%chk=000231904.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231904

0 1
S -2.095352 1.758554 0.054665
O 3.043585 1.658220 -0.004425
N 2.647294 -0.614305 -0.002358
N -2.991128 -0.732056 -0.004517
N -4.727703 0.945102 0.155748
C -0.908705 0.470425 0.024081
C -1.573501 -0.787070 0.008579
C 1.216300 -0.610446 0.002303
C 0.471931 0.582375 0.019444
C -0.816302 -1.969010 -0.006578
C 0.570655 -1.874734 -0.009519
C -3.416406 0.516552 0.030040
C 3.483340 0.527051 -0.004210
C 4.950371 0.197937 -0.006493
H 0.968516 1.560173 0.029746
H -1.319979 -2.935841 -0.015096
H 1.162600 -2.788335 -0.020822
H 3.083564 -1.538062 -0.003959
H 5.258304 -0.366716 0.883455
H 5.539255 1.132010 -0.009096
H 5.255383 -0.370010 -0.895207
H -4.968269 1.833684 -0.263279
H -5.445354 0.235101 0.035396


%chk=000231904-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231904

0 1
S -2.156358 1.845429 -0.001294
O 3.142327 1.735571 -0.001242
N 2.657924 -0.562291 -0.000066
N -3.009855 -0.734569 -0.000210
N -4.786004 0.865692 -0.002464
C -0.934279 0.494853 -0.000527
C -1.602629 -0.774221 -0.000021
C 1.231475 -0.569533 -0.000064
C 0.462104 0.625721 -0.000700
C -0.814652 -1.947976 0.000566
C 0.587055 -1.841290 0.000626
C -3.460682 0.504067 -0.000621
C 3.529158 0.529247 -0.000569
C 5.007678 0.135835 0.000128
H 0.971973 1.589973 -0.001240
H -1.309071 -2.923335 0.001012
H 1.194284 -2.755641 0.001144
H 3.095291 -1.486912 0.000411
H 5.267069 -0.456120 0.897702
H 5.612545 1.053749 -0.003242
H 5.266564 -0.462521 -0.893330
H -5.077685 1.838289 -0.001331
H -5.485833 0.126583 0.003230


