%chk=000221053.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221053

0 1
S 2.029462 0.204704 -1.071605
O -3.612724 0.581560 0.480845
N 3.552069 1.269687 1.091988
C -0.200946 -0.790280 0.199694
C 0.572994 -2.017663 0.594592
C 0.380193 0.278772 -0.503274
C -1.560863 -0.709843 0.542831
C 0.446164 -3.105148 -0.471452
C -2.286982 0.431948 0.182674
C -0.363259 1.421508 -0.847947
C -1.706506 1.512202 -0.512714
C 2.904663 0.845822 0.235288
H 1.645422 -1.785409 0.769980
H 0.207357 -2.402931 1.570630
H -2.035932 -1.525701 1.078285
H -0.600331 -3.378332 -0.650922
H 0.980710 -4.013865 -0.169646
H 0.871144 -2.780473 -1.430169
H 0.116033 2.246284 -1.384462
H -2.311224 2.380504 -0.764995
H -3.981543 -0.194245 0.975979


%chk=000221053-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221053

0 1
S 2.082568 0.206593 -1.185060
O -3.706346 0.633047 0.570722
N 3.626409 0.960840 1.215225
C -0.229870 -0.766170 0.215527
C 0.551751 -2.008604 0.616166
C 0.324644 0.289251 -0.556631
C -1.589326 -0.641450 0.597144
C 0.583425 -3.076522 -0.510285
C -2.360896 0.480943 0.212143
C -0.438937 1.415325 -0.938674
C -1.790211 1.518222 -0.560352
C 2.969061 0.662817 0.257467
H 1.588519 -1.739464 0.888182
H 0.091758 -2.449683 1.519985
H -2.041772 -1.438291 1.202939
H -0.438855 -3.386458 -0.792570
H 1.136708 -3.972372 -0.175688
H 1.084254 -2.683966 -1.412622
H 0.026099 2.212948 -1.525596
H -2.400916 2.380190 -0.840862
H -4.022167 -0.128095 1.118438


