%chk=000012526.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012526

0 1
 S   0.5490000      3.0999999E-02 -0.8733000    
 S  -0.5524000      3.0700000E-02  0.8612000    
 O    5.325100     -0.5494000     -0.3654000    
 O   -5.323300     -0.5474000      0.3753000    
 N    3.387100      0.3690000      0.5401000    
 N   -3.385400      0.3619000     -0.5420000    
 C    2.648100     -0.8607000      0.7137000    
 C   -2.650200     -0.8621000     -0.7124000    
 C    1.808400      -1.227600     -0.5021000    
 C   -1.805800      -1.223500      0.5020000    
 C    4.666400      0.4157000      1.3300000E-02
 C   -4.666500      0.4164000     -9.8999999E-03
 C    5.192800       1.822700     -8.0899999E-02
 C   -5.193300       1.823500      8.0200002E-02
 H    2.058100     -0.7682000       1.629600    
 H    3.368900      -1.667800      0.8921000    
 H   -2.063100     -0.7754000      -1.630900    
 H   -3.370200      -1.671300     -0.8842000    
 H    2.447400      -1.321900      -1.386700    
 H    1.317100      -2.194600     -0.3527000    
 H   -1.316700      -2.191900      0.3541000    
 H   -2.442900      -1.316200       1.388300    
 H    2.928300       1.235500      0.8058000    
 H   -2.927300       1.227200     -0.8129000    
 H    6.263700       1.801300     -0.3013000    
 H    4.670900       2.354100     -0.8814000    
 H    5.041000       2.349100      0.8658000    
 H   -6.269900       1.802000      0.2708000    
 H   -4.692100       2.347200      0.8987000    
 H   -5.015200       2.357500     -0.8575000    


%chk=000012526-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012526

0 1
S 0.657444 0.175723 -0.936345
S -0.654861 0.187668 0.926489
O 5.664253 -0.725773 0.275461
O -5.663771 -0.727743 -0.259537
N 3.647250 0.434669 0.349841
N -3.648337 0.433921 -0.354166
C 2.843990 -0.743758 0.689174
C -2.845345 -0.747256 -0.684515
C 1.911693 -1.174943 -0.452788
C -1.910597 -1.167545 0.459518
C 5.020746 0.361271 0.152244
C -5.020938 0.361172 -0.150128
C 5.702644 1.676979 -0.212255
C -5.702750 1.679829 0.203721
H 2.243918 -0.551706 1.599411
H 3.558955 -1.558754 0.906013
H -2.247364 -0.563293 -1.597781
H -3.560450 -1.564480 -0.892376
H 2.474834 -1.355722 -1.386149
H 1.342976 -2.081725 -0.188674
H -1.342828 -2.077205 0.203315
H -2.471779 -1.338750 1.395851
H 3.155947 1.317422 0.196883
H -3.157426 1.318799 -0.212731
H 6.440479 1.927571 0.569581
H 6.260152 1.544046 -1.155024
H 5.001608 2.522031 -0.324621
H -6.442454 1.922938 -0.578726
H -6.258075 1.555183 1.148891
H -5.001913 2.526229 0.306822


