%chk=000231333.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231333

0 1
S 3.017406 1.341320 -0.313729
O -0.139208 -2.522815 -0.502536
N 0.363260 1.522031 -0.129788
N 1.261796 -0.697440 -0.408943
C -3.305471 0.696679 0.028575
C -2.192534 1.780126 0.064273
C -2.608556 -0.680426 -0.155304
C -0.929095 0.982296 -0.098749
C -1.145302 -0.362874 -0.219519
C -0.050556 -1.323863 -0.387503
C 1.416518 0.587759 -0.290806
C 4.126977 -0.044308 -0.602928
H -4.009721 0.890010 -0.796674
H -3.894496 0.713784 0.959786
H -2.206053 2.342521 1.015296
H -2.321781 2.519447 -0.746648
H -2.946267 -1.192655 -1.075419
H -2.830962 -1.368844 0.681137
H 0.522779 2.520974 -0.041787
H 4.020050 -0.444496 -1.621822
H 3.925482 -0.881999 0.086531
H 5.157736 0.300075 -0.453141


%chk=000231333-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231333

0 1
S 3.055223 1.442707 -0.483243
O -0.154175 -2.570131 -0.381035
N 0.357183 1.510986 -0.157041
N 1.268358 -0.681639 -0.439383
C -3.305369 0.706423 -0.119186
C -2.196684 1.775558 0.174484
C -2.615009 -0.694267 0.010024
C -0.929466 0.985262 -0.068721
C -1.144701 -0.373229 -0.155593
C -0.029998 -1.313650 -0.328217
C 1.413194 0.614790 -0.353162
C 4.143969 -0.072667 -0.723545
H -3.673515 0.841040 -1.151715
H -4.167100 0.814846 0.560434
H -2.236163 2.128046 1.224975
H -2.287538 2.666898 -0.474146
H -2.969920 -1.414672 -0.747320
H -2.799485 -1.160894 0.997442
H 0.529897 2.516896 -0.098732
H 4.652307 0.013974 -1.693867
H 3.458006 -0.938878 -0.708156
H 4.862987 -0.120096 0.106005


