%chk=000067074.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067074

0 1
 S   -5.577100      -1.739600      0.1559000    
 O   -3.933900       3.063000     -0.1516000    
 O   -5.894900      -2.130700      -1.399400    
 O   -5.046000      -2.935000      0.7943000    
 O   -6.745300      -1.064700      0.6996000    
 O    2.974500       2.132600     -0.1045000    
 N    1.781500      0.1108000      2.5800001E-02
 N    7.838700      -1.898900      2.6799999E-02
 C   -1.921100     -2.8300000E-02  4.0800001E-02
 C   -2.235100       1.349000     -4.5600001E-02
 C   -4.295800     -0.5555000      7.7900000E-02
 C   -2.963100     -0.9678000      0.1017000    
 C  -0.5743000     -0.4255000      6.3699998E-02
 C   0.4483000      0.5217000      2.9000000E-03
 C   -3.582000       1.746100     -6.8400003E-02
 C   -1.193000       2.288500     -0.1063000    
 C   -4.604600      0.7989000     -7.0000002E-03
 C   0.1397000       1.876100     -8.1900001E-02
 C    2.931400      0.9095000     -2.7100001E-02
 C    4.221400      0.1711000     -1.2400000E-02
 C    5.341300      0.7985000      0.4912000    
 C    4.256100      -1.117100     -0.5036000    
 C    6.614700      -1.198600      1.3500000E-02
 C    6.551900      0.1058000      0.5043000    
 C    5.466700      -1.810000     -0.4905000    
 H   -2.721100      -2.027100      0.1605000    
 H  -0.3243000      -1.483500      0.1295000    
 H   -1.375500       3.356200     -0.1897000    
 H   -5.637700       1.135800     -3.4400001E-02
 H   0.8733000       2.667900     -0.1366000    
 H    1.897900     -0.8926000      0.1345000    
 H   -3.244900       3.622600      0.2387000    
 H    5.308700       1.810900      0.8825000    
 H    3.398800      -1.616300     -0.9426000    
 H    7.439300      0.5926000      0.9008000    
 H    5.505100      -2.822600     -0.8840000    
 H   -5.145800      -2.538900      -1.894200    
 H    7.884800      -2.844600     -0.3282000    
 H    8.671200      -1.456200      0.3927000    


%chk=000067074-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000067074

0 1
S -5.614548 -1.846673 0.080536
O -4.098907 3.105611 -0.059664
O -5.855641 -1.943476 -1.761986
O -5.007096 -3.254839 0.596352
O -6.973502 -1.254940 0.729744
O 2.999900 2.173545 0.112050
N 1.819254 0.143210 0.077123
N 8.036901 -1.875421 0.003642
C -1.921650 0.002358 0.043950
C -2.274540 1.408062 -0.005673
C -4.269577 -0.547349 0.034470
C -2.956031 -0.990104 0.059834
C -0.544997 -0.370699 0.070638
C 0.478263 0.592813 0.050534
C -3.670994 1.775880 -0.023032
C -1.210593 2.365548 -0.025361
C -4.677958 0.805125 -0.006562
C 0.129967 1.988164 0.002501
C 3.005012 0.902065 0.072139
C 4.274934 0.115189 0.037671
C 5.478088 0.811139 0.339917
C 4.371286 -1.264795 -0.297481
C 6.809665 -1.224946 0.011015
C 6.719773 0.163863 0.333819
C 5.609291 -1.926845 -0.312803
H -2.720236 -2.057619 0.105901
H -0.296740 -1.439319 0.106690
H -1.422805 3.442607 -0.064174
H -5.731641 1.093839 -0.006216
H 0.933340 2.726241 -0.005472
H 1.934539 -0.870135 0.137043
H -3.341388 3.740826 -0.051520
H 5.403297 1.877429 0.576862
H 3.487141 -1.843874 -0.594520
H 7.630789 0.723575 0.577104
H 5.658430 -2.987449 -0.586509
H -6.660257 -2.517426 -1.924742
H 8.105744 -2.862372 -0.228411
H 8.893289 -1.374711 0.224191


