%chk=000128206.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128206

0 1
 S    3.997400     -0.9935000      0.2203000    
 O    2.727300       1.027100      -1.972200    
 O    5.319900     -0.3884000     -0.5315000    
 O    3.451500      -2.029100     -0.6516000    
 O    4.402600      -1.345800       1.577400    
 O   -1.253500       2.071400       1.429900    
 N    2.921200      0.3011000      0.2818000    
 N  -9.6900001E-02   1.418800     -0.4693000    
 N   -3.529600       2.390300     -0.1026000    
 C    1.710100      0.5060000       1.105000    
 C    1.252100       1.583500      9.8899998E-02
 C    2.385800       1.015500     -0.8124000    
 C   0.9112000     -0.7843000       1.198200    
 C   -1.248700       1.683100      0.2628000    
 C   -2.521500       1.417400     -0.5336000    
 C   -2.984600     -1.2900000E-02 -0.3502000    
 C   -2.525300     -0.9869000      -1.218700    
 C   -3.855800     -0.3128000      0.6820000    
 C   -2.951500      -2.304400      -1.049900    
 C   -4.281900      -1.630200      0.8508000    
 C   -3.829700      -2.626000     -1.5200000E-02
 H    1.954300      0.9083000       2.094900    
 H    1.445000       2.617100      0.4081000    
 H   0.7059000      -1.223300      0.2158000    
 H  -4.8799999E-02 -0.6057000       1.693300    
 H    1.442500      -1.530300       1.798800    
 H  -0.1995000       1.097100      -1.428800    
 H   -2.333100       1.605600      -1.598200    
 H    5.717600      0.4067000     -0.1051000    
 H   -4.368900       2.285000     -0.6723000    
 H   -3.189300       3.334600     -0.2825000    
 H   -1.841100     -0.7473000      -2.027300    
 H   -4.210900      0.4356000       1.383700    
 H   -2.598800      -3.079800      -1.723600    
 H   -4.962200      -1.882000       1.659100    
 H   -4.160500      -3.651900      0.1173000    


%chk=000128206-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128206

0 1
S 4.166923 -1.035491 0.571599
O 2.296126 0.225998 -2.203635
O 5.322111 0.208497 -0.152486
O 4.315916 -2.395477 -0.273989
O 4.283226 -1.035508 2.176852
O -0.995145 3.029986 0.411617
N 2.656999 -0.115763 0.196933
N -0.339840 0.955578 -0.398188
N -3.636820 2.349065 0.305079
C 1.724988 0.573768 1.176847
C 1.056261 1.198861 -0.126548
C 2.074226 0.391135 -1.001218
C 0.879424 -0.352175 2.042029
C -1.292468 1.922447 -0.127421
C -2.746760 1.599939 -0.582548
C -3.051395 0.096797 -0.593240
C -2.871840 -0.664082 -1.776699
C -3.489580 -0.553183 0.587763
C -3.109921 -2.058935 -1.777464
C -3.728819 -1.944536 0.587197
C -3.535265 -2.703170 -0.593087
H 2.263599 1.323376 1.779297
H 1.246897 2.285088 -0.174480
H 0.361800 -1.119236 1.440444
H 0.116801 0.241217 2.577225
H 1.512103 -0.857676 2.791473
H -0.648528 0.052787 -0.769362
H -2.776435 1.950423 -1.647306
H 6.104403 -0.295595 -0.524178
H -4.599103 2.437934 -0.025892
H -3.219448 3.220793 0.647851
H -2.564447 -0.164132 -2.704933
H -3.656244 0.058779 1.480635
H -2.972445 -2.635847 -2.698601
H -4.070287 -2.439777 1.503321
H -3.724713 -3.782284 -0.591785


