%chk=000290404.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290404

0 1
S 2.370066 2.554636 0.122650
O -2.551912 0.654391 -1.173392
O -2.277379 0.866783 1.052359
O 2.260838 -2.366811 -0.654575
N 0.177507 1.037605 0.027266
N 2.262401 -0.101011 -0.291625
C -0.533847 -0.171948 -0.107084
C -2.049604 -0.046238 -0.017786
C 0.115802 -1.348101 -0.330765
C -0.571817 -2.659848 -0.465019
C 1.608920 -1.368904 -0.444186
C 1.571983 0.988534 -0.069781
C -2.736032 -0.165234 -2.343096
C -3.671552 1.169355 1.298216
C 4.117528 2.148651 -0.000005
H -2.582951 -1.004099 0.131990
H -0.349214 1.896329 0.216613
H -1.085247 -2.949737 0.462278
H 0.160396 -3.464330 -0.677568
H -1.296770 -2.673021 -1.287596
H -1.777177 -0.581184 -2.671072
H -3.113509 0.556649 -3.080179
H -3.474218 -0.949263 -2.154164
H -3.605933 1.933763 2.082446
H -4.189554 0.276688 1.657749
H -4.135546 1.571533 0.390923
H 4.344059 1.586625 -0.921231
H 4.449266 1.519072 0.839358
H 4.690098 3.084315 -0.000824


%chk=000290404-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290404

0 1
S 2.370173 2.645821 0.153426
O -2.580421 0.683388 -1.214423
O -2.287156 0.955163 1.085670
O 2.255645 -2.382889 -0.711687
N 0.182166 1.039840 0.063388
N 2.253884 -0.067889 -0.324786
C -0.544558 -0.145857 -0.082954
C -2.046870 0.039339 0.005799
C 0.104073 -1.338160 -0.339201
C -0.596283 -2.674517 -0.475154
C 1.594648 -1.328877 -0.473418
C 1.560193 1.018043 -0.063836
C -2.650727 -0.210237 -2.377660
C -3.715502 1.207765 1.352213
C 4.159979 2.101282 -0.031986
H -2.564827 -0.934011 0.158017
H -0.337239 1.880473 0.337377
H -1.111116 -2.969962 0.458321
H 0.170755 -3.435332 -0.694918
H -1.339534 -2.688832 -1.293012
H -1.642138 -0.526226 -2.708130
H -3.129420 0.378370 -3.174751
H -3.265648 -1.108737 -2.160722
H -3.736454 1.886903 2.217089
H -4.233670 0.261555 1.607120
H -4.195875 1.676508 0.477339
H 4.277066 1.579077 -0.990807
H 4.422914 1.424764 0.792198
H 4.752546 3.028434 0.001386


