%chk=000081281.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081281

0 1
 S   -3.542400      -2.062900     -0.1231000    
 S    4.273400     -0.9850000     -4.5000002E-02
 O   -1.520300       2.548400      0.4466000    
 O    1.067600       2.905900      0.4725000    
 O   -3.869500      -2.523800       1.411000    
 O    4.659500     -0.9461000      -1.633200    
 O   -4.677700      -1.275400     -0.5811000    
 O   -3.106700      -3.236500     -0.8640000    
 O    5.170800     -6.0500000E-02  0.6326000    
 O    4.194600      -2.378000      0.3665000    
 C   5.4200001E-02  0.7127000      0.2020000    
 C   0.2480000     -0.6778000      2.4200000E-02
 C   -1.253300       1.219900      0.2760000    
 C   -2.163400     -0.9992000      1.8000000E-03
 C  -0.8715000      -1.520100     -7.4299999E-02
 C    1.555400      -1.185200     -5.0299998E-02
 C    1.173800       1.555000      0.3004000    
 C    2.656100     -0.3338000      4.9800001E-02
 C   -2.353900      0.3684000      0.1763000    
 C    2.465800       1.033600      0.2249000    
 C   -2.277700       3.190200     -0.5752000    
 C   -1.882900       4.650200     -0.6384000    
 H  -0.7210000      -2.590100     -0.2027000    
 H    1.702700      -2.253500     -0.1958000    
 H   -3.359300      0.7733000      0.2565000    
 H    3.321300       1.700600      0.2955000    
 H   -2.096100       2.725900      -1.552700    
 H   -3.343600       3.107900     -0.3365000    
 H    1.954100       3.303000      0.5149000    
 H   -2.463800       5.179500      -1.399000    
 H   -2.042800       5.135900      0.3299000    
 H  -0.8186000       4.752700     -0.8741000    
 H   -4.114300      -1.794800       2.028400    
 H    4.678200     -4.8900001E-02  -2.042000    


%chk=000081281-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081281

0 1
S -3.542025 -1.959965 -0.251970
S 4.457350 -1.122446 0.234537
O -1.264843 2.767759 -0.210555
O 1.302027 3.035013 -0.006138
O -3.801715 -2.049013 1.585249
O 4.744681 -1.234210 -1.596824
O -4.777873 -1.145929 -0.907241
O -3.142078 -3.431132 -0.790393
O 5.487097 -0.037664 0.852810
O 4.366475 -2.619002 0.839056
C 0.207121 0.845971 -0.065426
C 0.358842 -0.601288 -0.034003
C -1.136411 1.391886 -0.163038
C -2.029852 -0.856302 -0.165453
C -0.789014 -1.457863 -0.081809
C 1.656309 -1.203755 0.045749
C 1.410126 1.646998 0.003683
C 2.752428 -0.362876 0.100898
C -2.252567 0.534618 -0.207186
C 2.677051 1.043980 0.082882
C -2.628541 3.349799 -0.311900
C -2.450745 4.863466 -0.340815
H -0.676943 -2.545789 -0.067876
H 1.765947 -2.291651 0.076922
H -3.273749 0.911400 -0.295139
H 3.594604 1.639927 0.152743
H -3.112224 2.977119 -1.237005
H -3.225092 3.025254 0.564219
H 2.200247 3.452122 0.048550
H -3.438162 5.353908 -0.414073
H -1.950784 5.215055 0.577012
H -1.841638 5.168589 -1.207948
H -4.587397 -2.647794 1.751277
H 5.638048 -1.664686 -1.738394


