%chk=000222900.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222900

0 1
S 1.986399 -2.319908 -0.121769
S -0.435478 0.573177 0.235443
O 1.549976 -0.694325 1.907091
O 0.468488 2.870281 1.175408
O -2.279115 -2.687830 0.195089
O -5.076098 2.235783 1.171554
N -0.596584 -3.440339 -1.161578
N -3.516256 1.187462 -0.126575
C 2.630366 0.307747 -0.014140
C 2.031073 1.576186 -0.135552
C 0.872180 -3.355103 0.875178
C -1.695041 0.816801 1.535720
C 0.045059 -4.215136 -0.076893
C -3.032925 0.341136 0.985934
C 3.857157 0.057865 -0.641816
C 2.654552 2.577665 -0.890945
C 1.984206 -0.759639 0.796263
C 0.747995 1.898795 0.540000
C 4.472667 1.061351 -1.399142
C 3.872280 2.316222 -1.527329
C -1.721330 -2.646676 -0.890424
C -4.495795 2.164943 0.102308
C -2.207564 -1.819612 -2.047409
C -4.796737 3.049849 -1.076523
H 0.217168 -2.704215 1.501248
H 1.460095 -3.974064 1.577864
H -1.720105 1.884634 1.841229
H -1.396605 0.230353 2.428764
H -0.758097 -4.728513 0.514173
H 0.666445 -5.014351 -0.541018
H -3.794583 0.355332 1.811246
H -2.981353 -0.725826 0.640564
H 4.347125 -0.914304 -0.539989
H 2.191941 3.564198 -0.972680
H 5.427217 0.860180 -1.887880
H 4.354980 3.096965 -2.116708
H -0.005069 -3.226072 -1.961392
H -2.932132 1.215348 -0.955396
H -3.189567 -1.378051 -1.808540
H -1.523116 -0.989789 -2.271757
H -2.336962 -2.409129 -2.964423
H -5.644841 3.712447 -0.835494
H -3.949102 3.696543 -1.335142
H -5.079111 2.479720 -1.969963


%chk=000222900-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222900

0 1
S 2.627990 -2.451425 -0.762444
S -0.867812 0.375866 -0.331430
O 1.498977 -1.174160 1.401785
O -0.002742 2.104467 1.637301
O -1.799435 -5.420576 0.245863
O -5.282958 3.185306 0.645108
N -0.347424 -3.836645 -0.650597
N -3.503819 2.281432 -0.554282
C 2.515510 0.318723 -0.223040
C 1.712615 1.471129 0.033588
C 1.969019 -3.896538 0.283726
C -2.388089 0.501866 0.806967
C 0.852319 -4.655309 -0.450431
C -3.637406 0.941889 0.025689
C 3.759350 0.474558 -0.886720
C 2.188954 2.752026 -0.338734
C 2.114940 -1.016342 0.324074
C 0.345789 1.419905 0.654459
C 4.211430 1.751342 -1.280212
C 3.430323 2.893965 -0.995598
C -1.608935 -4.280185 -0.278101
C -4.336875 3.332076 -0.187117
C -2.753757 -3.309268 -0.556200
C -4.036399 4.671281 -0.854006
H 1.607452 -3.446335 1.224844
H 2.833124 -4.551267 0.478600
H -2.112852 1.234170 1.585798
H -2.525991 -0.494242 1.256976
H 0.535911 -5.524966 0.155875
H 1.226105 -5.044642 -1.418398
H -4.497293 0.991908 0.719875
H -3.883179 0.201991 -0.761559
H 4.387807 -0.405308 -1.058444
H 1.574572 3.630451 -0.116737
H 5.176768 1.855299 -1.785855
H 3.784490 3.889879 -1.281012
H -0.233361 -2.902017 -1.050421
H -2.737180 2.444293 -1.209950
H -3.344632 -3.181088 0.366750
H -2.410805 -2.322455 -0.913442
H -3.425190 -3.751263 -1.313318
H -4.936782 5.015928 -1.390834
H -3.816812 5.418826 -0.072329
H -3.189910 4.633555 -1.561470


