%chk=000090891.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090891

0 1
 S    2.655200      -2.560200      0.1619000    
 S    5.643100      -2.320300     -9.1600001E-02
 O   -2.531500      -1.259800      0.1874000    
 O    1.905200       1.084900     -0.6821000    
 O    4.723800      0.9905000       1.593100    
 O    6.141600       2.289700      0.3889000    
 N   -2.769300      0.9669000     -0.3421000    
 N    3.774400     -0.3240000     -0.4636000    
 C   -4.028400      0.4266000     -0.1272000    
 C   -1.856700     -6.1299998E-02 -0.1510000    
 C   -2.562700       2.348700     -0.6970000    
 C   -3.875100     -0.9297000      0.1951000    
 C   -5.289400      0.9829000     -0.1807000    
 C  -0.5221000     -5.2499998E-02 -0.2425000    
 C   -4.932600      -1.766900      0.4696000    
 C   -2.429900       3.219500      0.5408000    
 C   0.2962000      -1.218500     -1.1500000E-02
 C    1.630800      -1.210300     -0.1027000    
 C   -6.385200      0.1551000      9.4200000E-02
 C   -6.208300      -1.205100      0.4158000    
 C    2.416300     -3.0000000E-03 -0.4512000    
 C    4.789900      0.6769000     -0.7799000    
 C    4.120100      -1.636200     -0.1621000    
 C    5.294700       1.406100      0.4385000    
 H   -1.653300       2.451600      -1.301000    
 H   -3.375100       2.723700      -1.330900    
 H   -5.448400       2.027500     -0.4230000    
 H  -0.1129000      0.9080000     -0.5000000    
 H   -4.787400      -2.811500      0.7160000    
 H   -3.336500       3.181100       1.153500    
 H   -1.590700       2.893000       1.164200    
 H   -2.256500       4.261700      0.2553000    
 H  -0.2072000      -2.146400      0.2500000    
 H   -7.390400      0.5679000      5.9999999E-02
 H   -7.078300      -1.822100      0.6244000    
 H    4.336600       1.426200      -1.438000    
 H    5.638800      0.2226000      -1.296700    
 H    5.069000       1.479300       2.370300    


%chk=000090891-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090891

0 1
S 2.713356 -2.534591 0.184967
S 5.792585 -2.159275 -0.043752
O -2.662529 -1.276448 0.189283
O 2.053600 1.266106 -0.740469
O 4.961971 1.018661 1.694509
O 6.726596 1.860954 0.434882
N -2.934718 0.912374 -0.394687
N 3.850350 -0.246512 -0.442121
C -4.224420 0.393139 -0.144393
C -1.982081 -0.086830 -0.176330
C -2.615117 2.305766 -0.757001
C -4.051748 -0.968305 0.207862
C -5.509796 0.960781 -0.197068
C -0.602596 -0.007228 -0.278151
C -5.109038 -1.822728 0.515043
C -2.286970 3.181946 0.470207
C 0.256875 -1.121733 -0.044361
C 1.643265 -1.077610 -0.126635
C -6.601306 0.108234 0.111404
C -6.409834 -1.252165 0.459469
C 2.451374 0.091127 -0.457859
C 4.843128 0.789633 -0.720818
C 4.220885 -1.550862 -0.129410
C 5.633010 1.263949 0.497909
H -1.764093 2.290639 -1.460741
H -3.482277 2.711259 -1.307503
H -5.672308 2.010139 -0.459598
H -0.144966 0.949750 -0.542684
H -4.943163 -2.869027 0.782721
H -3.137033 3.218197 1.173597
H -1.405200 2.793964 1.008001
H -2.061728 4.212737 0.144243
H -0.217680 -2.075806 0.220779
H -7.617215 0.515104 0.081215
H -7.276987 -1.877691 0.692310
H 4.284858 1.654627 -1.128598
H 5.573184 0.436328 -1.466777
H 5.515563 1.343998 2.454756


