%chk=000287007.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287007

0 1
S -3.229703 1.515508 -0.014435
O 0.499470 -1.290376 0.012013
N -0.582600 0.756845 -0.001040
N -2.377241 -0.943480 0.012947
N -3.723752 -1.010646 0.010920
C 3.090912 -0.202575 0.003411
C 1.865339 0.722844 0.005453
C 4.397631 0.599678 0.004833
C 0.591364 -0.094696 0.006147
C 5.613508 -0.323146 0.002878
C -1.892141 0.304484 0.000869
C -4.356737 0.142262 -0.002215
H 3.052683 -0.878653 0.882492
H 3.052494 -0.875152 -0.878270
H 1.899146 1.389793 -0.881471
H 1.899931 1.387206 0.894438
H 4.436078 1.263783 0.890758
H 4.435880 1.267301 -0.878442
H 5.629725 -0.975393 0.884337
H 6.547278 0.250859 0.003980
H 5.629609 -0.971852 -0.881181
H -0.455330 1.772473 -0.008311
H -5.428642 0.282932 -0.005710


%chk=000287007-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287007

0 1
S -3.251966 1.630097 -0.019240
O 0.495704 -1.400012 0.016573
N -0.601756 0.689806 -0.000708
N -2.413069 -0.938722 0.016137
N -3.819195 -0.984172 0.013254
C 3.114526 -0.222045 0.002874
C 1.855317 0.665556 0.006000
C 4.416994 0.609242 0.005313
C 0.554613 -0.151791 0.008217
C 5.681181 -0.277313 0.001954
C -1.937932 0.304186 0.001008
C -4.395612 0.207509 -0.003617
H 3.091657 -0.890568 0.883940
H 3.091573 -0.885005 -0.882451
H 1.861308 1.332100 -0.882087
H 1.864384 1.329581 0.895981
H 4.432336 1.270979 0.895889
H 4.431979 1.277192 -0.880616
H 5.706397 -0.933369 0.891885
H 6.602713 0.332673 0.004143
H 5.706320 -0.926827 -0.892773
H -0.418126 1.695392 -0.009378
H -5.474444 0.355512 -0.007896


