%chk=000279787.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279787

0 1
S -1.360644 0.832621 1.602439
S 1.596386 1.113084 0.977877
O -2.239718 -0.232057 2.054121
O -1.040628 1.913481 2.502551
O 1.060454 2.234508 0.219287
O 2.245417 1.302418 2.252062
O -1.894145 -2.280174 -0.232937
O -0.468974 -2.988221 1.391657
C 0.215076 0.010468 1.234336
C 0.024241 -0.967759 0.095372
C -1.959561 1.442083 0.107434
C 2.710555 0.269369 -0.052870
C -0.770297 -2.182987 0.547178
C -1.576935 2.708518 -0.345413
C 2.744760 0.553877 -1.421975
C -2.884401 0.684324 -0.626028
C 3.620066 -0.639090 0.497559
C -2.110590 3.213573 -1.538443
C 3.665525 -0.096074 -2.248238
C -3.415290 1.186565 -1.813473
C 4.541404 -1.291641 -0.327286
C -3.027703 2.455440 -2.268128
C 4.561747 -1.020910 -1.699806
C -2.867164 -3.329057 0.095337
C -2.363804 -4.674648 -0.379306
H 0.450381 -0.585233 2.168834
H 0.995833 -1.369136 -0.284517
H -0.457000 -0.494609 -0.792604
H -0.846621 3.307181 0.223111
H 2.057242 1.295741 -1.845559
H -3.187081 -0.308318 -0.264303
H 3.623669 -0.833666 1.575886
H -1.806693 4.198806 -1.889399
H 3.692381 0.124323 -3.314608
H -4.132962 0.599513 -2.382872
H 5.247878 -2.002225 0.100951
H -3.447115 2.849742 -3.194575
H 5.282785 -1.527325 -2.343534
H -3.751465 -2.968635 -0.460150
H -3.048470 -3.295019 1.186295
H -3.130258 -5.450730 -0.263654
H -2.067350 -4.650835 -1.434823
H -1.484335 -4.995289 0.201213


%chk=000279787-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279787

0 1
S -1.451122 0.989539 1.618598
S 1.680728 1.202356 0.761961
O -2.447586 -0.240940 2.049581
O -1.025318 2.166044 2.653500
O 1.155486 2.328769 -0.303260
O 2.311786 1.578847 2.214564
O -1.956697 -2.517692 -0.320520
O -0.411292 -2.916355 1.387814
C 0.168838 -0.027970 1.085958
C -0.151061 -0.952140 -0.076270
C -2.199408 1.761533 0.052353
C 2.960295 0.129906 -0.155009
C -0.836260 -2.223762 0.437693
C -1.773685 3.042589 -0.332581
C 3.017842 0.225806 -1.554931
C -3.219853 1.035256 -0.584272
C 3.835561 -0.646390 0.621672
C -2.419263 3.626268 -1.447068
C 4.011127 -0.531561 -2.219314
C -3.846820 1.639240 -1.699151
C 4.818151 -1.399475 -0.063263
C -3.445890 2.927352 -2.126253
C 4.900047 -1.344152 -1.475389
C -2.738482 -3.730183 0.102465
C -2.135423 -5.005843 -0.489275
H 0.452887 -0.545184 2.019894
H 0.797400 -1.275989 -0.550457
H -0.759003 -0.459474 -0.852363
H -0.976016 3.558440 0.207829
H 2.333490 0.891316 -2.092349
H -3.520031 0.052870 -0.205079
H 3.770178 -0.640476 1.714715
H -2.116821 4.623877 -1.781108
H 4.093138 -0.480342 -3.309925
H -4.647901 1.107782 -2.223178
H 5.519625 -2.018404 0.505376
H -3.940545 3.391493 -2.986551
H 5.667375 -1.926464 -1.996716
H -3.748133 -3.525508 -0.286541
H -2.752625 -3.756040 1.205536
H -2.778843 -5.868478 -0.235143
H -2.068205 -4.940140 -1.589029
H -1.131076 -5.194324 -0.075516


