%chk=000123630.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123630

0 1
 S   1.5699999E-02  -1.414800      0.3388000    
 O   0.9326000      -1.830100       1.382400    
 O   4.3099999E-02  -2.056400     -0.9626000    
 O   -3.904400     -0.6287000      -1.315600    
 O   -1.082400       3.098900     -0.5139000    
 O   -2.736300       2.289600      0.8299000    
 N   -2.160000     -0.2357000      0.2222000    
 N    2.520900      0.3863000     -0.5342000    
 N    3.010900     -0.8371000     -0.7669000    
 N    4.237200     -0.8664000     -0.2567000    
 C   0.1424000      0.4162000      0.1024000    
 C   -1.651900      -1.391000      0.9778000    
 C   -1.286300      0.7675000     -0.3557000    
 C   -2.767000      -2.217600      0.3265000    
 C   -3.142600     -0.9246000     -0.4233000    
 C    1.183400      0.7349000     -0.9716000    
 C   0.5484000       1.068300       1.433200    
 C   -1.799100       2.106000      6.7400001E-02
 C    3.402900       1.175800      0.1261000    
 C    4.492500      0.3587000      0.2939000    
 H   -1.715700      -1.246700       2.059900    
 H   -1.392300      0.6903000      -1.445400    
 H   -3.544100      -2.567500       1.011400    
 H   -2.447300      -3.035800     -0.3229000    
 H    1.195200       1.805800      -1.205900    
 H   0.9944000      0.2019000      -1.910600    
 H  -0.2472000      0.9548000       2.179400    
 H    1.436300      0.6169000       1.885200    
 H   0.7337000       2.141800       1.319100    
 H   -1.403300       3.986700     -0.2475000    
 H    3.201700       2.200500      0.4038000    
 H    5.432700      0.5852000      0.7732000    


%chk=000123630-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123630

0 1
S -0.107939 -1.606106 0.743244
O 0.545638 -2.052654 2.163807
O 0.147161 -2.405925 -0.667967
O -3.304228 -0.709728 -2.150211
O -1.119449 3.265799 0.037804
O -2.593678 2.225551 1.515554
N -2.268455 -0.212351 0.000700
N 2.515481 0.434200 -0.496519
N 2.965160 -0.650409 0.293096
N 4.296163 -0.491297 0.434655
C 0.131057 0.461652 0.327581
C -2.092110 -1.343383 0.895637
C -1.310997 0.890155 -0.150933
C -2.904468 -2.245685 -0.067797
C -2.933746 -1.001317 -1.007799
C 1.100949 0.526533 -0.866239
C 0.618609 1.029170 1.654796
C -1.780066 2.156532 0.578692
C 3.570000 1.253650 -0.841735
C 4.692233 0.659949 -0.251790
H -2.289264 -1.240766 1.970243
H -1.280584 1.129091 -1.231037
H -3.882612 -2.585717 0.303401
H -2.327421 -3.081783 -0.498461
H 0.957027 1.490412 -1.387046
H 0.857623 -0.298712 -1.568488
H -0.179950 1.036857 2.416426
H 1.450465 0.420730 2.048403
H 0.979647 2.066159 1.517280
H -1.399193 4.096214 0.510230
H 3.458820 2.144269 -1.453348
H 5.732228 0.972612 -0.272378


