%chk=000090167.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090167

0 1
 S    5.249700     -0.5128000      2.5300000E-02
 N   -2.518800     -0.3594000     -6.9999998E-04
 C  -6.8200000E-02 -0.3449000     -2.8300000E-02
 C    1.182900      0.5384000     -1.6300000E-02
 C   -1.340900      0.4998000      2.4000001E-03
 C    2.458700     -0.3098000     -1.1400000E-02
 C    3.748600      0.5107000      4.0000002E-03
 C   -3.740100      0.4335000      1.8400000E-02
 C   -4.972000     -0.4556000      6.6000000E-03
 H  -6.1900001E-02 -0.9764000     -0.9257000    
 H  -4.7800001E-02  -1.016300      0.8395000    
 H    1.172200       1.183900      0.8700000    
 H    1.182100       1.193900     -0.8955000    
 H   -1.354600       1.158700     -0.8742000    
 H   -1.336100       1.132200      0.8987000    
 H    2.439600     -0.9688000      0.8663000    
 H    2.453900     -0.9592000     -0.8963000    
 H   -2.496800     -0.9798000      0.8080000    
 H    3.769200       1.158400      0.8867000    
 H    3.791600       1.156500     -0.8792000    
 H   -3.771100       1.067000      0.9127000    
 H   -3.777500       1.090300     -0.8587000    
 H   -4.995600      -1.086300     -0.8885000    
 H   -4.998400      -1.107500      0.8862000    
 H   -5.880100      0.1559000      1.2600000E-02
 H    6.125700      0.5026000      3.5399999E-02


%chk=000090167-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090167

0 1
S 5.299184 -0.612442 -0.047496
N -2.555378 -0.294498 0.005916
C -0.064593 -0.300776 -0.006386
C 1.225663 0.549529 0.014675
C -1.345828 0.555391 0.022323
C 2.507311 -0.316919 -0.019368
C 3.783071 0.540360 0.004342
C -3.835591 0.447017 0.006703
C -5.031957 -0.519855 0.010544
H -0.087097 -0.938783 -0.910780
H -0.062344 -0.987996 0.866583
H 1.234468 1.187126 0.923272
H 1.223675 1.239887 -0.854354
H -1.373949 1.203808 -0.876929
H -1.309606 1.243586 0.907698
H 2.510901 -1.006244 0.848217
H 2.502460 -0.947079 -0.930625
H -2.530363 -0.993065 0.763693
H 3.835648 1.142333 0.927589
H 3.824544 1.209052 -0.872307
H -3.923643 1.153163 0.872657
H -3.866293 1.070583 -0.908989
H -4.982841 -1.192787 -0.863338
H -5.037167 -1.145180 0.924415
H -5.987141 0.034699 -0.021906
H 6.261166 0.384089 0.011850


