%chk=000065368.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065368

0 1
 S   -3.605600      0.1656000       1.126100    
 S    3.604600      0.1662000      -1.125500    
 O   -3.834800     -0.4721000     -0.3615000    
 O    3.836100     -0.4707000      0.3621000    
 O   -2.743500     -0.7164000       1.894000    
 O   -4.899600      0.5905000       1.635200    
 O    2.741500     -0.7164000      -1.891700    
 O    4.897700      0.5912000      -1.636700    
 N   -1.306800       4.002100      0.4063000    
 N    1.304100       4.002300     -0.4084000    
 C   -1.329600       1.601400      0.4153000    
 C    1.328500       1.601600     -0.4142000    
 C  -0.6660000       2.831600      0.2072000    
 C   0.6641000       2.831800     -0.2078000    
 C   -2.667500       1.622000      0.8329000    
 C    2.666500       1.622400     -0.8317000    
 C  -0.6624000      0.3905000      0.2081000    
 C   0.6621000      0.3907000     -0.2054000    
 C   -3.318000       2.828800       1.035000    
 C    3.316300       2.829600      -1.035200    
 C   -2.598000       3.981900      0.8093000    
 C    2.595500       3.982400     -0.8112000    
 C   -4.532100      -1.634300     -0.5852000    
 C    4.534000      -1.632700      0.5854000    
 C   -5.080300      -2.321700      0.4895000    
 C    5.080700      -2.320400     -0.4898000    
 C   -4.678600      -2.105600      -1.883100    
 C    4.682400      -2.103200       1.883200    
 C   -5.787600      -3.502200      0.2623000    
 C    5.788700      -3.500700     -0.2631000    
 C   -5.386100      -3.286100      -2.110200    
 C    5.390500      -3.283500       2.109900    
 C   -5.940500      -3.984400      -1.037500    
 C    5.943700      -3.982200       1.036700    
 H   -1.120800     -0.5844000      0.3091000    
 H    1.121200     -0.5842000     -0.3047000    
 H   -4.350100       2.909500       1.353600    
 H    4.348300       2.910500      -1.353900    
 H   -3.050800       4.958100      0.9486000    
 H    3.047600       4.958700     -0.9517000    
 H   -4.996200      -2.002600       1.521200    
 H    4.995000      -2.001800      -1.521600    
 H   -4.247700      -1.564400      -2.720500    
 H    4.252700      -1.561800       2.721000    
 H   -6.219400      -4.047000       1.096900    
 H    6.219300      -4.045700      -1.098100    
 H   -5.505100      -3.661700      -3.122400    
 H    5.511100      -3.658600       3.121900    
 H   -6.491200      -4.903600      -1.214400    
 H    6.494900      -4.901200       1.213300    


%chk=000065368-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065368

0 1
S -3.606660 -0.107794 1.651061
S 3.606646 -0.108074 -1.651518
O -4.037835 -0.580016 -0.281664
O 4.037919 -0.578261 0.281562
O -2.679342 -1.266646 2.319215
O -4.951861 0.383243 2.422668
O 2.679688 -1.267768 -2.318689
O 4.951754 0.382668 -2.423472
N -1.253402 3.825836 0.586946
N 1.252102 3.825729 -0.590928
C -1.298643 1.341256 0.606719
C 1.298168 1.341148 -0.608493
C -0.663855 2.614217 0.311220
C 0.662956 2.614160 -0.314129
C -2.588870 1.439272 1.199272
C 2.588368 1.439068 -1.201121
C -0.624914 0.105430 0.292431
C 0.624854 0.105378 -0.293099
C -3.205313 2.650938 1.481271
C 3.204415 2.650685 -1.484184
C -2.474815 3.834878 1.155188
C 2.473521 3.834673 -1.159163
C -4.996825 -1.563040 -0.458271
C 4.997586 -1.560456 0.459239
C -6.375796 -1.205056 -0.500108
C 6.376346 -1.201607 0.500339
C -4.593815 -2.916902 -0.646598
C 4.595392 -2.914296 0.649430
C -7.339620 -2.196764 -0.765909
C 7.340791 -2.192417 0.767258
C -5.568262 -3.897222 -0.915391
C 5.570448 -3.893696 0.919365
C -6.939680 -3.541019 -0.974386
C 6.941669 -3.536622 0.977613
H -1.113150 -0.841934 0.535765
H 1.113407 -0.842042 -0.535573
H -4.198782 2.695663 1.936677
H 4.197882 2.695329 -1.939604
H -2.908767 4.818401 1.365249
H 2.907147 4.818153 -1.370092
H -6.656344 -0.160859 -0.330327
H 6.656265 -0.157476 0.329126
H -3.529017 -3.165073 -0.592499
H 3.530726 -3.163147 0.595871
H -8.400760 -1.929242 -0.807412
H 8.401786 -1.924230 0.808194
H -5.265999 -4.937656 -1.074894
H 5.268815 -4.934087 1.080332
H -7.693946 -4.309016 -1.177748
H 7.696422 -4.303905 1.181860


