%chk=000082330.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082330

0 1
 S   -4.511600       1.416500       1.115000    
 C   -1.741400      0.1935000     -0.1571000    
 C   -2.964300     -0.6881000      0.1415000    
 C  -0.4392000     -0.5755000      9.1300003E-02
 C   -4.349600     -1.6899999E-02 -2.6799999E-02
 C   0.8194000      0.2566000     -0.1716000    
 C    2.119300     -0.4873000      0.1469000    
 C    3.341000      0.3877000     -0.1470000    
 C    4.671700     -0.2927000      0.1866000    
 C   -4.582200      0.4779000      -1.459700    
 C   -5.445000      -1.028200      0.3472000    
 C    5.894000      0.5521000     -0.1749000    
 C    7.188000     -0.1957000      0.1087000    
 H   -1.763200      0.5290000      -1.199600    
 H   -1.738300       1.086400      0.4755000    
 H   -2.919700      -1.567700     -0.5156000    
 H   -2.873700      -1.077000       1.165400    
 H  -0.4221000     -0.9262000       1.130800    
 H  -0.4167000      -1.469000     -0.5449000    
 H   0.8266000      0.5691000      -1.223200    
 H   0.7742000       1.172900      0.4303000    
 H    2.173300      -1.406700     -0.4481000    
 H    2.123800     -0.7829000       1.202700    
 H    3.266600       1.321700      0.4239000    
 H    3.336200      0.6648000      -1.208600    
 H    4.696500     -0.5299000       1.257400    
 H    4.724500      -1.248400     -0.3498000    
 H   -3.876800       1.264000      -1.750100    
 H   -5.594800      0.8787000      -1.589300    
 H   -4.466900     -0.3448000      -2.175000    
 H   -5.405600      -1.902600     -0.3133000    
 H   -6.448700     -0.5969000      0.2518000    
 H   -5.329300      -1.392500       1.374800    
 H    5.880300       1.487200      0.3967000    
 H    5.859700      0.8198000      -1.237300    
 H   -3.682300       2.244300      0.4629000    
 H    8.049700      0.4261000     -0.1537000    
 H    7.266500     -0.4554000       1.169200    
 H    7.244600      -1.118800     -0.4769000    


%chk=000082330-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000082330

0 1
S -4.746173 1.425848 1.126550
C -1.775477 0.214541 -0.109169
C -3.005369 -0.668369 0.192425
C -0.447133 -0.520316 0.187573
C -4.406610 -0.058188 -0.078938
C 0.805942 0.330071 -0.118354
C 2.130349 -0.415605 0.161345
C 3.388017 0.426825 -0.149415
C 4.710391 -0.326408 0.119593
C -4.578694 0.426681 -1.533348
C -5.503131 -1.084409 0.287191
C 5.970019 0.513091 -0.193450
C 7.285323 -0.251478 0.070860
H -1.779951 0.530000 -1.171936
H -1.819053 1.138215 0.503198
H -2.932790 -1.595062 -0.419297
H -2.969326 -0.985740 1.253221
H -0.430280 -0.828806 1.253707
H -0.406538 -1.456872 -0.407705
H 0.783072 0.647714 -1.182089
H 0.774796 1.261476 0.484879
H 2.157779 -1.348739 -0.439803
H 2.154825 -0.731663 1.225376
H 3.366106 1.356583 0.457040
H 3.360242 0.748723 -1.211780
H 4.740598 -0.647803 1.181986
H 4.732298 -1.256716 -0.486211
H -3.869763 1.233779 -1.788707
H -5.601723 0.807212 -1.696536
H -4.402608 -0.414372 -2.233492
H -5.404586 -1.978353 -0.357811
H -6.511989 -0.660246 0.140570
H -5.411336 -1.409446 1.339149
H 5.950772 1.439860 0.415896
H 5.936598 0.838173 -1.253574
H -3.830466 2.302125 0.566086
H 8.170166 0.370626 -0.158426
H 7.356314 -0.562874 1.130279
H 7.343886 -1.164976 -0.550784


