%chk=000262759.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262759

0 1
S -2.245096 0.582511 0.094225
O 0.717920 -2.584941 -0.739294
O -3.755515 -0.953238 -1.261072
O -4.896854 -2.626920 -0.283072
O -0.102402 -3.128109 1.337256
O -0.171338 0.928353 1.675506
N -1.491785 -2.338977 -0.386009
C -2.629148 -2.051004 0.518774
C -2.480041 -0.751763 1.306564
C -3.890669 -1.971479 -0.349600
C 2.080339 -2.915236 -0.309894
C 2.757289 -1.650909 0.136355
C -0.273688 -2.704479 0.213877
C -0.250604 2.381044 -0.253445
C -0.698398 1.329864 0.678212
C 3.732868 -1.049503 -0.671246
C 2.409538 -1.068498 1.364201
C 1.094020 2.379612 -0.661598
C -1.135319 3.361017 -0.725845
C 4.363357 0.123614 -0.246049
C 3.035156 0.109479 1.779460
C 4.015194 0.704400 0.977631
C 1.545764 3.355003 -1.552514
C -0.671413 4.337689 -1.611817
C 0.664278 4.332905 -2.027219
H -2.740775 -2.921549 1.236320
H -1.611015 -0.802647 2.007846
H -3.364884 -0.539810 1.936589
H -1.442254 -1.756318 -1.236351
H 2.499145 -3.345886 -1.238747
H 2.044242 -3.684766 0.486697
H 4.001600 -1.491745 -1.628996
H 1.643169 -1.533612 1.991449
H 1.780134 1.615739 -0.281544
H -2.177665 3.374064 -0.401654
H 5.128002 0.583887 -0.869184
H 2.751410 0.565788 2.728139
H 4.507821 1.617184 1.308114
H 2.586028 3.354098 -1.875884
H -1.353698 5.103112 -1.979696
H 1.020123 5.094084 -2.721783
H -4.555737 -0.850058 -1.850902


%chk=000262759-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262759

0 1
S -2.739236 0.914897 0.281427
O 0.669016 -2.522299 -0.693971
O -3.730774 -2.137204 -1.740196
O -5.164020 -2.064491 0.087555
O -0.243630 -2.894051 1.459450
O -0.206610 0.686242 1.321818
N -1.521446 -2.060057 -0.316037
C -2.738757 -1.942387 0.477579
C -2.797923 -0.644188 1.335453
C -4.003805 -2.060502 -0.371500
C 2.016536 -2.956359 -0.195685
C 2.901626 -1.766749 0.110202
C -0.359564 -2.518957 0.261138
C -0.439891 2.523935 -0.243766
C -0.924610 1.355614 0.544121
C 3.974791 -1.426013 -0.750796
C 2.668426 -0.983005 1.270185
C 0.965173 2.741824 -0.295733
C -1.314626 3.407446 -0.929973
C 4.809247 -0.322913 -0.458024
C 3.497159 0.122141 1.560310
C 4.571973 0.453424 0.700156
C 1.483647 3.826504 -1.030492
C -0.790191 4.496393 -1.656164
C 0.608395 4.707290 -1.710072
H -2.760132 -2.777832 1.207211
H -1.916077 -0.610845 1.998312
H -3.732170 -0.606082 1.916044
H -1.533633 -1.805115 -1.303977
H 2.419709 -3.562358 -1.022457
H 1.852124 -3.583350 0.698610
H 4.157197 -2.025063 -1.651904
H 1.834349 -1.236114 1.933164
H 1.628210 2.047145 0.230612
H -2.398521 3.253448 -0.889145
H 5.640058 -0.072184 -1.127254
H 3.307868 0.719526 2.459028
H 5.221708 1.305152 0.932901
H 2.566483 3.984109 -1.076515
H -1.467940 5.179876 -2.178489
H 1.012562 5.552123 -2.278866
H -4.583603 -2.186970 -2.250459


