%chk=000170606.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170606

0 1
 S    2.482800     -0.2107000      -1.470200    
 P    1.006900     -5.9000000E-02 -0.2021000    
 O    1.160900       1.154500      0.8750000    
 O   0.8643000      -1.317200      0.8241000    
 O   -1.772700     -4.7300000E-02   1.107500    
 N  -0.5696000      0.1435000     -0.8693000    
 C   -1.726100      0.1077000     -0.1098000    
 C   -2.965900      0.3116000     -0.9368000    
 C    1.064800       2.501800      0.4432000    
 C   0.4547000      -2.584900      0.3383000    
 H  -0.6507000      0.2940000      -1.871300    
 H   -3.848800      5.1600002E-02 -0.3465000    
 H   -2.939500     -0.3260000      -1.825100    
 H   -3.031600       1.359500      -1.241800    
 H    1.855400       2.726700     -0.2765000    
 H    1.182900       3.154200       1.312100    
 H   8.6499996E-02   2.688000     -6.5000001E-03
 H    1.235500      -3.010600     -0.2967000    
 H  -0.4781000      -2.506400     -0.2243000    
 H   0.2954000      -3.248300       1.192100    


%chk=000170606-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170606

0 1
S 1.780663 -0.057553 -2.246553
P 0.512949 0.215661 -0.630829
O 0.475756 1.722977 0.188943
O 0.768726 -0.837058 0.722813
O -2.264303 0.211809 0.952953
N -1.167849 0.090723 -1.120692
C -2.320469 0.149436 -0.296926
C -3.623679 0.144080 -1.095230
C 1.694948 2.150580 0.915814
C 1.197874 -2.229233 0.465723
H -1.298742 0.032622 -2.135666
H -4.451113 -0.117606 -0.419356
H -3.598904 -0.570601 -1.936907
H -3.814172 1.153399 -1.504586
H 1.897760 1.464178 1.754598
H 1.450654 3.155518 1.289035
H 2.561411 2.196840 0.230199
H 2.035921 -2.257829 -0.254808
H 0.351198 -2.830180 0.088358
H 1.518472 -2.605061 1.448517


