%chk=000145422.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145422

0 1
 S   -3.979800     -0.9287000       1.243000    
 O    2.130200      -2.121500      5.5500001E-02
 O    1.220700       2.560400      0.2578000    
 N   -2.289900     -0.5052000     -0.9162000    
 C    1.258600      -1.083500     -6.8999998E-02
 C   0.7984000       1.286200      3.2200001E-02
 C    1.691700      0.2224000      0.1607000    
 C  -0.9609000     -0.2621000     -0.5555000    
 C  -6.7599997E-02  -1.325700     -0.4271000    
 C  -0.5278000       1.043800     -0.3259000    
 C    3.471100      -1.802600      0.4242000    
 C   0.2549000       3.600100      0.1103000    
 C   -2.999600     -0.6835000      9.9999998E-03
 H    2.708800      0.4752000      0.4417000    
 H  -0.3990000      -2.345700     -0.6075000    
 H   -1.264500       1.832100     -0.4435000    
 H    4.024500      -2.746000      0.4772000    
 H    3.517700      -1.348800       1.420000    
 H    3.962300      -1.186600     -0.3366000    
 H   0.7625000       4.545600      0.3281000    
 H  -0.1126000       3.665100     -0.9195000    
 H  -0.5588000       3.500100      0.8367000    


%chk=000145422-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145422

0 1
S -5.088006 -1.242784 -0.275262
O 2.213064 -2.129657 0.147814
O 1.322970 2.641662 0.097498
N -2.324410 -0.622114 -0.119995
C 1.347909 -1.031331 0.096828
C 0.797673 1.343464 0.065874
C 1.772286 0.313717 0.122425
C -0.976867 -0.319629 -0.039854
C -0.027795 -1.362684 0.015470
C -0.579033 1.049326 -0.015062
C 3.651909 -1.856791 0.235959
C 0.374678 3.760024 0.047186
C -3.499181 -0.885685 -0.186169
H 2.823388 0.604008 0.184220
H -0.333741 -2.410988 -0.003069
H -1.344886 1.826289 -0.058956
H 4.128143 -2.847521 0.264986
H 3.896663 -1.296402 1.158448
H 4.007420 -1.296214 -0.649613
H 0.998589 4.664775 0.084780
H -0.209221 3.747543 -0.892918
H -0.310653 3.742090 0.916010


