%chk=000233411.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233411

0 1
S -2.648487 -1.380714 0.067558
O -3.926246 -0.796958 0.444664
O -2.635322 -2.305620 -1.055337
N -2.190968 -2.333379 1.438676
C 0.942137 0.302447 -0.542565
C 2.340383 -0.157240 -0.871842
C -0.105894 -0.633528 -0.427214
C 0.681937 1.670112 -0.329349
C -1.405109 -0.203862 -0.081321
C -0.617768 2.103446 0.011388
C -1.662907 1.166205 0.136340
C 3.126788 -0.488962 0.405871
C 4.551678 -0.958788 0.085402
C 0.169075 -2.081717 -0.668212
C 1.775726 2.684717 -0.453600
C -0.849863 3.567077 0.238800
C -3.034222 1.630777 0.493926
C 5.334529 -1.287985 1.354439
H 2.308472 -1.046115 -1.539994
H 2.875941 0.622014 -1.456439
H 2.590438 -1.267215 0.983133
H 3.157987 0.398552 1.066912
H 4.516787 -1.849405 -0.572366
H 5.086629 -0.178924 -0.491025
H 1.147649 -2.261131 -1.142587
H 0.169963 -2.652800 0.272394
H -0.574784 -2.551659 -1.344465
H 2.696535 2.271182 -0.895302
H 1.474291 3.531874 -1.086429
H 2.046203 3.090222 0.532273
H -0.222310 3.946989 1.056541
H -0.620639 4.151154 -0.663427
H -1.894156 3.796900 0.507005
H -3.109661 2.721553 0.622836
H -3.784331 1.349428 -0.268187
H -3.403292 1.172935 1.428592
H 4.851973 -2.085467 1.931234
H 5.422366 -0.416444 2.013072
H 6.350347 -1.623914 1.117595
H -2.690738 -2.164630 2.308941
H -2.118736 -3.339130 1.300069


%chk=000233411-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233411

0 1
S -2.806407 -1.494546 -0.143528
O -4.302830 -0.869225 0.034087
O -2.585046 -2.512305 -1.391267
N -2.411075 -2.529549 1.357520
C 0.961881 0.303097 -0.471638
C 2.374635 -0.155038 -0.829957
C -0.090458 -0.661288 -0.374665
C 0.692393 1.685921 -0.236135
C -1.391341 -0.164306 -0.086122
C -0.628173 2.126759 0.059597
C -1.710162 1.195155 0.158899
C 3.250699 -0.499349 0.407775
C 4.675673 -0.955958 0.021611
C 0.202724 -2.144273 -0.547911
C 1.814313 2.716623 -0.284341
C -0.914491 3.607252 0.271041
C -3.084790 1.732271 0.530684
C 5.544800 -1.304254 1.249424
H 2.333900 -1.037230 -1.493112
H 2.886543 0.627743 -1.419305
H 2.753801 -1.293066 1.001250
H 3.311792 0.384317 1.075179
H 4.606880 -1.837567 -0.647964
H 5.168803 -0.156595 -0.568961
H 1.270127 -2.356876 -0.397104
H -0.362885 -2.737641 0.189071
H -0.093193 -2.500247 -1.549762
H 2.810659 2.255013 -0.238447
H 1.770665 3.318416 -1.213635
H 1.742173 3.421837 0.561964
H -0.169474 4.242505 -0.232480
H -1.905005 3.888763 -0.122046
H -0.904825 3.876495 1.346639
H -3.538136 2.269976 -0.324384
H -3.794548 0.944714 0.812445
H -2.996013 2.454257 1.361110
H 5.089101 -2.123050 1.837234
H 5.652690 -0.430690 1.919682
H 6.558449 -1.627167 0.949243
H -2.845230 -2.083709 2.185174
H -2.816218 -3.465188 1.171133


