%chk=000282865.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282865

0 1
S -2.502738 -1.218560 -1.984836
O 2.630417 3.071088 -0.681576
O -2.912889 -0.465775 -3.157281
O -2.413365 -2.669214 -2.032815
O -6.950360 1.219398 2.351544
O -6.519440 -0.670090 3.313578
N 5.372040 1.181933 0.613269
N 2.656478 0.886535 0.070389
N -6.377898 0.144939 2.417559
C 7.855060 -0.362316 0.427797
C 7.141359 -0.125084 1.763926
C 6.845738 -0.303898 -0.724908
C 6.355363 1.196401 1.747970
C 6.064697 1.019490 -0.710150
C 4.540203 2.422873 0.618081
C 3.200512 2.182863 -0.081144
C 1.421991 0.426598 -0.454295
C -1.012235 -0.589698 -1.397408
C 1.077476 -0.926470 -0.212620
C 0.548048 1.257660 -1.184309
C -0.130937 -1.418937 -0.691439
C -0.653810 0.740056 -1.654946
C -3.644144 -0.821948 -0.700427
C -4.331462 0.391435 -0.739869
C -3.863307 -1.735790 0.330885
C -5.232106 0.717734 0.279647
C -4.759921 -1.427175 1.359029
C -5.428708 -0.196747 1.322294
H 8.649591 0.393516 0.278846
H 8.365611 -1.343631 0.437721
H 6.449437 -0.965827 1.971304
H 7.870534 -0.110717 2.595161
H 7.360663 -0.417986 -1.697098
H 6.139150 -1.154173 -0.646916
H 7.059283 2.054671 1.692151
H 5.784722 1.300407 2.696387
H 5.286961 1.004748 -1.505037
H 6.747670 1.865374 -0.941753
H 5.025138 3.303270 0.134017
H 4.318969 2.738426 1.665153
H 3.249794 0.185045 0.545912
H 1.751240 -1.581662 0.334716
H 0.818714 2.301116 -1.387572
H -0.389885 -2.471507 -0.521900
H -1.320217 1.382626 -2.243026
H -4.184162 1.086140 -1.575984
H -3.349501 -2.704902 0.331613
H -5.780207 1.665993 0.268111
H -4.944965 -2.129829 2.178448


%chk=000282865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282865

0 1
S -2.414583 -1.105291 -1.966123
O 2.818766 3.554879 -0.820429
O -2.955617 -0.209738 -3.224771
O -2.170437 -2.723824 -2.034926
O -7.286898 0.780039 2.449228
O -6.675720 -1.208795 3.384019
N 5.436761 1.327605 0.505639
N 2.874403 1.281718 -0.155871
N -6.571896 -0.292895 2.481623
C 7.505107 -0.764714 0.649379
C 6.821770 -0.198122 1.915352
C 6.571173 -0.622115 -0.574398
C 6.346619 1.250559 1.685590
C 6.104286 0.837306 -0.738557
C 4.816361 2.661010 0.312902
C 3.399409 2.559845 -0.298048
C 1.625339 0.779657 -0.570472
C -0.805771 -0.329621 -1.364144
C 1.344880 -0.593767 -0.312144
C 0.665580 1.588262 -1.246979
C 0.122162 -1.160608 -0.713951
C -0.558949 1.022072 -1.653534
C -3.677241 -0.834470 -0.561900
C -4.472304 0.322306 -0.605868
C -3.807894 -1.839012 0.410790
C -5.435297 0.504554 0.408262
C -4.770623 -1.658868 1.425454
C -5.557968 -0.486120 1.407839
H 8.446402 -0.209124 0.458817
H 7.782795 -1.824012 0.802627
H 5.946315 -0.824414 2.177039
H 7.515363 -0.221070 2.777010
H 7.084493 -0.946257 -1.499108
H 5.684449 -1.273774 -0.444248
H 7.236328 1.912428 1.541741
H 5.796472 1.618891 2.571310
H 5.385974 0.922415 -1.575190
H 6.981774 1.484111 -0.987140
H 5.409065 3.341334 -0.335845
H 4.710390 3.163084 1.293516
H 3.577224 0.656518 0.293628
H 2.091585 -1.215333 0.195351
H 0.900173 2.635196 -1.450244
H -0.097785 -2.221917 -0.559618
H -1.293585 1.612761 -2.210768
H -4.358013 1.038574 -1.425910
H -3.195257 -2.744411 0.352699
H -6.085985 1.382118 0.435467
H -4.924991 -2.400570 2.213103


