%chk=000236597.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236597

0 1
S 0.695644 1.792762 -1.302968
S -2.508558 0.539263 1.097025
O 2.378172 -2.252203 -1.128269
O 2.561618 -1.843175 1.065523
C 0.728140 -0.806348 -0.253056
C -0.408810 -1.274023 0.690096
C 1.067174 0.625822 -0.058784
C -1.725564 -0.771485 0.243747
C 1.965890 -1.647425 0.035388
C 1.659996 1.246042 1.002272
C -2.509935 -1.184452 -0.792543
C 1.817539 2.669656 0.814704
C 1.346528 3.116484 -0.381505
C -3.749022 -0.447638 -0.901823
C -3.898030 0.513490 0.049063
H 0.412336 -0.998008 -1.319220
H -0.177391 -0.958487 1.733196
H -0.430104 -2.388185 0.726394
H 1.999139 0.743493 1.901008
H -2.263347 -1.980971 -1.479976
H 2.272459 3.291534 1.574706
H 1.340367 4.120847 -0.767744
H -4.468336 -0.668408 -1.679266
H -4.717979 1.194177 0.194330
H 3.198173 -2.803961 -1.011499


%chk=000236597-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236597

0 1
S 0.865840 1.790075 -1.453418
S -2.252513 0.818847 0.869385
O 2.728910 -2.055376 -1.149633
O 2.435617 -1.975088 1.153429
C 0.781978 -0.870947 -0.332106
C -0.406673 -1.389425 0.555053
C 1.087655 0.598806 -0.114153
C -1.736795 -0.783993 0.199891
C 2.038444 -1.674959 0.006102
C 1.538482 1.230879 1.037637
C -2.722957 -1.296555 -0.633871
C 1.708840 2.655691 0.890698
C 1.393422 3.121539 -0.375810
C -3.887279 -0.452912 -0.765543
C -3.803488 0.714658 -0.025186
H 0.543213 -1.048005 -1.394198
H -0.143946 -1.217182 1.613761
H -0.479165 -2.485756 0.421374
H 1.754754 0.685556 1.960343
H -2.619965 -2.262856 -1.136172
H 2.053019 3.308998 1.695957
H 1.424168 4.137856 -0.764209
H -4.753153 -0.707733 -1.381403
H -4.523997 1.525505 0.065672
H 3.561686 -2.538823 -0.892801


