%chk=000121804.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121804

0 1
 S   0.8877000       2.378000      0.1994000    
 O   -3.953000     -0.9413000     -0.1043000    
 O   -2.365100     -0.3848000       1.422100    
 N  -0.6377000       1.937500     -0.2711000    
 C   0.5816000     -8.8399999E-02 -0.2860000    
 C  -0.6432000      0.6264000     -0.4876000    
 C    1.576700      0.8034000      0.1203000    
 C   -1.920200      1.6100001E-02 -0.9216000    
 C   0.9175000      -1.453300     -0.4230000    
 C    2.889000      0.3873000      0.3938000    
 C    2.222200      -1.878500     -0.1526000    
 C    3.193300     -0.9684000      0.2505000    
 C   -2.748800     -0.4341000      0.2603000    
 H   -1.738300     -0.8515000      -1.564800    
 H   -2.512300      0.7398000      -1.494800    
 H   0.1732000      -2.181100     -0.7347000    
 H    3.650700       1.093700      0.7085000    
 H    2.477200      -2.929500     -0.2584000    
 H    4.202600      -1.314800      0.4569000    
 H   -4.471200      -1.246700      0.6706000    


%chk=000121804-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121804

0 1
S 1.124331 2.600745 -0.009823
O -3.810344 -1.223254 -0.235108
O -2.244321 -0.748591 1.415452
N -0.575782 2.106777 -0.444333
C 0.578455 0.012542 -0.259909
C -0.641742 0.768718 -0.517703
C 1.675467 0.877633 0.041677
C -1.976147 0.167867 -0.888674
C 0.786235 -1.392198 -0.281790
C 2.962918 0.373475 0.322908
C 2.066846 -1.901725 -0.006115
C 3.147149 -1.024562 0.295018
C -2.631297 -0.623322 0.237555
H -1.887175 -0.497281 -1.768443
H -2.669541 0.977976 -1.176980
H -0.044801 -2.071009 -0.501397
H 3.798003 1.041055 0.556263
H 2.237951 -2.983120 -0.017453
H 4.137364 -1.440720 0.510000
H -4.251670 -1.711207 0.512354


