%chk=000170473.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170473

0 1
 S  -0.1182000      -1.747900     -0.4084000    
 O  -0.3652000      -1.855600      -1.833700    
 O  -1.1000000E-02  -2.936400      0.4159000    
 O   -3.683000     -0.6488000     -0.3654000    
 O   -2.937000      -2.458000      0.7735000    
 O   -1.747000       2.829200     -0.6327000    
 O   -2.103400       1.899500       1.437300    
 N   -1.428700      0.6223000     -0.3775000    
 C   -1.370900     -0.6701000      0.2864000    
 C    1.388400     -0.8478000     -0.1835000    
 C    2.113000      -1.025900      0.9813000    
 C    1.812000      1.5900001E-02  -1.177600    
 C   -2.719100      -1.368400      0.2577000    
 C    3.744300      0.5591000      0.1671000    
 C    3.300800     -0.3163000       1.158200    
 C    2.999900      0.7252000      -1.000800    
 C    5.015000       1.316600      0.3554000    
 C   -1.789900       1.793000      0.2562000    
 C   -2.100000       4.114500     -0.1094000    
 H   -1.118700     -0.5064000       1.340200    
 H    1.780300      -1.695400       1.768300    
 H    1.244100      0.1628000      -2.091000    
 H   -1.223000      0.6627000      -1.371200    
 H    3.870100     -0.4515000       2.074000    
 H    3.333700       1.406700      -1.778900    
 H    4.812200       2.274800      0.8439000    
 H    5.724200      0.7522000      0.9704000    
 H    5.506400       1.509000     -0.6046000    
 H   -4.548700      -1.110200     -0.3567000    
 H   -3.130600       4.103500      0.2578000    
 H   -2.024000       4.843800     -0.9203000    
 H   -1.407600       4.401800      0.6875000    


%chk=000170473-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170473

0 1
S -0.253660 -0.827775 -0.826067
O -0.678879 0.201411 -2.039316
O -0.304158 -2.452253 -1.058332
O -3.471644 -1.674631 0.519046
O -1.801731 -2.114751 2.101896
O -3.052898 2.678973 -1.080599
O -1.044077 2.605116 0.147399
N -2.537128 0.786013 0.054320
C -1.735604 -0.079248 0.777378
C 1.493053 -0.400231 -0.247391
C 2.351555 -1.467419 0.061945
C 1.865903 0.951188 -0.158816
C -2.305630 -1.367356 1.236838
C 4.098161 0.196152 0.582826
C 3.664985 -1.152170 0.473872
C 3.185094 1.235674 0.259116
C 5.502254 0.520984 1.058933
C -2.103121 2.080917 -0.271240
C -2.695139 4.026100 -1.582935
H -0.979784 0.378099 1.422761
H 2.002377 -2.500432 -0.037248
H 1.158511 1.751314 -0.402903
H -3.364868 0.415302 -0.423710
H 4.360880 -1.964695 0.712670
H 3.506793 2.280782 0.335032
H 5.528792 0.626003 2.160931
H 6.216945 -0.275455 0.788364
H 5.867073 1.470494 0.630381
H -3.783854 -2.589161 0.748180
H -2.482378 4.703972 -0.739775
H -3.578280 4.355828 -2.146396
H -1.811144 3.955151 -2.237760


