%chk=000258170.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258170

0 1
S -2.923419 0.662479 -0.864793
O 2.364793 -1.638026 0.853451
N -0.454986 1.774560 -0.687259
N 2.000163 2.259213 -0.427101
N 3.316249 0.403024 0.370343
N -1.205644 -2.797079 0.556850
C 0.862420 1.447162 -0.369389
C 0.916629 0.095995 0.053054
C -1.240483 0.614827 -0.485837
C -0.418050 -0.417089 -0.033092
C 2.186050 -0.514041 0.465092
C -3.707899 0.429391 0.775460
C 3.227397 1.630338 -0.027098
C -5.197608 0.452969 0.518735
C -0.842803 -1.731902 0.290922
H -0.803745 2.652709 -1.035191
H 1.952254 3.221783 -0.735759
H -3.382587 -0.535597 1.212141
H -3.393019 1.230026 1.468496
H 4.109548 2.289157 -0.083861
H -5.539616 1.405024 0.089916
H -5.518814 -0.349637 -0.162294
H -5.755230 0.307613 1.456515


%chk=000258170-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258170

0 1
S -2.956441 0.773708 -0.947046
O 2.325602 -1.642544 0.966387
N -0.371773 1.800418 -0.753777
N 2.071423 2.240093 -0.471012
N 3.371254 0.406354 0.422421
N -1.350700 -2.721523 0.597026
C 0.924009 1.464814 -0.400819
C 0.952008 0.138912 0.072009
C -1.207993 0.686723 -0.527010
C -0.407465 -0.357423 -0.022012
C 2.213731 -0.469389 0.523561
C -3.764703 0.353208 0.750964
C 3.263633 1.632010 -0.035254
C -5.285866 0.401836 0.576819
C -0.891807 -1.653003 0.318136
H -0.717236 2.695484 -1.100118
H 2.074291 3.202337 -0.812456
H -3.413175 -0.651864 1.029759
H -3.397217 1.097992 1.474584
H 4.152446 2.271568 -0.098840
H -5.633830 1.405438 0.274328
H -5.627857 -0.330355 -0.175533
H -5.770734 0.148107 1.537184


