -0.187502 -0.293234
H 9.187378 0.726348 1.255252
H 4.215017 2.802088 1.185054
H -4.750479 3.281754 1.719349
H -6.437986 -0.095495 -0.441856
H 10.853705 1.415465 -0.334873
H -6.490072 4.774409 0.751731
H -8.198096 1.418889 -1.419601
H -8.226446 3.866113 -0.821532


