%chk=000085004.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085004

0 1
 S    3.119500       1.023200      0.1195000    
 S    3.114400      -1.027800      0.1309000    
 N  -0.7389000      5.1000002E-03 -0.2525000    
 C   0.6364000      4.3000001E-03  0.2236000    
 C   -1.490600      -1.161300      0.2099000    
 C   -1.495900       1.160000      0.2295000    
 C   -2.935000     -0.7644000     -5.6800000E-02
 C   -2.937900      0.7612000     -4.7499999E-02
 C    1.367100       1.247400     -0.2852000    
 C    1.360900      -1.247800     -0.2715000    
 H   0.6448000      9.3000000E-03   1.325100    
 H   -1.349700      -1.341600       1.283400    
 H   -1.240800      -2.075600     -0.3375000    
 H   -1.248100       2.084900     -0.3006000    
 H   -1.357800       1.321400       1.306400    
 H   -3.610300      -1.175200      0.7005000    
 H   -3.266000      -1.129400      -1.036100    
 H   -3.265900       1.136700      -1.024000    
 H   -3.618100       1.160600      0.7115000    
 H    1.271700       1.363600      -1.370800    
 H    1.017500       2.167600      0.1920000    
 H    1.008400      -2.161400      0.2162000    
 H    1.265200      -1.375600      -1.355800    


%chk=000085004-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085004

0 1
S 3.232436 1.167185 0.161757
S 3.232930 -1.167408 0.156345
N -0.744052 -0.000095 -0.214592
C 0.669047 -0.000639 0.234668
C -1.537967 -1.182719 0.237070
C -1.538893 1.180175 0.241465
C -3.005190 -0.784043 -0.058477
C -3.005106 0.781932 -0.058520
C 1.402690 1.250084 -0.306033
C 1.402869 -1.249099 -0.310774
H 0.753051 -0.002802 1.352654
H -1.396827 -1.368871 1.332800
H -1.232967 -2.093621 -0.305567
H -1.233645 2.093753 -0.296488
H -1.399620 1.361316 1.338297
H -3.691032 -1.204767 0.696916
H -3.316711 -1.167031 -1.044734
H -3.312791 1.164771 -1.046043
H -3.693527 1.203020 0.694314
H 1.302433 1.301865 -1.401898
H 1.030480 2.176503 0.160857
H 1.031099 -2.177291 0.152954
H 1.302193 -1.297016 -1.406770


