%chk=000001982.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001982

0 1
 S   -2.204100      0.7350000       1.082500    
 P  -0.6070000      0.2663000     -0.2061000    
 O  -0.6617000      -1.311000     -0.6000000    
 O  -0.6876000       1.133300      -1.437500    
 O    2.277300     -0.1844000      -1.078800    
 N   0.8725000      0.4770000      0.6445000    
 C    2.103200      0.2210000      6.7100003E-02
 C    3.246000      0.4783000       1.010100    
 C   -3.698500      0.4846000      0.1040000    
 C  -0.6399000      -2.300100      0.4144000    
 H   0.8407000      0.8003000       1.607600    
 H    3.151100       1.472200       1.456500    
 H    4.192400      0.4275000      0.4646000    
 H    3.245400     -0.2779000       1.799700    
 H   -4.579800      0.6980000      0.7137000    
 H   -3.747400     -0.5506000     -0.2426000    
 H   -3.694400       1.151700     -0.7615000    
 H   -1.606300      -2.331800      0.9232000    
 H   0.1554000      -2.100000       1.136300    
 H  -0.4561000      -3.271500     -5.1500000E-02


%chk=000001982-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001982

0 1
S -2.278997 0.143812 1.313622
P -0.756820 -0.049712 -0.427083
O -0.614346 -1.701733 -0.877578
O -1.105592 0.867614 -1.676048
O 2.355503 -0.746097 -0.651042
N 0.674260 0.349173 0.555303
C 2.023205 0.040028 0.271353
C 3.017931 0.751751 1.185439
C -3.670023 0.936500 0.299074
C -0.235203 -2.716135 0.129101
H 0.479374 0.998942 1.325251
H 3.106930 1.813117 0.889272
H 4.003411 0.275672 1.076600
H 2.709287 0.714616 2.245320
H -4.068154 1.769623 0.896423
H -4.445519 0.184846 0.099244
H -3.243155 1.316027 -0.645313
H -0.890646 -2.653953 1.018491
H 0.826776 -2.599487 0.403160
H -0.387021 -3.676703 -0.384388


