%chk=000202691.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202691

0 1
S -4.203412 -0.694816 -0.439440
S -1.811478 -2.279642 -1.362523
O -2.043566 2.425303 0.330059
O -0.133773 -0.336666 1.609836
N -1.812305 0.256704 -0.512074
N -0.418303 0.334764 -0.587782
N 4.566619 -0.182015 -0.334710
C -4.005276 0.996953 0.185262
C -2.556891 1.378575 0.059022
C -2.487747 -0.936873 -0.782950
C 0.357357 -0.103385 0.532926
C 1.822463 -0.121289 0.205917
C 2.571464 1.056685 0.275067
C 2.438338 -1.329754 -0.133768
C 3.948029 0.979751 -0.002538
C 3.819568 -1.314297 -0.395598
H -4.333640 1.060823 1.247519
H -4.652657 1.702906 -0.379033
H -0.054483 0.229751 -1.547247
H 2.106599 2.005987 0.541509
H 1.871340 -2.259023 -0.185138
H 4.586101 1.871728 0.039747
H 4.356754 -2.233070 -0.663465


%chk=000202691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202691

0 1
S -4.352190 -0.281159 -0.942579
S -1.997165 -1.286147 -2.694887
O -1.885850 1.958231 1.251365
O -0.248418 -0.926380 1.247598
N -1.836325 0.421433 -0.544536
N -0.446711 0.442669 -0.634203
N 4.621670 -0.181024 -0.198930
C -3.963280 0.834155 0.540084
C -2.477762 1.163972 0.496715
C -2.598658 -0.393710 -1.409455
C 0.302805 -0.286799 0.314730
C 1.788789 -0.214993 0.110992
C 2.435978 0.876347 -0.521774
C 2.584588 -1.278353 0.602847
C 3.843420 0.846359 -0.650888
C 3.982907 -1.220209 0.421444
H -4.196485 0.293374 1.471041
H -4.561792 1.755287 0.480905
H -0.061717 0.703868 -1.545931
H 1.879197 1.753980 -0.866404
H 2.110585 -2.120000 1.116266
H 4.378552 1.675737 -1.126177
H 4.628962 -2.027539 0.782374


