%chk=000146816.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146816

0 1
 S   -3.970000       2.666400      0.3677000    
 O   -2.105400     -0.1003000     -0.2924000    
 O   -3.419800      -1.652300      0.7943000    
 N   -5.501000     -0.8970000     -0.8318000    
 C    2.799200      0.2517000     -0.1846000    
 C    4.131100     -0.3273000      0.3010000    
 C    1.581100     -0.5473000      0.2841000    
 C    5.352400      0.4279000     -0.2278000    
 C   0.2835000      5.9799999E-02 -0.2472000    
 C    6.653100     -0.2351000      0.2283000    
 C  -0.9374000     -0.7033000      0.2470000    
 C    7.870600      0.4879000     -0.3251000    
 C   -4.450300      8.7600000E-02 -0.5625000    
 C   -3.296500     -0.6777000      6.2899999E-02
 C   -4.990600       1.158800      0.3860000    
 H    2.711600       1.288200      0.1639000    
 H    2.804300      0.2862000      -1.281300    
 H    4.147100     -0.3228000       1.397900    
 H    4.195200      -1.377100     -1.1600000E-02
 H    1.559400     -0.5675000       1.380400    
 H    1.668900      -1.585600     -5.7399999E-02
 H    5.319000      0.4537000      -1.323700    
 H    5.321500       1.466800      0.1215000    
 H   0.2892000      6.7199998E-02  -1.344300    
 H   0.2013000       1.110100      5.9200000E-02
 H    6.676000      -1.279600     -0.1037000    
 H    6.703200     -0.2412000       1.323400    
 H  -0.9821000     -0.6705000       1.341900    
 H  -0.8833000      -1.748600     -7.8900002E-02
 H    7.867100      0.4813000      -1.419700    
 H    8.788800     -1.4000000E-03  1.4500000E-02
 H    7.895400       1.528900      1.2400000E-02
 H   -4.139900      0.5077000      -1.526400    
 H   -5.999700       1.467100      9.0800002E-02
 H   -5.042900      0.7921000       1.417200    
 H   -6.302300     -0.4343000      -1.259800    
 H   -5.167500      -1.574100      -1.517400    
 H   -4.704000       3.357200       1.252200    


%chk=000146816-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146816

0 1
S -4.270080 2.432507 1.202113
O -2.141595 0.024859 -0.355187
O -3.524065 -1.326320 0.954020
N -5.432751 -0.671654 -1.291514
C 2.863950 0.202305 -0.327995
C 4.184267 -0.340556 0.263386
C 1.606930 -0.457427 0.282633
C 5.442852 0.316283 -0.347171
C 0.292161 0.091148 -0.320332
C 6.764027 -0.228775 0.242011
C -0.934744 -0.578133 0.296838
C 8.016555 0.432196 -0.373166
C -4.538912 0.291388 -0.622456
C -3.375329 -0.420017 0.098476
C -5.369251 1.100119 0.396370
H 2.815059 1.299798 -0.170191
H 2.862666 0.045746 -1.426883
H 4.186138 -0.183380 1.362418
H 4.231979 -1.438739 0.106743
H 1.607926 -0.297599 1.380899
H 1.658845 -1.555311 0.126772
H 5.442098 0.161134 -1.446572
H 5.398457 1.414326 -0.188980
H 0.284800 -0.072002 -1.415438
H 0.229194 1.183842 -0.156438
H 6.807500 -1.325858 0.083862
H 6.763981 -0.073365 1.340326
H -1.008692 -0.400831 1.385506
H -0.953209 -1.669940 0.120916
H 8.055364 0.266413 -1.466495
H 8.946900 0.024708 0.063621
H 8.012686 1.525201 -0.200769
H -4.118861 0.973043 -1.381163
H -6.206533 1.580607 -0.130204
H -5.743142 0.429688 1.188373
H -5.105724 -0.987530 -2.209026
H -5.711691 -1.450979 -0.684506
H -5.113455 2.686703 2.270202


