%chk=000275670.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275670

0 1
S 2.625954 0.698573 -0.405610
O 2.874905 1.390967 -1.641760
O 3.543945 0.784106 0.699481
O 0.505123 2.164841 0.471438
O -4.381960 0.855534 -0.785824
O -3.962409 -0.836147 0.619790
N 0.238140 -0.114970 0.244071
C 0.945662 -1.406432 -0.100678
C 2.285962 -1.003543 -0.759482
C 0.950949 1.078059 0.185830
C 0.091141 -2.223716 -1.075488
C 1.196026 -2.190637 1.194409
C -1.162983 -0.125803 0.724724
C -2.108310 0.448319 -0.345400
C -3.523745 0.050074 -0.076522
H 3.103941 -1.668217 -0.416779
H 2.262771 -1.181604 -1.854399
H -0.161298 -1.658304 -1.980858
H 0.617147 -3.132981 -1.393380
H -0.856121 -2.549711 -0.625651
H 1.711773 -3.137976 0.997095
H 1.813606 -1.627772 1.908661
H 0.262863 -2.440351 1.714793
H -1.467954 -1.160858 1.002594
H -1.231268 0.495892 1.651465
H -1.818446 0.113539 -1.366492
H -2.008261 1.561472 -0.388703
H -5.339354 0.623244 -0.639425


%chk=000275670-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275670

0 1
S 2.803340 0.676209 -0.222122
O 3.398796 1.612579 -1.418863
O 3.673315 0.377486 1.137719
O 0.395320 2.202507 0.534156
O -4.506189 0.863746 -0.888781
O -4.039946 -0.510148 0.926936
N 0.189512 -0.129120 0.165366
C 0.956970 -1.412749 -0.134166
C 2.218919 -1.017689 -0.936797
C 0.815102 1.075853 0.240634
C 0.098056 -2.349293 -1.017470
C 1.337870 -2.093241 1.205713
C -1.231476 -0.174491 0.617099
C -2.193015 0.382443 -0.453009
C -3.637512 0.181031 -0.035543
H 3.049518 -1.723698 -0.800207
H 2.015503 -0.805467 -1.997569
H -0.240259 -1.838696 -1.936121
H 0.707334 -3.220617 -1.315241
H -0.781993 -2.735853 -0.475234
H 1.811049 -3.071921 1.009773
H 2.050783 -1.468519 1.772517
H 0.440514 -2.269632 1.824494
H -1.495460 -1.211850 0.870658
H -1.321739 0.423635 1.541070
H -2.045274 -0.124591 -1.425160
H -2.013018 1.457688 -0.627836
H -5.448222 0.709997 -0.604114


