%chk=000013523.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013523

0 1
 S  -0.2246000      0.1591000      -1.312700    
 S    3.240300     -0.2200000      -1.790200    
 P    1.741700     -6.9700003E-02 -0.5327000    
 O    1.963700       1.130700      0.5554000    
 O    1.695200      -1.321500      0.5183000    
 O   -3.544400      3.9000001E-02  0.8256000    
 O   -3.187700      0.3514000      -1.429300    
 C    2.073000       2.477300      0.1250000    
 C    1.511800      -2.646600      4.7600001E-02
 C   -1.324400      1.6600000E-02  0.1104000    
 C    2.271700       3.366700       1.333700    
 C    1.509400      -3.593500       1.228700    
 C   -2.769500      0.1605000     -0.2959000    
 C   -4.956100      0.1499000      0.6162000    
 H    2.925300       2.583700     -0.5518000    
 H    1.162100       2.767100     -0.4065000    
 H   0.5627000      -2.717600     -0.4910000    
 H    2.323800      -2.915100     -0.6338000    
 H   -1.182100     -0.9647000      0.5710000    
 H   -1.074600      0.8040000      0.8268000    
 H    2.359100       4.415600       1.037200    
 H    1.431800       3.264800       2.028900    
 H    3.174800       3.077400       1.881100    
 H    1.369900      -4.627400      0.9008000    
 H    2.451400      -3.522100       1.782300    
 H   0.7083000      -3.333700       1.928700    
 H   -5.202100       1.135400      0.2092000    
 H   -5.453200      3.5500001E-02   1.583100    
 H   -5.302900     -0.6431000     -5.3100001E-02


%chk=000013523-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000013523

0 1
S -0.520240 -0.742783 -1.553977
S 2.981781 0.203825 -1.944435
P 1.529266 -0.294416 -0.570874
O 1.144389 0.782521 0.727323
O 1.779336 -1.641614 0.490364
O -2.414695 1.274486 0.368921
O -3.921389 -0.373501 -0.300204
C 0.856720 2.208211 0.373508
C 2.304114 -2.901993 -0.117366
C -1.549912 -0.945240 0.048581
C 0.543010 2.903688 1.693138
C 2.450847 -3.889266 1.035807
C -2.758123 -0.032204 0.008907
C -3.526921 2.257868 0.321017
H 1.747166 2.634437 -0.125977
H -0.009233 2.231758 -0.314346
H 1.583965 -3.259097 -0.879398
H 3.273319 -2.687777 -0.606076
H -1.874763 -1.992719 0.098289
H -0.887676 -0.689939 0.890978
H 0.343829 3.975900 1.508426
H -0.349379 2.454674 2.160118
H 1.392323 2.822666 2.392197
H 2.844249 -4.849498 0.654104
H 3.150955 -3.500495 1.793986
H 1.477686 -4.077557 1.519764
H -3.924636 2.330671 -0.704921
H -3.075479 3.207076 0.641369
H -4.336111 1.950018 1.003775


