%chk=000003082.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003082

0 1
 S   2.1500001E-02  0.1939000     -0.9200000    
 S    3.414800     -0.4721000      -1.567200    
 P    2.012000     -0.1260000     -0.2398000    
 O    2.384700       1.126200      0.7438000    
 O    1.944200      -1.296300      0.9002000    
 O   -2.901800       1.586100      4.8599999E-02
 N   -3.129000     -0.7256000     -3.0900000E-02
 C  -0.9944000      0.2305000      0.5706000    
 C   -2.435200      0.4553000      0.1762000    
 C    2.560500       2.428500      0.2113000    
 C    1.639800      -2.633200      0.5382000    
 C   -4.517100     -0.7672000     -0.4311000    
 H  -0.8855000     -0.7079000       1.122100    
 H  -0.6718000       1.047300       1.223100    
 H   -2.641900      -1.611800      6.4900003E-02
 H    2.456400       3.152700       1.023100    
 H    1.810100       2.645000     -0.5526000    
 H    3.562200       2.519700     -0.2158000    
 H   0.8662000      -2.666100     -0.2326000    
 H    1.276800      -3.158900       1.424900    
 H    2.543500      -3.131200      0.1784000    
 H   -4.557300     -0.9857000      -1.501000    
 H   -5.012200      0.1859000     -0.2306000    
 H   -5.010800      -1.568700      0.1234000    


%chk=000003082-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003082

0 1
S 0.012171 -1.206422 -1.010739
S 3.450000 -0.223913 -1.711049
P 2.033553 -0.399583 -0.223867
O 1.632119 0.952036 0.769141
O 2.375017 -1.412636 1.145609
O -1.906924 1.469704 -0.096835
N -3.415243 -0.307023 -0.109354
C -1.078096 -0.764007 0.493307
C -2.156018 0.237010 0.074294
C 1.317582 2.251606 0.107865
C 2.964276 -2.738711 0.862640
C -4.566129 0.502151 -0.529659
H -1.476886 -1.709032 0.895945
H -0.418041 -0.289320 1.237436
H -3.544937 -1.309589 0.033655
H 1.481183 2.997791 0.899501
H 0.262392 2.248852 -0.213878
H 2.006047 2.434002 -0.737283
H 2.253914 -3.372912 0.299964
H 3.155232 -3.169617 1.856289
H 3.909108 -2.635739 0.299129
H -4.966709 0.151382 -1.498431
H -4.215621 1.540218 -0.642389
H -5.372291 0.474151 0.225908


