%chk=000210817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210817

0 1
S -1.095958 1.291370 -1.716171
O 3.772337 -1.285033 -0.581594
N 1.357141 0.033536 0.219295
C 0.188177 0.315179 1.129214
C 0.052175 1.836998 1.390625
C 2.648138 0.246450 0.960504
C 1.332298 -1.361695 -0.331850
C -1.111982 -0.272243 0.602162
C 0.269064 2.746683 0.177093
C 3.814335 0.041532 -0.019734
C 2.532064 -1.537646 -1.275811
C -0.935796 2.818502 -0.743676
C -1.748183 0.113478 -0.581972
C -1.717772 -1.276598 1.383515
C -2.948081 -0.484710 -0.989170
C -2.911044 -1.878354 0.983810
C -3.528489 -1.485917 -0.209075
H 0.373430 -0.155316 2.141289
H 0.781218 2.121167 2.175997
H -0.947049 2.026231 1.832283
H 2.766464 -0.436816 1.829032
H 2.669011 1.285770 1.350044
H 0.393550 -1.500288 -0.912868
H 1.351334 -2.140658 0.459125
H 0.517017 3.768015 0.533825
H 1.162285 2.403184 -0.394094
H 3.791954 0.780310 -0.840561
H 4.794216 0.056541 0.487317
H 2.653456 -2.583353 -1.606130
H 2.465628 -0.861564 -2.147197
H -1.871253 3.018139 -0.190448
H -0.823277 3.631637 -1.489189
H -1.247404 -1.594218 2.313601
H -3.434031 -0.168601 -1.914823
H -3.361922 -2.654503 1.600301
H -4.458550 -1.954807 -0.524367


%chk=000210817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210817

0 1
S -1.063580 1.315747 -1.830371
O 3.837225 -1.292640 -0.608404
N 1.350421 -0.013567 0.235121
C 0.183544 0.290151 1.121916
C 0.108644 1.816054 1.453992
C 2.648446 0.298883 0.889848
C 1.375558 -1.411446 -0.271248
C -1.139159 -0.278024 0.585392
C 0.297942 2.786204 0.267445
C 3.808596 0.084623 -0.097374
C 2.544694 -1.593013 -1.250304
C -0.875393 2.843488 -0.721573
C -1.759821 0.088935 -0.645526
C -1.796048 -1.251172 1.385298
C -2.965423 -0.535571 -1.052741
C -3.000449 -1.869999 0.986034
C -3.583876 -1.519297 -0.250818
H 0.338582 -0.220535 2.110205
H 0.879440 2.045434 2.215370
H -0.866210 2.005532 1.944870
H 2.809374 -0.341749 1.795646
H 2.661161 1.353806 1.217320
H 0.430830 -1.625610 -0.799058
H 1.478781 -2.149534 0.564744
H 0.442155 3.809256 0.674804
H 1.215751 2.518093 -0.286927
H 3.703473 0.796842 -0.944894
H 4.782006 0.238144 0.398096
H 2.620378 -2.640187 -1.586952
H 2.398023 -0.925231 -2.126117
H -1.841804 2.994574 -0.209483
H -0.733883 3.661280 -1.450646
H -1.334914 -1.539182 2.337932
H -3.422247 -0.228414 -1.999314
H -3.471870 -2.619673 1.630771
H -4.515843 -1.989800 -0.582752


