%chk=000193875.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193875

0 1
S -0.006453 -2.257333 -0.504212
S -2.670918 -0.234171 1.188574
O -0.412377 -0.641599 -0.162792
O 0.964481 2.516358 -1.131488
O -1.011090 1.723376 -2.869660
O -3.148302 0.236110 -0.348124
O 1.984501 3.443244 1.198643
O 0.331936 -2.770994 0.998703
O -1.159873 -2.937900 -1.001341
O 1.213426 -2.156529 -1.260735
O 2.656640 -1.381741 1.323314
O -2.094905 -1.752139 0.825969
O -1.597152 0.602748 1.634507
O -3.874285 -0.412637 1.924091
N 2.759192 0.508838 0.071599
C -0.037357 0.395662 -1.077024
C 0.484571 1.547878 -0.184429
C -1.319074 0.766122 -1.867482
C 1.611294 1.108117 0.777677
C -2.470621 1.317281 -1.000374
C 2.163947 2.305561 1.572920
C 3.145680 -0.808777 0.350401
C 4.157352 -1.415039 -0.559406
H 0.760271 0.059880 -1.784955
H -0.343719 1.999887 0.421641
H -1.684189 -0.117254 -2.450769
H 1.158623 0.358695 1.503889
H -3.260576 1.747586 -1.655868
H -2.143023 2.082575 -0.274043
H 3.031734 0.978458 -0.793856
H 1.260017 3.342262 -0.642125
H 2.733600 2.052651 2.477900
H -0.419490 2.446309 -2.510316
H 4.846361 -0.705511 -1.031067
H 4.763978 -2.166382 -0.026773
H 3.627826 -1.963359 -1.370141
H 1.183629 -2.411451 1.419325
H -2.703453 -2.368583 0.338527


%chk=000193875-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193875

0 1
S -0.207877 -2.553879 -0.359861
S -3.441488 0.152659 1.148011
O -0.389614 -0.763980 0.115999
O 0.830689 2.548470 -0.853543
O -0.576214 1.511272 -2.901825
O -3.240082 0.105559 -0.708835
O 1.742332 3.329854 1.670813
O 0.819843 -3.114216 0.940031
O -1.679321 -3.136634 -0.077414
O 0.493967 -2.663350 -1.802800
O 2.870177 -1.613374 0.764655
O -3.380542 -1.596272 1.414821
O -2.181319 0.964862 1.756832
O -4.915792 0.604674 1.557088
N 2.887525 0.585433 0.042965
C 0.024053 0.243570 -0.890119
C 0.501289 1.402892 0.020353
C -1.108965 0.595468 -1.889182
C 1.735141 1.004850 0.864066
C -2.402976 1.185374 -1.287787
C 2.200170 2.163954 1.759734
C 3.373577 -0.702643 0.022764
C 4.528434 -0.995125 -0.911571
H 0.868154 -0.139126 -1.499620
H -0.314706 1.666677 0.721570
H -1.378610 -0.325052 -2.437479
H 1.468396 0.145480 1.509132
H -3.002737 1.612938 -2.110044
H -2.200007 1.976724 -0.541113
H 3.256486 1.270583 -0.622569
H 0.911238 3.344730 -0.259046
H 3.003916 1.911015 2.489449
H -0.073325 2.229262 -2.415050
H 4.902060 -0.103282 -1.440295
H 5.353475 -1.444907 -0.333707
H 4.206437 -1.745941 -1.654409
H 1.709723 -2.550186 0.922039
H -2.711308 -2.070134 0.796648


