%chk=000194502.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194502

0 1
S 1.525927 0.332777 -0.024743
O -1.000513 -0.115846 0.408110
O 1.498717 0.025634 -1.442179
O 0.862998 1.524602 0.465476
N -3.014232 -0.999993 -0.266405
C 1.009300 -1.118940 0.871720
C -0.421147 -1.455714 0.481010
C 3.216253 0.449718 0.457508
C -2.297186 0.044302 -0.035361
C -2.530341 1.515101 -0.122608
H 1.665756 -1.985152 0.670198
H 1.067834 -0.951280 1.965185
H -0.510332 -1.939740 -0.509566
H -0.966257 -2.041621 1.238880
H 3.674279 1.382222 0.091022
H 3.371531 0.468031 1.540638
H 3.842631 -0.351380 0.048980
H -3.304264 1.851399 0.577272
H -1.596923 2.070669 0.131272
H -2.809672 1.822737 -1.138462
H -3.969358 -0.904028 -0.590546


%chk=000194502-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194502

0 1
S 1.944803 0.516783 0.073275
O -1.231955 0.115073 0.544610
O 1.557328 0.209497 -1.488668
O 1.848443 2.018441 0.707533
N -2.839595 -1.121684 -0.603568
C 0.903420 -0.734726 1.193698
C -0.377249 -1.085314 0.470576
C 3.757461 -0.071077 0.312267
C -2.475503 0.016354 -0.085515
C -3.207399 1.343617 -0.030704
H 1.560017 -1.610585 1.324035
H 0.756652 -0.174860 2.129394
H -0.197816 -1.342118 -0.590655
H -0.887182 -1.941903 0.951784
H 4.356253 0.639537 -0.274058
H 3.986392 -0.007246 1.385458
H 3.826604 -1.092174 -0.087825
H -4.141593 1.245241 0.550570
H -2.575720 2.115367 0.434098
H -3.474276 1.671317 -1.050736
H -3.774084 -1.086042 -1.048168


