%chk=000268975.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268975

0 1
S -2.048654 1.651541 0.210529
O -2.920497 2.263925 1.190655
O -1.765624 2.298800 -1.048691
N -0.566348 1.487347 1.092286
N 4.404436 -0.048026 -1.040886
C -2.532060 0.028517 -0.071584
C 0.699681 1.133158 0.568030
C 2.962823 0.311241 0.925278
C 1.698098 0.710610 1.435934
C 3.196048 0.346468 -0.478799
C 0.947954 1.202071 -0.846870
C -3.398322 -0.606173 0.827378
C -2.077610 -0.663048 -1.202031
C -3.336834 -2.622444 -0.519978
C 2.158132 0.815687 -1.352986
C -3.799179 -1.923540 0.608849
C -2.473187 -1.979930 -1.426561
C 4.032670 -0.141129 1.765283
C -3.755474 -4.031634 -0.767476
C 5.221376 -0.524036 1.200295
C 5.368386 -0.463854 -0.226694
H -0.578853 1.700398 2.099650
H 1.533762 0.671775 2.509011
H 0.182514 1.616385 -1.515414
H -3.772125 -0.063466 1.704184
H -1.413102 -0.168382 -1.919648
H 2.371285 0.864458 -2.424138
H -4.473392 -2.408377 1.312867
H -2.114259 -2.512545 -2.306049
H 3.879653 -0.171578 2.843201
H -4.394992 -4.438709 0.027579
H -4.319823 -4.121000 -1.709013
H -2.885634 -4.701225 -0.852938
H 6.056459 -0.871529 1.803662
H 6.314595 -0.770654 -0.688216


%chk=000268975-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268975

0 1
S -2.220823 1.941147 0.065976
O -3.310254 2.509191 1.128704
O -2.033144 2.542629 -1.427390
N -0.533249 2.243186 0.979115
N 4.189262 -0.087535 -1.083638
C -2.466466 0.073282 -0.092897
C 0.615320 1.578294 0.484679
C 2.580018 0.129433 0.805952
C 1.357216 0.689784 1.285315
C 3.023568 0.436139 -0.541284
C 1.065587 1.892707 -0.849600
C -3.181373 -0.583752 0.920956
C -1.934878 -0.580523 -1.217818
C -2.840545 -2.692432 -0.315948
C 2.231827 1.320809 -1.347102
C -3.365423 -1.979187 0.793929
C -2.129434 -1.974399 -1.316028
C 3.395870 -0.755157 1.586135
C -3.043079 -4.190505 -0.447030
C 4.564971 -1.277917 1.029873
C 4.921846 -0.913892 -0.309108
H -0.756557 2.072883 1.975460
H 1.006930 0.432145 2.293938
H 0.478246 2.598873 -1.444229
H -3.605384 -0.019648 1.758310
H -1.410020 -0.016793 -1.995286
H 2.594196 1.547357 -2.354347
H -3.929129 -2.517315 1.564185
H -1.727349 -2.510509 -2.183386
H 3.094756 -1.010723 2.608900
H -3.597902 -4.603888 0.411663
H -3.608783 -4.436270 -1.364937
H -2.074620 -4.720187 -0.512223
H 5.212128 -1.954404 1.596759
H 5.838570 -1.311724 -0.760898


