%chk=000284164.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284164

0 1
S 2.429705 0.922693 1.453774
S -3.166926 -1.084108 -0.066723
O 0.091994 -3.418227 0.625866
O 2.518697 0.227580 2.725344
O 1.984993 2.294792 1.432073
O -3.403069 -2.024711 1.009878
O -3.419046 -1.462415 -1.436427
O 2.144216 -2.736273 -0.028388
N 1.298832 -0.057526 0.564924
N -1.495742 -0.642536 0.099113
C 0.680979 -1.204372 1.249833
C -0.844591 -1.024256 1.378129
C 0.636378 0.393150 -0.622081
C -0.725352 0.031432 -0.883412
C 1.092056 -2.489126 0.512337
C 1.352565 1.138912 -1.567281
C -1.282108 0.368615 -2.128712
C 3.902094 0.786699 0.574300
C -3.991882 0.391369 0.285598
C 0.752977 1.516417 -2.772687
C -0.550946 1.115053 -3.056312
C 4.684918 1.935729 0.388367
C 4.335238 -0.444387 0.072764
C -4.304055 1.292365 -0.737128
C -4.357996 0.676380 1.606281
C 5.901189 1.850579 -0.289414
C 5.555477 -0.528927 -0.608234
C -4.970451 2.484926 -0.439549
C -5.024116 1.867477 1.905845
C 0.315086 -4.712954 0.001793
C 6.337536 0.614643 -0.786152
C -5.326780 2.772968 0.882225
H 1.113242 -1.306342 2.301102
H -1.300094 -1.979854 1.759304
H -1.041139 -0.228890 2.137176
H 2.386664 1.429289 -1.386060
H -2.278154 0.021409 -2.419505
H 1.315712 2.108601 -3.490935
H -1.007881 1.374769 -4.010386
H 4.339400 2.904291 0.768681
H 3.721530 -1.352498 0.190677
H -4.034521 1.066527 -1.774874
H -4.133762 -0.037757 2.406528
H 6.510347 2.741844 -0.432304
H 5.888617 -1.490154 -0.999567
H -5.209899 3.188120 -1.236310
H -5.307137 2.090284 2.933907
H -0.610945 -5.248336 0.242624
H 1.195757 -5.187991 0.443008
H 0.438917 -4.579224 -1.077607
H 7.289609 0.548066 -1.314765
H -5.843435 3.705184 1.115964


%chk=000284164-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284164

0 1
S 3.209646 1.136130 1.359213
S -2.853867 -1.140852 0.220936
O -0.119615 -2.377848 -0.111743
O 3.138635 0.452338 2.854086
O 3.214568 2.761101 1.168836
O -2.839823 -2.047382 1.598311
O -2.903494 -1.855291 -1.261235
O 1.918129 -2.989855 0.845303
N 1.611792 0.110906 0.296113
N -1.270106 0.389195 0.696174
C 0.946548 -0.754957 1.291474
C -0.448788 -0.240419 1.737323
C 0.831563 0.904276 -0.519335
C -0.629659 0.931672 -0.392192
C 0.988406 -2.168314 0.681741
C 1.447570 1.681406 -1.553053
C -1.390576 1.619897 -1.395184
C 4.719313 0.441173 0.466567
C -4.413401 -0.073338 0.308759
C 0.672379 2.375091 -2.483616
C -0.757597 2.326546 -2.417144
C 5.564429 1.355579 -0.182793
C 4.924978 -0.948970 0.495294
C -5.096878 0.184666 -0.891154
C -4.832934 0.394866 1.564556
C 6.703127 0.834722 -0.841034
C 6.067441 -1.444831 -0.174919
C -6.272641 0.968504 -0.821380
C -6.008775 1.179275 1.612349
C -0.240758 -3.688713 -0.802692
C 6.950749 -0.558162 -0.836586
C -6.722107 1.466814 0.424111
H 1.597237 -0.784446 2.193782
H -1.037896 -1.076478 2.178256
H -0.320615 0.519869 2.534282
H 2.540120 1.692753 -1.616001
H -2.482104 1.606720 -1.313174
H 1.160328 2.951236 -3.276443
H -1.354616 2.860538 -3.163444
H 5.343947 2.427890 -0.159212
H 4.228620 -1.625292 1.002579
H -4.733879 -0.239505 -1.833184
H -4.275669 0.139981 2.470979
H 7.391659 1.516607 -1.350773
H 6.260046 -2.522415 -0.179101
H -6.835463 1.181686 -1.736237
H -6.366089 1.559281 2.575095
H -1.191177 -3.605315 -1.346024
H -0.266083 -4.499134 -0.056068
H 0.617407 -3.829210 -1.480530
H 7.833656 -0.954111 -1.349832
H -7.632984 2.073418 0.470566


