%chk=000284382.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284382

0 1
S -2.803475 -1.223832 1.329674
S 3.610298 2.091676 -0.261596
O -3.281765 -2.488794 0.794567
O -3.196123 -0.869976 2.683867
O 3.979899 0.447728 0.096989
O 3.644506 2.203577 -1.687366
O 2.411509 2.408190 0.460303
N -1.098995 -0.279397 -1.029245
C -0.613199 -1.425553 -0.206607
C -1.029018 -1.284340 1.254562
C -3.155532 0.063510 0.261092
C -2.281559 0.411160 -0.786503
C 0.900931 -1.528922 -0.328345
C -4.343118 0.796424 0.435970
C -2.606307 1.500104 -1.651344
C 1.713813 -0.419943 -0.060714
C 1.471126 -2.753719 -0.697238
C -4.665258 1.848894 -0.407235
C -3.785627 2.194197 -1.454425
C 3.099590 -0.568868 -0.184965
C 2.862890 -2.879308 -0.798422
C 3.694354 -1.789300 -0.549503
C 5.017378 2.760897 0.483396
H -1.092873 -2.361204 -0.633541
H -0.627614 -2.129170 1.850753
H -0.565825 -0.397532 1.733145
H -0.448459 0.084731 -1.724224
H -5.016820 0.533268 1.259909
H -1.932540 1.775700 -2.457240
H 1.271188 0.527662 0.263604
H 0.838383 -3.616304 -0.904044
H -5.584819 2.409478 -0.267048
H -4.043766 3.025018 -2.114484
H 3.299098 -3.838848 -1.080372
H 4.776522 -1.862219 -0.627911
H 4.791340 3.453117 1.312840
H 5.679467 1.992527 0.927765
H 5.662802 3.322771 -0.213262


%chk=000284382-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284382

0 1
S -3.078338 -1.574930 1.059805
S 4.077872 1.856578 -0.961873
O -3.386004 -2.804651 0.016445
O -3.828711 -1.523988 2.511426
O 3.987534 0.421504 0.457135
O 5.161993 1.524610 -2.120007
O 2.549398 2.237906 -1.370937
N -0.970643 -0.078893 -0.760707
C -0.603577 -1.394780 -0.201473
C -1.149216 -1.550447 1.232181
C -3.261361 0.084676 0.205310
C -2.196494 0.569457 -0.606311
C 0.916024 -1.563517 -0.200203
C -4.461762 0.785569 0.412418
C -2.423221 1.823522 -1.254338
C 1.755655 -0.483183 0.147228
C 1.495284 -2.814485 -0.536234
C -4.656986 2.020549 -0.236992
C -3.629163 2.522245 -1.076631
C 3.166563 -0.646665 0.119874
C 2.901290 -2.979806 -0.537867
C 3.747353 -1.893980 -0.237314
C 4.782663 3.137966 0.246492
H -1.054832 -2.214964 -0.803566
H -0.894629 -2.522944 1.678608
H -0.920492 -0.708433 1.903243
H -0.314459 0.323582 -1.432080
H -5.217906 0.364630 1.084228
H -1.632885 2.241231 -1.889776
H 1.338865 0.491573 0.419235
H 0.846651 -3.654867 -0.810618
H -5.585423 2.580626 -0.094836
H -3.767692 3.478687 -1.592685
H 3.333966 -3.950209 -0.801707
H 4.837496 -1.984860 -0.266858
H 4.029163 3.249771 1.036017
H 5.720179 2.707203 0.621256
H 4.938245 4.057116 -0.335087


