%chk=000212755.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212755

1 1
S -0.868429 -2.291163 -0.288921
O 0.668134 1.009188 0.941659
N 3.678093 0.137919 -0.064047
N 0.387670 -1.276026 0.363869
C 3.099791 1.139633 0.940458
C 2.895166 0.176601 -1.356507
C 5.109000 0.548688 -0.360746
C 3.684161 -1.267214 0.486552
C 1.856927 0.704450 1.720219
C -0.075821 -0.044271 0.478762
C -1.446394 0.224281 0.040220
C -2.027848 -0.978818 -0.430843
C -2.187342 1.412714 0.043208
C -3.334597 -1.018860 -0.905307
C -3.496902 1.374495 -0.432199
C -4.063545 0.173503 -0.901229
H 3.894884 1.403551 1.682529
H 2.855575 2.089612 0.396421
H 2.911056 1.178581 -1.821169
H 3.288523 -0.545003 -2.096537
H 1.829496 -0.090220 -1.195708
H 5.753154 0.479034 0.535670
H 5.566638 -0.100410 -1.132808
H 5.170805 1.586527 -0.738235
H 4.178704 -1.325980 1.470941
H 2.645960 -1.669123 0.604875
H 4.201526 -1.971341 -0.191069
H 1.868962 -0.346250 2.064750
H 1.720064 1.370335 2.605213
H -1.743571 2.337049 0.413924
H -3.782083 -1.945539 -1.266088
H -4.098864 2.285954 -0.439805
H -5.094591 0.176505 -1.266052


%chk=000212755-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212755

1 1
S -0.873111 -2.367822 -0.207643
O 0.669259 1.091169 0.853031
N 3.715448 0.128988 -0.061571
N 0.405551 -1.222881 0.384635
C 3.178160 1.109964 1.012669
C 2.903045 0.226194 -1.355624
C 5.160470 0.533296 -0.359603
C 3.684232 -1.315669 0.445301
C 1.846490 0.783622 1.695003
C -0.107981 0.011960 0.429656
C -1.478746 0.226772 0.006856
C -2.070792 -1.007392 -0.396579
C -2.231789 1.428723 -0.035901
C -3.405307 -1.071873 -0.844598
C -3.561970 1.370765 -0.485614
C -4.140663 0.132418 -0.886972
H 3.955963 1.150260 1.797161
H 3.120189 2.099415 0.527167
H 2.880098 1.275106 -1.687601
H 3.391101 -0.400688 -2.117974
H 1.888051 -0.145923 -1.166849
H 5.771120 0.392051 0.545248
H 5.548311 -0.100809 -1.171030
H 5.184837 1.589439 -0.669930
H 4.201546 -1.365431 1.416528
H 2.630817 -1.632947 0.535070
H 4.209232 -1.949341 -0.286438
H 1.787280 -0.254427 2.061776
H 1.767503 1.473684 2.553945
H -1.775833 2.371410 0.281250
H -3.864961 -2.016269 -1.150086
H -4.163982 2.283510 -0.526671
H -5.179265 0.111127 -1.232610


