%chk=000089520.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089520

0 1
 S   -2.828200       1.968900     -0.3845000    
 S   0.2630000       2.689500     -0.1847000    
 S    5.499000      -1.056700     -0.1785000    
 S    3.197700       3.319600      1.4300000E-02
 O   0.6063000      -1.011700      0.6777000    
 O    5.805100      -1.615300      -1.680000    
 O    5.277500      -2.187300      0.7042000    
 O    6.466200     -2.2500001E-02  0.1403000    
 N   -2.151200     -0.5423000      0.2519000    
 N    1.988000      0.8733000      0.4231000    
 C   -1.612100      0.7268000      3.3399999E-02
 C   -3.550400     -0.5517000      9.2299998E-02
 C  -0.3258000       1.104100      0.1005000    
 C    3.253500      0.2083000      0.7221000    
 C   -1.452700      -1.762300      0.6079000    
 C   -4.093200      0.7072000     -0.2505000    
 C   0.7793000      0.1757000      0.4362000    
 C    3.946300     -0.2931000     -0.5304000    
 C    1.936800       2.227400      0.1137000    
 C   -4.408700      -1.637900      0.2349000    
 C   -5.454100      0.8941000     -0.4488000    
 C   -1.059900      -2.551200     -0.6297000    
 C   -5.782100      -1.459500      3.6800001E-02
 C   -6.300500     -0.2033000     -0.3022000    
 H    3.043300     -0.6412000       1.383300    
 H    3.909000      0.8793000       1.286800    
 H  -0.8782000      -1.735800       1.541300    
 H   -2.188800      -2.442900       1.058900    
 H    4.134800      0.5155000      -1.242900    
 H    3.319200      -1.041500      -1.027800    
 H   -4.070000      -2.637900      0.4788000    
 H   -5.860100       1.865400     -0.7118000    
 H   -1.940800      -2.844900      -1.211500    
 H  -0.4089000      -1.983700      -1.302600    
 H  -0.5358000      -3.468300     -0.3415000    
 H   -6.455400      -2.306100      0.1434000    
 H   -7.370100     -8.5299999E-02 -0.4528000    
 H    5.246400      -2.373300      -1.973000    


%chk=000089520-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089520

0 1
S -2.841636 1.870823 -0.358672
S 0.243359 2.391146 -0.892057
S 5.745687 -1.086150 0.260142
S 3.256623 3.121384 -0.884130
O 0.928845 -0.973441 1.114078
O 6.568565 -0.997250 -1.410551
O 5.614712 -2.634249 0.711573
O 6.422693 -0.020961 1.272754
N -2.323224 -0.678627 0.213739
N 2.077305 0.866826 0.196141
C -1.648062 0.506297 -0.047819
C -3.741691 -0.574879 0.227667
C -0.279444 0.797573 -0.111124
C 3.359043 0.349803 0.709615
C -1.679716 -2.027199 0.210657
C -4.219887 0.726669 -0.073089
C 0.869091 0.110496 0.444865
C 4.077265 -0.408984 -0.417737
C 1.992844 2.079204 -0.479147
C -4.663776 -1.616494 0.480629
C -5.591196 1.023012 -0.128156
C -1.675730 -2.648549 -1.199862
C -6.044008 -1.324874 0.432972
C -6.509320 -0.020933 0.132716
H 3.118921 -0.319597 1.552781
H 3.971752 1.200738 1.051904
H -0.657814 -1.921104 0.608107
H -2.239499 -2.656368 0.923466
H 4.381130 0.245166 -1.248450
H 3.553611 -1.315452 -0.755440
H -4.326119 -2.630276 0.710856
H -5.942735 2.032082 -0.362683
H -2.696423 -2.765397 -1.605555
H -1.090477 -2.029312 -1.901973
H -1.205127 -3.646861 -1.156186
H -6.764409 -2.124863 0.631563
H -7.583846 0.183685 0.100729
H 7.487094 -1.383685 -1.325721


