%chk=000284388.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284388

0 1
S -1.740899 -0.271646 -1.722642
O -1.826461 -1.712746 -1.598708
O -2.256843 0.321572 -2.949609
N -0.329171 0.892014 0.759996
C 0.546431 0.154416 -0.204161
C -0.040429 0.232898 -1.615449
C 0.710300 -1.322558 0.186889
C 1.901085 0.879155 -0.093823
C -2.467420 0.498658 -0.376438
C -1.717135 0.987139 0.705940
C -3.864311 0.661503 -0.372016
C 1.713973 -2.068581 -0.456328
C 2.788209 0.532073 0.938148
C -0.103215 -1.947327 1.137873
C 2.245324 1.918556 -0.967810
C -2.376454 1.634386 1.794240
C -4.509692 1.287656 0.684927
C -3.752781 1.774201 1.769038
C 1.900656 -3.416004 -0.146693
C 4.006615 1.200812 1.077185
C 0.086617 -3.300030 1.447031
C 3.466037 2.585893 -0.829502
C 1.086368 -4.035891 0.808564
C 4.350032 2.227864 0.192015
H 0.057941 1.262934 -2.027486
H 0.578358 -0.378846 -2.307298
H 0.146731 1.264792 1.582842
H -4.450149 0.293050 -1.222316
H 2.353256 -1.594915 -1.201091
H 2.536344 -0.272715 1.631549
H -0.906836 -1.405618 1.635461
H 1.558915 2.217432 -1.763606
H -1.801376 2.015845 2.632164
H -5.589402 1.407304 0.680885
H -4.264056 2.267619 2.598286
H 2.675345 -3.987989 -0.654674
H 4.690908 0.919268 1.876743
H -0.561130 -3.779975 2.179332
H 3.725499 3.388041 -1.519514
H 1.226498 -5.089388 1.043940
H 5.301417 2.746849 0.299217


%chk=000284388-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284388

0 1
S -1.534814 -0.262729 -2.064789
O -1.553998 -1.895707 -2.122481
O -2.068094 0.559551 -3.378809
N -0.338113 1.076843 0.600221
C 0.623952 0.257870 -0.180941
C 0.253770 0.383607 -1.680580
C 0.646919 -1.221388 0.295809
C 2.016987 0.939037 -0.023529
C -2.441534 0.384916 -0.546204
C -1.731431 0.964992 0.540377
C -3.845979 0.319448 -0.596145
C 1.164005 -2.256043 -0.524311
C 3.190903 0.208157 0.281326
C 0.201978 -1.554153 1.597796
C 2.116710 2.344954 -0.214679
C -2.524796 1.500786 1.600694
C -4.604791 0.844478 0.468471
C -3.928322 1.440564 1.562356
C 1.233679 -3.584567 -0.055347
C 4.436255 0.867732 0.393866
C 0.269147 -2.883445 2.071110
C 3.359638 3.002099 -0.099897
C 0.787453 -3.905905 1.246410
C 4.527629 2.264087 0.203264
H 0.198156 1.432102 -2.007196
H 0.897932 -0.204869 -2.348221
H 0.047231 1.522502 1.433991
H -4.334614 -0.124875 -1.469687
H 1.505012 -2.046032 -1.542937
H 3.135437 -0.872101 0.442149
H -0.217824 -0.778431 2.245956
H 1.215978 2.926359 -0.443170
H -2.019052 1.962538 2.458123
H -5.697161 0.798079 0.444199
H -4.502340 1.859637 2.396042
H 1.620763 -4.369635 -0.713717
H 5.333764 0.287438 0.634600
H -0.089764 -3.118931 3.079147
H 3.417486 4.085918 -0.248933
H 0.832761 -4.939281 1.607194
H 5.494178 2.772101 0.291576


