%chk=000257165.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257165

0 1
S -0.824480 -0.651005 1.522949
O -0.616020 0.813271 -2.062531
N -1.206406 -1.184053 -1.047609
N -1.717225 -2.989508 0.432606
C -0.451691 0.735721 0.373157
C 1.019481 1.119708 0.500048
C -1.381069 1.908378 0.684508
C 2.001303 -0.012645 0.170887
C -0.752952 0.169631 -1.058167
C 3.451845 0.491937 0.205923
C -2.862978 1.597109 0.506604
C -1.299979 -1.728797 0.147080
C 4.440974 -0.627671 -0.109249
H 1.225632 1.507393 1.518421
H 1.213802 1.975249 -0.188071
H -1.108858 2.755341 0.012287
H -1.196822 2.276358 1.714782
H 1.884519 -0.850735 0.885143
H 1.782436 -0.434048 -0.831164
H 3.679623 0.922614 1.200387
H 3.581756 1.317974 -0.521329
H -3.095061 1.261335 -0.513168
H -3.213831 0.821326 1.197769
H -3.471837 2.490993 0.691589
H 4.264818 -1.052525 -1.104816
H 4.368995 -1.447899 0.613790
H 5.473438 -0.261042 -0.088864
H -1.732197 -3.343240 1.374522
H -1.974917 -3.622672 -0.313881


%chk=000257165-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257165

0 1
S -0.854047 -0.725332 1.624244
O -0.647725 0.811951 -2.057259
N -1.268004 -1.232330 -1.041466
N -1.765195 -3.032926 0.396686
C -0.475624 0.699518 0.381173
C 1.020750 1.105664 0.451342
C -1.395652 1.920210 0.660867
C 2.042074 -0.009061 0.143367
C -0.805223 0.097417 -1.035753
C 3.499651 0.501902 0.216514
C -2.909319 1.648979 0.562935
C -1.342179 -1.758022 0.172331
C 4.534048 -0.605841 -0.076616
H 1.225383 1.540214 1.450349
H 1.144298 1.922619 -0.288518
H -1.112559 2.685113 -0.089242
H -1.142197 2.332676 1.656679
H 1.909924 -0.845789 0.857292
H 1.852800 -0.417051 -0.869616
H 3.688533 0.928057 1.223517
H 3.632433 1.333534 -0.504870
H -3.188004 1.299282 -0.447272
H -3.230700 0.887569 1.295518
H -3.475589 2.576230 0.763328
H 4.384073 -1.029335 -1.087501
H 4.443951 -1.434653 0.650855
H 5.568126 -0.218674 -0.022375
H -1.818347 -3.423837 1.334553
H -2.033382 -3.599587 -0.407459


