%chk=000236623.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236623

0 1
S -1.798927 -2.072763 -0.015017
O 1.657453 2.199900 -0.047670
O 3.765844 1.876256 0.820519
O 2.899326 -0.566891 -1.109643
O 3.673054 -1.649872 0.797854
O -0.528058 -0.944625 0.003801
O -1.635441 -2.877824 1.167076
O -1.739377 -2.684512 -1.320783
C 1.669989 0.837617 0.404597
C 3.099365 0.620653 0.975155
C 1.546609 -0.141546 -0.785658
C 3.745479 -0.440570 0.048680
C 3.011441 2.728325 -0.096024
C 0.762167 -1.411293 -0.420477
C 2.979867 4.119403 0.497612
C 3.574329 2.610213 -1.497158
C 4.218390 -2.807400 0.128212
C -3.118320 -0.996513 0.133580
C -3.692672 -0.426427 -1.010419
C -3.625605 -0.678693 1.400652
C -4.765673 0.454809 -0.891153
C -4.698195 0.202147 1.525651
C -5.276348 0.777312 0.379371
C -6.412156 1.733920 0.510809
H 0.829682 0.761935 1.122236
H 3.169942 0.363860 2.048444
H 1.174554 0.350475 -1.706856
H 4.752979 -0.230559 -0.343074
H 1.238973 -1.952991 0.423022
H 0.668444 -2.082680 -1.296500
H 2.175298 4.717101 0.049323
H 2.790007 4.076028 1.580369
H 3.929619 4.646350 0.351408
H 4.637426 2.875957 -1.524117
H 3.484857 1.580001 -1.879072
H 3.038879 3.260764 -2.198386
H 3.953215 -3.625115 0.809147
H 5.303101 -2.706812 0.035964
H 3.741672 -2.936717 -0.849429
H -3.302936 -0.677885 -2.003912
H -3.182607 -1.128575 2.297523
H -5.207043 0.895388 -1.783693
H -5.087166 0.445923 2.512992
H -6.040248 2.767770 0.599729
H -7.086789 1.711328 -0.356888
H -7.029001 1.539427 1.399704


%chk=000236623-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236623

0 1
S -1.901400 -2.167849 0.180232
O 1.824494 2.303848 0.133450
O 4.062792 1.893992 0.742148
O 2.852833 -0.510968 -1.158341
O 3.864747 -1.721827 0.688791
O -0.550228 -0.861177 0.321731
O -1.905225 -3.094446 1.507193
O -1.744451 -2.841791 -1.288502
C 1.868431 0.893098 0.551958
C 3.364791 0.617438 0.923418
C 1.538804 -0.094582 -0.592687
C 3.834955 -0.481011 -0.058978
C 3.211455 2.795581 -0.085568
C 0.774304 -1.350208 -0.121826
C 3.314138 4.202579 0.496837
C 3.596909 2.702892 -1.569972
C 4.361472 -2.863828 -0.096827
C -3.352587 -0.989859 0.221913
C -3.764495 -0.399406 -0.983159
C -3.980086 -0.765592 1.456876
C -4.875714 0.469301 -0.935200
C -5.088394 0.108692 1.474276
C -5.546057 0.741583 0.287872
C -6.717737 1.704277 0.328527
H 1.163497 0.787233 1.391227
H 3.526805 0.294479 1.962154
H 0.981815 0.408521 -1.399156
H 4.812374 -0.266491 -0.531188
H 1.298024 -1.852578 0.710957
H 0.662415 -2.044243 -0.977272
H 2.642192 4.886625 -0.048762
H 3.025933 4.187200 1.559772
H 4.348933 4.575071 0.409216
H 4.641880 3.032507 -1.706499
H 3.494916 1.668510 -1.938363
H 2.938599 3.358669 -2.166127
H 4.322257 -3.731838 0.578086
H 5.406971 -2.688066 -0.421857
H 3.725238 -3.040809 -0.983185
H -3.251489 -0.625858 -1.922895
H -3.626154 -1.268567 2.362208
H -5.225490 0.941795 -1.859903
H -5.602982 0.300843 2.422349
H -6.366454 2.739172 0.506089
H -7.275659 1.706469 -0.623644
H -7.421975 1.453217 1.140134


