%chk=000246363.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246363

0 1
S 2.351872 1.227742 0.297499
O 1.898625 -1.367087 0.444905
N -2.472211 0.137234 -0.051664
N 0.320071 -0.199832 -0.765203
C -1.512260 1.287362 0.047289
C -1.769553 -1.159983 0.226978
C -0.386131 1.089519 -0.988787
C -0.625367 -1.357263 -0.787579
C -3.607110 0.325947 0.899743
C 1.453130 -0.319523 0.030708
C 3.845484 0.633913 1.117798
H -1.081766 1.416514 1.063335
H -2.068462 2.220160 -0.190051
H -2.508907 -1.981635 0.105805
H -1.373896 -1.230812 1.263228
H -0.822430 1.048023 -2.017277
H 0.309095 1.954457 -0.984174
H -0.071008 -2.298644 -0.569222
H -1.031099 -1.437973 -1.821652
H -4.141234 1.254722 0.640712
H -3.323515 0.373727 1.961433
H -4.324664 -0.500734 0.769323
H 4.724336 0.842923 0.496892
H 3.802866 -0.457034 1.292160
H 3.958735 1.129278 2.088803


%chk=000246363-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246363

0 1
S 2.569690 1.320948 0.248101
O 2.115258 -1.409864 0.369174
N -2.560309 0.122006 -0.080795
N 0.288970 -0.133329 -0.327071
C -1.677518 1.289303 0.152337
C -1.883082 -1.139370 0.306816
C -0.371119 1.146250 -0.655185
C -0.583386 -1.319907 -0.499134
C -3.879928 0.275847 0.561561
C 1.588005 -0.297436 0.095838
C 4.195106 0.572142 0.819965
H -1.423197 1.408891 1.237150
H -2.204462 2.204340 -0.176252
H -2.560864 -1.986267 0.091908
H -1.640094 -1.161683 1.400169
H -0.610812 1.158787 -1.736697
H 0.300799 1.990868 -0.435830
H -0.025687 -2.208087 -0.163269
H -0.829867 -1.429243 -1.573577
H -4.370863 1.191942 0.187225
H -3.825357 0.342833 1.677365
H -4.521298 -0.585155 0.301544
H 4.969729 0.794528 0.072254
H 4.030031 -0.516258 0.898190
H 4.454854 0.998916 1.799218


