%chk=000078525.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078525

0 1
 S    4.263100     -0.4850000     -0.1777000    
 O   -3.878800     -0.4442000      0.1066000    
 N    1.666700      0.4663000     -0.2226000    
 C   0.2384000      0.2548000     -0.1410000    
 C  -0.2599000      -1.040500      6.2100001E-02
 C    2.114000       1.854100     -0.4379000    
 C    2.572800     -0.6100000     -0.1003000    
 C  -0.6874000       1.307600     -0.2581000    
 C   0.6589000      -2.158300      0.1885000    
 C   -1.641800      -1.271300      0.1451000    
 C    1.975400      -1.965300      0.1138000    
 C   -2.540600     -0.2156000      2.6400000E-02
 C   -2.063000       1.073300     -0.1749000    
 C    2.323100       2.548100      0.8943000    
 C   -4.740800      0.6858000     -2.4499999E-02
 H    3.068000       1.849100     -0.9749000    
 H    1.449200       2.406800      -1.106200    
 H  -0.3928000       2.342800     -0.3912000    
 H   0.2596000      -3.154700      0.3448000    
 H   -2.023500      -2.278200      0.3026000    
 H    2.641800      -2.817700      0.2115000    
 H   -2.701900       1.945000     -0.2709000    
 H    1.390800       2.615000       1.464200    
 H    3.051800       2.021200       1.518100    
 H    2.691800       3.566300      0.7344000    
 H   -4.586900       1.405000      0.7871000    
 H   -5.769100      0.3199000      6.2899999E-02
 H   -4.648900       1.149200      -1.012600    


%chk=000078525-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078525

0 1
S 4.289596 -0.409449 -0.066074
O -3.934483 -0.476397 0.086952
N 1.659139 0.441012 -0.218135
C 0.255590 0.262756 -0.132511
C -0.283204 -1.061771 0.043044
C 2.204638 1.809445 -0.445726
C 2.571336 -0.622820 -0.063979
C -0.653792 1.352966 -0.208940
C 0.640595 -2.167655 0.152041
C -1.685041 -1.254800 0.109267
C 1.999058 -1.946741 0.104327
C -2.569160 -0.165108 0.013082
C -2.044173 1.147337 -0.141505
C 2.385226 2.595407 0.867743
C -4.891726 0.627640 -0.015999
H 3.190642 1.672724 -0.922853
H 1.544449 2.335246 -1.155850
H -0.291427 2.377690 -0.310874
H 0.244921 -3.181102 0.281284
H -2.094690 -2.261830 0.237552
H 2.718308 -2.763293 0.195609
H -2.707984 2.014298 -0.204622
H 1.432770 2.719781 1.413005
H 3.100429 2.068011 1.521594
H 2.795707 3.597796 0.649453
H -4.761692 1.354424 0.809550
H -5.881533 0.155076 0.061359
H -4.803499 1.148857 -0.989194


