%chk=000271957.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271957

0 1
S -3.465841 -0.621447 -2.091863
O 1.200269 2.380604 1.822650
N -0.858654 0.879959 0.748587
N 0.422749 0.417742 0.834555
C -3.163638 0.802937 0.243165
C -1.818892 -1.315935 -0.008569
C -1.851094 0.118134 0.368582
C -3.979046 0.529700 -0.864889
C -2.498304 -1.750034 -1.155699
C 3.470986 0.656805 -0.033462
C 2.787836 0.668219 1.226339
C 4.761856 0.066582 -0.094979
C -3.597278 1.740021 1.193904
C -1.130822 -2.263202 0.766982
C -5.203981 1.172676 -1.042885
C -2.441623 -3.079181 -1.579128
C 3.371643 0.142307 2.355947
C 1.430354 1.302408 1.338897
C 2.907572 1.220810 -1.223050
C 5.343609 -0.482468 1.091248
C -4.823034 2.389076 1.021790
C -1.074931 -3.597064 0.355899
C 5.458681 0.037091 -1.345615
C -5.622172 2.110467 -0.092787
C -1.713110 -4.001769 -0.822953
C 4.667174 -0.442179 2.285281
C 3.600074 1.180252 -2.406666
C 4.891112 0.577792 -2.471138
H -2.964605 1.970459 2.054029
H -0.656619 -1.963905 1.702076
H -5.832349 0.950817 -1.905724
H -2.966264 -3.400817 -2.479919
H 2.856877 0.170120 3.318222
H 1.925662 1.695058 -1.174320
H 6.336457 -0.929002 1.027581
H -5.154309 3.120080 1.758743
H -0.535534 -4.327187 0.958288
H 6.446900 -0.420070 -1.381655
H -6.574763 2.622676 -0.221199
H -1.655683 -5.041418 -1.143855
H 5.107856 -0.850171 3.194332
H 0.696876 -0.490073 0.432363
H 3.176783 1.610510 -3.314627
H 5.414021 0.560721 -3.426578


%chk=000271957-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271957

0 1
S -3.689477 -0.516783 -2.208094
O 1.063039 2.196625 2.406725
N -0.931931 0.960160 0.869907
N 0.383787 0.540789 0.883107
C -3.216411 0.844556 0.250880
C -1.705088 -1.161296 -0.267564
C -1.871629 0.210941 0.297427
C -4.127613 0.582846 -0.806387
C -2.448376 -1.588726 -1.405801
C 3.338535 0.462232 0.096789
C 2.766243 0.780246 1.388544
C 4.684193 -0.084943 0.055474
C -3.605920 1.769456 1.260139
C -0.842871 -2.117662 0.351378
C -5.390110 1.218646 -0.859484
C -2.259300 -2.876861 -1.961203
C 3.540048 0.641410 2.551379
C 1.354841 1.278639 1.594722
C 2.671801 0.708914 -1.153889
C 5.418883 -0.256032 1.274271
C -4.858299 2.407737 1.212940
C -0.661586 -3.404232 -0.190112
C 5.271562 -0.419442 -1.209901
C -5.755236 2.131689 0.150809
C -1.352894 -3.777487 -1.367783
C 4.865799 0.121122 2.499342
C 3.276881 0.383340 -2.370536
C 4.580821 -0.202340 -2.402659
H -2.889612 1.982418 2.058988
H -0.347255 -1.861213 1.293967
H -6.079889 0.996355 -1.680569
H -2.841667 -3.178771 -2.838352
H 3.097281 0.934606 3.508815
H 1.692512 1.197983 -1.159163
H 6.432308 -0.672068 1.225487
H -5.138558 3.117419 1.998259
H 0.005988 -4.114853 0.307721
H 6.285072 -0.838075 -1.223329
H -6.734879 2.619907 0.111703
H -1.212060 -4.772857 -1.801895
H 5.439240 0.010349 3.425438
H 0.692305 -0.268592 0.324353
H 2.753048 0.590118 -3.310110
H 5.039275 -0.458166 -3.363832


