%chk=000121714.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121714

0 1
 S   0.8824000      0.1380000     -0.2020000    
 S  -0.8391000       1.006000      0.6325000    
 O   0.7845000      0.2890000      -1.643100    
 O    1.032500      -1.177800      0.3944000    
 O    4.125000      -1.469400      -1.058100    
 O    3.982400      -1.179400       1.186000    
 O   -4.591000      -1.776000      0.4383000    
 O   -5.548000     -8.8500001E-02 -0.7376000    
 N    4.636400       1.543200      0.2710000    
 N   -3.806100       1.754700      6.4300001E-02
 C    2.234200       1.132500      0.3494000    
 C    3.558800      0.7202000     -0.2813000    
 C   -2.159800     -6.3699998E-02  2.3200000E-02
 C   -3.535700      0.3885000      0.5163000    
 C    3.896100     -0.7219000      5.3100001E-02
 C   -4.652500     -0.4954000     -6.3999998E-03
 H    2.000100       2.170800      8.9199997E-02
 H    2.262600       1.045600       1.442100    
 H    3.521900      0.8482000      -1.368500    
 H   -1.960400      -1.087000      0.3600000    
 H   -2.130300     -7.8699999E-02  -1.072700    
 H   -3.585500      0.3660000       1.611900    
 H    5.532100       1.247100     -0.1146000    
 H    4.695600       1.415700       1.280600    
 H   -3.074700       2.377100      0.4060000    
 H   -4.676800       2.085800      0.4786000    
 H    4.352900      -2.396800     -0.8339000    
 H   -5.333500      -2.318200      9.6299998E-02


%chk=000121714-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121714

0 1
S 0.503497 0.677818 -0.051287
S -1.007634 1.350247 1.807855
O 0.459416 1.722272 -1.309198
O 0.268482 -0.926582 -0.292087
O 2.916149 -0.771506 -1.969325
O 4.082206 -1.586464 -0.123030
O -5.183131 -0.566081 1.151524
O -4.364455 -1.479557 -0.823908
N 4.612158 1.139254 0.564325
N -2.575308 0.673214 -1.071202
C 2.236657 0.915759 0.800715
C 3.422589 0.788790 -0.196977
C -2.254075 0.019901 1.375748
C -3.212813 0.467660 0.211170
C 3.522873 -0.649302 -0.732797
C -4.286216 -0.617977 0.073573
H 2.184437 1.937233 1.206022
H 2.249946 0.153756 1.595836
H 3.259796 1.480148 -1.040052
H -2.812774 -0.174724 2.309913
H -1.681811 -0.885748 1.089438
H -3.716351 1.394989 0.540077
H 5.179491 1.921247 0.245973
H 5.096897 0.366899 1.024383
H -2.003419 1.504837 -1.216448
H -2.313983 -0.158130 -1.601448
H 2.873877 -1.724522 -2.255301
H -5.852401 -1.297832 1.061508


