%chk=000251549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251549

0 1
S 2.823860 1.474372 0.119420
O 0.590448 2.118863 -0.276343
O 0.207526 -2.488968 -0.354953
N 0.713920 -0.189355 -0.293708
N 2.953988 -1.149522 0.093053
C -1.444636 0.759499 -0.694171
C -1.548566 -0.807311 -0.721784
C -2.404290 1.158419 0.479095
C -2.558377 -1.114411 0.435236
C -2.169547 -0.018721 1.482098
C -3.807320 0.796210 -0.022683
C -3.898228 -0.546761 -0.048767
C 0.007780 1.067302 -0.403667
C -0.152053 -1.354007 -0.440247
C 2.096142 -0.160346 -0.042003
C 4.370810 0.711490 0.382509
C 4.254096 -0.644935 0.335881
H -1.753480 1.232573 -1.648889
H -1.912286 -1.198391 -1.693456
H -2.263276 2.174682 0.858602
H -2.558130 -2.154072 0.776968
H -1.147956 -0.096565 1.870694
H -2.840652 0.009956 2.350899
H -4.528597 1.541884 -0.290908
H -4.712801 -1.177410 -0.344220
H 5.256080 1.297635 0.551819
H 5.043345 -1.380711 0.463324


%chk=000251549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251549

0 1
S 3.037500 1.591635 0.166858
O 0.408305 2.327818 -0.361344
O 0.315108 -2.393588 -0.370846
N 0.727972 -0.021941 -0.307886
N 2.857903 -1.094417 0.077847
C -1.505308 0.781681 -0.720277
C -1.527162 -0.772633 -0.724927
C -2.480219 1.156620 0.482105
C -2.515716 -1.126337 0.471435
C -2.153079 0.005120 1.484569
C -3.875237 0.721805 0.011032
C -3.895991 -0.643377 0.003691
C -0.058050 1.167945 -0.456210
C -0.090661 -1.223565 -0.456401
C 2.111724 -0.011795 -0.041891
C 4.493760 0.570951 0.426678
C 4.194525 -0.776674 0.340406
H -1.838550 1.253772 -1.658097
H -1.870193 -1.227675 -1.667687
H -2.367285 2.193060 0.829038
H -2.435552 -2.168739 0.809290
H -1.103059 -0.013882 1.828264
H -2.822857 0.011929 2.358800
H -4.656847 1.404052 -0.331987
H -4.698388 -1.297482 -0.346123
H 5.456838 1.039111 0.618600
H 4.908319 -1.591996 0.458861


