%chk=000208910.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208910

0 1
S 4.907726 1.028232 0.655272
O -1.448152 -1.499583 -0.104832
O -3.223165 1.612288 -0.682692
O -4.296103 -0.365874 -0.643891
O 5.515116 1.785142 -0.427028
O 5.132064 1.439700 2.031183
C -1.718471 -3.801684 0.067493
C -1.865231 -4.981728 -0.879602
C -2.443416 -5.059258 0.518316
C -2.504333 -2.536638 -0.163601
C -1.806946 2.120046 -0.534803
C -1.009491 0.839355 -0.291086
C -1.841600 -0.226825 -0.297873
C 0.435253 0.873029 -0.066868
C -3.265619 0.243637 -0.553998
C -1.840039 3.045031 0.663927
C -1.499749 2.802380 -1.851364
C 1.314618 1.066585 -1.145496
C 0.942038 0.727605 1.236184
C 3.194904 0.956142 0.377384
C 2.691175 1.112315 -0.916639
C 2.320123 0.776392 1.452610
C 5.432437 -0.641227 0.502418
H -0.719611 -3.591572 0.484444
H -0.987066 -5.571516 -1.134918
H -2.535189 -4.913177 -1.734326
H -3.523300 -5.044491 0.653317
H -1.978461 -5.704556 1.261127
H -3.235892 -2.324369 0.636350
H -2.992764 -2.479798 -1.151531
H -0.860296 3.507597 0.841971
H -2.573662 3.852068 0.523640
H -2.127432 2.515395 1.582204
H -1.496152 2.094065 -2.690269
H -2.259760 3.562596 -2.086792
H -0.523164 3.302999 -1.827971
H 0.922788 1.174801 -2.155424
H 0.258824 0.578442 2.071025
H 3.375844 1.284089 -1.755425
H 2.713752 0.686477 2.471827
H 4.631129 -1.351344 0.272557
H 6.185522 -0.769269 -0.289915
H 5.910651 -1.012502 1.421496


%chk=000208910-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208910

0 1
S 4.976328 0.583456 1.022411
O -1.695711 -1.469880 0.179786
O -3.193902 1.589861 -1.144680
O -4.389974 -0.380262 -0.813338
O 5.456488 2.121947 1.313479
O 5.160417 -0.621356 2.115290
C -2.174123 -3.679316 1.024811
C -1.465664 -4.703532 0.124567
C -2.819920 -5.051673 0.754257
C -2.812308 -2.461133 0.415239
C -1.761570 2.059333 -0.958490
C -1.035304 0.819318 -0.400846
C -1.965437 -0.200583 -0.279480
C 0.397059 0.769820 -0.074109
C -3.313393 0.249741 -0.746894
C -1.866967 3.233959 0.036985
C -1.304696 2.483756 -2.369190
C 1.242941 1.915057 -0.219797
C 0.990741 -0.439341 0.416893
C 3.144019 0.646164 0.548784
C 2.614933 1.862995 0.092530
C 2.360919 -0.504076 0.734064
C 5.873602 0.018527 -0.575188
H -1.752564 -3.523775 2.023508
H -0.569995 -5.194357 0.514602
H -1.436058 -4.498900 -0.949976
H -3.697386 -5.087452 0.101044
H -2.844453 -5.771569 1.576349
H -3.552666 -1.992786 1.086640
H -3.298304 -2.680707 -0.550833
H -0.889730 3.714018 0.210418
H -2.561365 3.990137 -0.366550
H -2.255922 2.882959 1.007484
H -1.334492 1.622828 -3.058066
H -1.983606 3.263531 -2.753606
H -0.277627 2.885103 -2.361625
H 0.835194 2.864421 -0.571907
H 0.363633 -1.322419 0.549285
H 3.254881 2.748576 0.016833
H 2.807409 -1.416439 1.144009
H 5.676078 0.780383 -1.341438
H 6.935957 -0.025882 -0.297208
H 5.471437 -0.969454 -0.837645


