%chk=000170018.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170018

0 1
 S  -0.5642000      0.3060000       1.008600    
 S   -1.428600      0.4122000     -0.8518000    
 O    2.297200       1.580700     -0.9524000    
 O    3.100400      0.7614000       1.004500    
 O   -4.300700      0.9034000      0.1419000    
 N    2.652100      -1.741500     -0.4788000    
 C    1.673400     -0.6623000     -0.3320000    
 C   0.6628000      -1.017000      0.7604000    
 C    2.439100      0.6089000     -1.5900001E-02
 C   -2.785000     -0.7746000     -0.6969000    
 C   -3.746300     -0.3773000      0.4124000    
 H    1.183100     -0.5504000      -1.304000    
 H   0.1367000      -1.950000      0.5286000    
 H    1.169700      -1.164400       1.721200    
 H    3.262000      -1.545200      -1.271900    
 H    2.170400      -2.612100     -0.7004000    
 H   -3.310000     -0.7858000      -1.657800    
 H   -2.383700      -1.778300     -0.5259000    
 H   -3.290000     -0.3631000       1.405200    
 H   -4.573000      -1.094800      0.4564000    
 H    2.789600       2.394500     -0.7127000    
 H   -4.741100      0.8566000     -0.7238000    


%chk=000170018-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170018

0 1
S -0.616181 0.597986 0.702670
S -1.836646 0.220386 -1.178480
O 3.827618 0.903355 -0.653949
O 2.610092 1.176339 1.304457
O -4.903519 0.690716 0.007114
N 2.591974 -1.588176 -0.812815
C 1.802871 -0.388506 -0.461815
C 0.676038 -0.774398 0.512132
C 2.739504 0.631963 0.191520
C -3.111876 -1.009076 -0.492675
C -4.091384 -0.409369 0.524644
H 1.346723 0.121706 -1.345506
H 0.156296 -1.679561 0.159843
H 1.072853 -0.951307 1.525450
H 3.499908 -1.373439 -1.236721
H 2.059661 -2.282887 -1.344940
H -3.634043 -1.379548 -1.397237
H -2.560035 -1.852439 -0.041327
H -3.535453 0.022358 1.373384
H -4.734816 -1.232609 0.911024
H 4.429589 1.565609 -0.218340
H -5.375275 0.397798 -0.813533


