%chk=000294590.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294590

0 1
S 1.300121 1.281995 1.430197
O 3.699515 -1.608790 -0.549675
O 1.942409 -0.518832 -1.411523
N 4.717237 1.124412 -0.780907
N -2.775023 -1.377109 0.552417
C -1.185163 0.295781 1.351226
C 2.560116 1.804610 0.234476
C -0.135802 0.843998 0.393705
C 3.569669 0.671138 0.059257
C -2.450722 -0.055211 0.609045
C 2.934453 -0.478460 -0.728812
C -3.257274 0.940145 0.018843
C -4.418533 0.553938 -0.651675
C -3.909889 -1.734689 -0.103410
C -4.757517 -0.801507 -0.720246
H 3.042749 2.717482 0.636230
H 2.112111 2.094450 -0.738944
H -1.424863 1.026951 2.154178
H -0.795084 -0.608988 1.877840
H 3.888991 0.268861 1.062592
H 0.150713 0.087362 -0.371006
H -0.495410 1.733321 -0.153727
H -2.976789 1.987576 0.088344
H 5.476433 0.446280 -0.743681
H 5.078650 2.016315 -0.457867
H -5.057538 1.303539 -1.118333
H -4.130335 -2.808395 -0.124986
H -5.655175 -1.127032 -1.237876
H 3.351052 -2.395341 -1.048882


%chk=000294590-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294590

0 1
S 1.317154 1.349875 1.479234
O 4.167523 -1.638634 -0.585460
O 2.062507 -0.852191 -1.158118
N 4.807065 1.118541 -0.790056
N -2.703711 -1.281275 0.335991
C -1.338200 0.451735 1.424451
C 2.580286 1.702293 0.113412
C -0.200040 0.835871 0.452158
C 3.682566 0.629287 0.042816
C -2.583495 0.047586 0.653537
C 3.169215 -0.652128 -0.620915
C -3.554771 1.004468 0.257199
C -4.678519 0.583971 -0.487384
C -3.794509 -1.673208 -0.384479
C -4.804822 -0.784893 -0.818564
H 3.032854 2.679853 0.353446
H 2.050876 1.781559 -0.849173
H -1.560628 1.304739 2.092927
H -1.014667 -0.402559 2.044131
H 3.979374 0.355482 1.082897
H 0.092493 -0.012521 -0.184680
H -0.488440 1.695449 -0.178080
H -3.427280 2.056339 0.535452
H 5.536180 0.416523 -0.951000
H 5.182384 2.020249 -0.481226
H -5.440441 1.306423 -0.799696
H -3.852194 -2.743809 -0.614345
H -5.659641 -1.156521 -1.392451
H 3.839983 -2.458706 -1.045222


