%chk=000229591.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229591

0 1
S 1.801656 -0.441896 1.061116
S -1.812382 -0.445338 -1.058363
O 1.595249 1.131029 0.475643
O -1.604530 1.130084 -0.480175
O 0.484610 -0.870543 1.507479
O 2.857668 -0.387558 2.034606
O -0.495743 -0.877219 -1.502829
O -2.868407 -0.394516 -2.032020
C -0.003944 2.865563 -0.006380
C 1.111874 3.714231 -0.662075
C -1.119092 3.718201 0.645272
C 0.599427 1.963912 1.103661
C -0.608003 1.959131 -1.112126
C 1.744578 4.742240 0.271021
C -1.750996 4.742257 -0.292698
C 2.288454 -1.205872 -0.413820
C -2.299809 -1.202097 0.420078
C 3.080092 -2.486007 -0.151226
C -3.091959 -2.483112 0.163371
C 3.539866 -3.134300 -1.466726
C -3.552067 -3.125123 1.481833
C 4.322872 -4.418911 -1.210477
C -4.335657 -4.410542 1.231487
H 1.904304 3.024356 -1.026014
H 0.710433 4.227980 -1.556800
H -0.717254 4.235877 1.537550
H -1.912067 3.030676 1.012468
H -0.187340 1.338120 1.569643
H 1.128892 2.556264 1.871421
H -1.136907 2.548232 -1.882766
H 0.178278 1.330436 -1.575028
H 2.207300 4.264648 1.143635
H 2.533388 5.302166 -0.245233
H 1.012613 5.470113 0.638632
H -1.018477 5.467829 -0.663729
H -2.214059 4.260883 -1.163051
H -2.539400 5.305212 0.220877
H 1.391803 -1.433806 -1.064840
H 2.873574 -0.517291 -1.063044
H -1.403377 -1.427373 1.072335
H -2.884752 -0.510194 1.065910
H 2.463447 -3.212670 0.417398
H 3.965802 -2.267961 0.484757
H -2.475588 -3.212662 -0.401850
H -3.977550 -2.267648 -0.473654
H 4.164515 -2.422580 -2.041490
H 2.661380 -3.349877 -2.107751
H -4.176404 -2.410474 2.053292
H -2.673696 -3.338148 2.123870
H 3.718205 -5.165525 -0.682595
H 4.653160 -4.873918 -2.151726
H 5.218482 -4.235324 -0.605165
H -3.731326 -5.159852 0.707051
H -4.666159 -4.861066 2.174816
H -5.231179 -4.229332 0.625330


%chk=000229591-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229591

0 1
S 1.862289 -0.382115 1.298340
S -1.878621 -0.386004 -1.291295
O 1.710486 1.363978 0.595433
O -1.723212 1.362509 -0.594667
O 0.372007 -0.869673 1.750181
O 3.052696 -0.452714 2.387293
O -0.389322 -0.877117 -1.742654
O -3.069870 -0.458379 -2.379226
C -0.004452 3.028872 -0.006008
C 1.121895 3.890152 -0.664869
C -1.126335 3.901357 0.645509
C 0.568433 2.136893 1.128804
C -0.580691 2.130609 -1.134041
C 1.849977 4.867623 0.283462
C -1.849848 4.873677 -0.311569
C 2.395463 -1.205758 -0.364864
C -2.411474 -1.204451 0.374503
C 2.879984 -2.633866 -0.125347
C -2.894001 -2.633948 0.139097
C 3.322873 -3.266593 -1.472886
C -3.334787 -3.264122 1.488515
C 3.802411 -4.722424 -1.288230
C -3.811496 -4.721373 1.307761
H 1.868303 3.201494 -1.106535
H 0.681600 4.461440 -1.505750
H -0.682557 4.478185 1.480748
H -1.875897 3.220432 1.093786
H -0.218646 1.441686 1.482787
H 0.921132 2.755858 1.973793
H -0.933267 2.744651 -1.982654
H 0.204970 1.432017 -1.484508
H 2.364054 4.333189 1.101915
H 2.619629 5.431513 -0.274472
H 1.159663 5.605016 0.732121
H -1.155918 5.603450 -0.767021
H -2.366677 4.334293 -1.124995
H -2.616604 5.446401 0.241321
H 1.472825 -1.119186 -0.966100
H 3.181761 -0.519347 -0.719729
H -1.489093 -1.115028 0.975693
H -3.198696 -0.517853 0.726941
H 2.068234 -3.244952 0.313792
H 3.726922 -2.641290 0.586598
H -2.081564 -3.244819 -0.299085
H -3.741421 -2.644556 -0.572239
H 4.137147 -2.659543 -1.916157
H 2.477853 -3.237759 -2.188123
H -4.149972 -2.657602 1.930821
H -2.489350 -3.231862 2.203123
H 2.997523 -5.356422 -0.872430
H 4.113259 -5.161030 -2.253466
H 4.664825 -4.774701 -0.598281
H -3.005604 -5.354729 0.892922
H -4.120746 -5.158265 2.274285
H -4.674295 -4.777109 0.618562


