%chk=000239835.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239835

0 1
S 2.064108 -2.418818 -0.390954
O -1.592864 0.140968 -1.046965
O -1.404329 -0.137143 1.187333
N 0.823339 1.915337 -0.379285
C 0.587022 0.456337 -0.181299
C 1.490271 -0.054516 0.959121
C 1.481463 -1.566711 1.103266
C -0.879276 0.111298 0.127981
C 0.235253 2.751741 0.707477
C 0.326298 2.357913 -1.716034
C -3.014146 -0.202841 -1.009054
C 3.805205 -1.951413 -0.498273
C -3.172459 -1.707125 -0.933295
H 0.867110 -0.072408 -1.139600
H 2.520413 0.323840 0.784349
H 1.168009 0.401495 1.922335
H 2.085524 -1.877330 1.976525
H 0.452771 -1.947171 1.290088
H 0.561837 2.374768 1.690589
H -0.864279 2.800139 0.711122
H 0.627046 3.777262 0.606144
H -0.728999 2.102836 -1.917161
H 0.946023 1.885568 -2.496424
H 0.450362 3.446637 -1.815957
H -3.478941 0.317211 -0.152998
H -3.359876 0.224050 -1.967552
H 4.364415 -2.244299 0.395828
H 3.929245 -0.874580 -0.658123
H 4.237765 -2.477354 -1.360128
H -4.215835 -2.010444 -1.075508
H -2.567548 -2.213752 -1.697178
H -2.845126 -2.092395 0.043927


%chk=000239835-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239835

0 1
S 2.294954 -2.436179 -0.576430
O -1.621421 -0.044388 -1.144482
O -1.498977 0.122382 1.182426
N 0.764611 1.890977 -0.401781
C 0.559803 0.429855 -0.198391
C 1.435388 -0.120467 0.945155
C 1.520990 -1.657541 0.970910
C -0.930573 0.121020 0.061772
C 0.350670 2.769347 0.713207
C 0.329254 2.394707 -1.720948
C -3.101357 -0.259516 -1.049876
C 4.065761 -1.827788 -0.376741
C -3.417338 -1.747337 -0.874140
H 0.851851 -0.071628 -1.139434
H 2.441224 0.324686 0.836021
H 1.026122 0.205358 1.921489
H 2.110505 -2.000114 1.839537
H 0.519059 -2.117159 1.037803
H 0.782217 2.411961 1.662146
H -0.755091 2.839929 0.847493
H 0.738535 3.786558 0.522851
H -0.778255 2.441723 -1.846582
H 0.728992 1.741652 -2.515939
H 0.736834 3.411937 -1.867894
H -3.489885 0.336381 -0.205163
H -3.483862 0.134313 -2.005181
H 4.459251 -2.126544 0.608813
H 4.124444 -0.734862 -0.498049
H 4.652717 -2.317595 -1.169428
H -4.512124 -1.902624 -0.896788
H -2.966334 -2.343717 -1.685847
H -3.038163 -2.116225 0.093769


