%chk=000272623.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272623

0 1
S -3.606610 -0.763139 -0.908455
O -4.603965 -0.228387 0.330312
O -4.103597 -0.100396 -2.073736
O -3.485119 -2.190890 -0.807286
N -2.124970 -0.058289 -0.419977
C 0.460467 -0.116037 -0.648434
C -0.914808 -0.812368 -0.711320
C -0.119666 -0.569769 -1.986858
C 0.563898 1.346979 -0.352462
C 1.603553 -0.884767 -0.060068
C 1.128754 2.218170 -1.295389
C 1.492775 -1.441512 1.222252
C 0.119409 1.845762 0.881393
C 2.794382 -1.030213 -0.786590
C 1.240207 3.580893 -1.006243
C 2.568643 -2.144959 1.770689
C 0.232946 3.209339 1.164005
C 3.866308 -1.734545 -0.232116
C 0.791504 4.078692 0.221336
C 3.755159 -2.293482 1.045293
C -4.497285 -0.930432 1.578189
H -0.983877 -1.849633 -0.329026
H 0.324864 -1.417104 -2.506453
H -0.449712 0.176969 -2.706299
H -2.010820 0.961581 -0.531919
H 1.485109 1.831678 -2.248771
H 0.571449 -1.323291 1.789623
H -0.310193 1.166868 1.617178
H 2.882315 -0.590941 -1.778656
H 1.679509 4.256116 -1.739140
H 2.482046 -2.577817 2.766042
H -0.112267 3.594947 2.122135
H 4.790729 -1.847163 -0.796451
H 0.879320 5.140498 0.443785
H 4.591264 -2.842057 1.474547
H -4.619621 -2.011702 1.430710
H -5.334364 -0.527746 2.166513
H -3.541534 -0.694255 2.059643


%chk=000272623-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272623

0 1
S -3.481711 -0.663222 -1.012739
O -4.632370 0.368534 0.020667
O -3.435129 0.066109 -2.453191
O -3.848004 -2.229742 -0.897653
N -1.954844 -0.371177 0.068113
C 0.559132 -0.290079 -0.531014
C -0.778862 -1.081203 -0.393426
C -0.134717 -0.834070 -1.780210
C 0.530662 1.207743 -0.275321
C 1.809228 -0.986712 -0.025446
C 0.608694 2.142916 -1.337656
C 1.838681 -1.629800 1.236777
C 0.460280 1.692593 1.058552
C 2.993053 -0.948532 -0.805315
C 0.623143 3.531772 -1.075073
C 3.029639 -2.223015 1.712931
C 0.468396 3.079091 1.321936
C 4.184145 -1.539249 -0.330853
C 0.552403 4.004535 0.254818
C 4.206895 -2.177583 0.931685
C -5.161752 -0.374864 1.184639
H -0.717039 -2.098432 0.000644
H 0.295124 -1.710123 -2.273963
H -0.654775 -0.133210 -2.440598
H -1.841262 0.663460 0.061287
H 0.660385 1.784336 -2.371789
H 0.926144 -1.672951 1.843601
H 0.408035 0.979861 1.889800
H 2.977703 -0.452236 -1.782940
H 0.685486 4.241974 -1.906890
H 3.038366 -2.720438 2.689229
H 0.409639 3.437895 2.355461
H 5.092362 -1.503550 -0.942895
H 0.559768 5.081002 0.457947
H 5.130610 -2.637627 1.299806
H -5.707673 -1.280722 0.867894
H -5.858426 0.344274 1.647791
H -4.355205 -0.639957 1.891390


