%chk=000294944.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294944

0 1
S 2.018255 -1.116227 1.184222
O -2.349425 0.089229 -1.195523
O 1.961225 2.555343 1.369364
O 1.444147 1.924954 -0.741666
O -2.450235 1.672514 0.471898
N -0.624123 0.233175 0.245812
C 0.225492 0.962993 1.202321
C 0.936393 -0.015624 2.134378
C 3.645057 -0.293775 1.263066
C 1.245455 1.828386 0.441511
C 4.346761 -0.700145 0.008782
C -1.863829 0.775216 -0.101990
C -3.732456 0.382085 -1.584762
C 5.317318 -1.714071 0.043165
C 4.042481 -0.070179 -1.209238
C -4.679291 -0.437629 -0.756802
C 5.980992 -2.087206 -1.128878
C 4.709160 -0.449084 -2.376295
C -5.179667 -1.651347 -1.248386
C -5.066103 0.015335 0.513624
C 5.680472 -1.455376 -2.339223
C -6.072868 -2.400800 -0.476884
C -5.957195 -0.737909 1.281181
C -6.463507 -1.944635 0.786014
C 2.918933 3.519445 0.852366
H -0.426069 1.665178 1.813315
H 1.489886 0.529806 2.923635
H 0.194478 -0.661067 2.655339
H -0.165091 -0.433811 -0.384717
H 4.179363 -0.621772 2.175578
H 3.538666 0.806438 1.342857
H -3.705530 0.090820 -2.652402
H -3.910939 1.470602 -1.488559
H 5.552167 -2.215944 0.979792
H 3.273814 0.706176 -1.253081
H 6.732483 -2.874379 -1.097824
H 4.467281 0.039768 -3.319222
H -4.871019 -2.015602 -2.226953
H -4.656299 0.952905 0.902278
H 6.197703 -1.747629 -3.250661
H -6.462001 -3.342483 -0.859988
H -6.256344 -0.384804 2.266728
H -7.159413 -2.529520 1.384862
H 3.496938 3.787553 1.742845
H 2.368838 4.376759 0.451103
H 3.541947 3.061035 0.076620


%chk=000294944-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294944

0 1
S 2.104651 -1.249144 1.476859
O -2.135237 -0.115279 -1.008050
O 1.739704 2.954951 1.701086
O 1.559605 2.098711 -0.458900
O -2.288169 1.736795 0.454046
N -0.448456 0.281004 0.458179
C 0.318467 1.035284 1.434282
C 1.107234 0.087131 2.378581
C 3.753955 -0.315046 1.110089
C 1.251594 2.058120 0.750867
C 4.370010 -0.816041 -0.173551
C -1.671789 0.728435 0.011900
C -3.496773 0.216550 -1.550103
C 5.380800 -1.810777 -0.143680
C 3.943509 -0.301750 -1.427510
C -4.591946 -0.519236 -0.808291
C 5.958962 -2.285380 -1.343021
C 4.524113 -0.773489 -2.624465
C -5.070518 -1.766235 -1.283867
C -5.157177 0.034386 0.370305
C 5.532041 -1.766955 -2.586912
C -6.094468 -2.453552 -0.594333
C -6.179972 -0.652162 1.060890
C -6.651867 -1.896724 0.580262
C 2.641307 4.017494 1.186579
H -0.387565 1.623743 2.049638
H 1.780811 0.662215 3.033479
H 0.392860 -0.478356 2.998704
H 0.014047 -0.501536 -0.014923
H 4.407853 -0.487441 1.979733
H 3.497975 0.753513 1.047474
H -3.426830 -0.103963 -2.601448
H -3.625649 1.310730 -1.485670
H 5.713788 -2.214172 0.820737
H 3.157470 0.462173 -1.459416
H 6.739224 -3.053919 -1.306626
H 4.191160 -0.367895 -3.586490
H -4.638003 -2.199840 -2.194148
H -4.779644 0.994225 0.740883
H 5.979767 -2.132346 -3.518027
H -6.458058 -3.416074 -0.971382
H -6.611453 -0.217051 1.969396
H -7.448104 -2.427027 1.115074
H 2.892522 4.623016 2.067984
H 2.117688 4.617937 0.424713
H 3.544864 3.569676 0.738672


