%chk=000185018.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185018

0 1
S 3.191859 -0.036918 -1.582617
O -0.943649 -1.779422 0.864716
O 3.537756 -1.475639 -1.588128
N 0.912721 -0.936016 -0.166416
N -0.572963 1.112775 -1.269849
N 0.724599 1.000147 -1.544267
N 1.790220 -1.810406 0.525839
C -2.710440 0.399325 -0.218519
C -1.203773 0.243131 -0.494007
C -2.901379 0.558911 1.298778
C -3.417377 -0.868983 -0.723915
C -3.270672 1.630759 -0.944889
C -0.510936 -0.901707 0.147436
C 1.457675 0.022337 -1.005879
C 3.909925 0.722908 -0.122885
H -2.355490 1.423986 1.688257
H -3.958668 0.700356 1.548090
H -2.560147 -0.330497 1.847084
H -3.076601 -1.765472 -0.186942
H -3.244864 -1.031625 -1.792652
H -4.500393 -0.800448 -0.574641
H -3.127902 1.561105 -2.030702
H -2.770852 2.553422 -0.624582
H -4.341945 1.748769 -0.756503
H 1.233227 -2.444489 1.124923
H 2.315469 -2.402048 -0.154140
H 3.545059 1.749574 0.002593
H 5.003032 0.759595 -0.205203
H 3.687807 0.178771 0.808519


%chk=000185018-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185018

0 1
S 3.269769 -0.072605 -1.620033
O -0.898893 -1.789568 0.908863
O 3.633945 -1.714427 -1.451053
N 0.928572 -0.881569 -0.205023
N -0.637941 1.161850 -1.296208
N 0.728786 1.053510 -1.613096
N 1.725127 -1.835911 0.435741
C -2.719001 0.391231 -0.207111
C -1.216383 0.241862 -0.485223
C -2.937670 0.566573 1.328129
C -3.455667 -0.893420 -0.699095
C -3.293649 1.623631 -0.947331
C -0.484487 -0.874942 0.132121
C 1.429877 0.071320 -1.056768
C 4.004399 0.740026 -0.035584
H -2.428486 1.475990 1.696850
H -4.019421 0.677301 1.526759
H -2.567873 -0.305669 1.891811
H -3.094186 -1.793101 -0.174321
H -3.320199 -1.033005 -1.787335
H -4.537934 -0.785771 -0.501128
H -3.159726 1.539634 -2.039212
H -2.797965 2.556063 -0.627919
H -4.374237 1.701138 -0.726009
H 1.118000 -2.512425 0.918717
H 2.536990 -2.136058 -0.167200
H 3.674765 1.789176 -0.014817
H 5.095431 0.655522 -0.143307
H 3.639356 0.165846 0.828279


