%chk=000296679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296679

0 1
S 2.786810 -2.045867 0.350974
S 1.291729 -3.177062 1.259643
O -0.381988 -0.208653 -2.109285
C 0.248034 -1.021787 0.060507
C 1.699231 -0.770391 -0.381768
C -0.035831 -2.514681 0.221486
C 2.209895 0.577166 0.035866
C -0.733452 -0.444763 -0.973974
C -2.140910 -0.227814 -0.526688
C 2.413172 1.559127 -0.947330
C 2.472785 0.878678 1.380960
C -2.486175 -0.076669 0.824345
C -3.140000 -0.156235 -1.511717
C 2.881019 2.825569 -0.587859
C 2.941922 2.146716 1.734148
C 3.147631 3.121420 0.752540
C -3.818702 0.130689 1.186952
C -4.472916 0.045939 -1.146017
C -4.812635 0.188546 0.203030
H 0.074609 -0.501938 1.043514
H 1.771955 -0.893732 -1.499373
H -1.007085 -2.701859 0.720790
H -0.067350 -3.041527 -0.753757
H 2.198253 1.337252 -1.993597
H 2.325046 0.125021 2.155318
H -1.714665 -0.111610 1.596614
H -2.861511 -0.254582 -2.565103
H 3.037629 3.582498 -1.354911
H 3.151067 2.374137 2.778291
H 3.515123 4.107195 1.031062
H -4.084324 0.250165 2.236574
H -5.245287 0.097163 -1.912615
H -5.852381 0.348489 0.489182


%chk=000296679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296679

0 1
S 3.003232 -2.106236 0.567383
S 1.356836 -3.511601 1.381321
O -0.368392 -0.612776 -2.141192
C 0.323203 -1.267920 0.099909
C 1.775085 -0.894277 -0.306515
C 0.146377 -2.808573 0.121018
C 2.138463 0.545493 0.018573
C -0.683813 -0.678301 -0.915333
C -2.044230 -0.254785 -0.447307
C 2.388600 1.457328 -1.037429
C 2.205712 1.007729 1.359159
C -2.469239 -0.354531 0.906273
C -2.950217 0.255590 -1.419373
C 2.687533 2.811423 -0.761001
C 2.503005 2.358453 1.635424
C 2.744082 3.266179 0.575533
C -3.771025 0.045622 1.276195
C -4.246413 0.658624 -1.048218
C -4.661432 0.553966 0.302258
H 0.133656 -0.879378 1.114413
H 1.887548 -1.085275 -1.385729
H -0.860977 -3.112397 0.454865
H 0.361420 -3.242840 -0.868663
H 2.333847 1.107197 -2.074877
H 2.059762 0.296728 2.181058
H -1.795466 -0.740322 1.678259
H -2.607485 0.322439 -2.457106
H 2.877142 3.506565 -1.586420
H 2.558338 2.703838 2.673994
H 2.980874 4.314044 0.791531
H -4.090141 -0.035436 2.320724
H -4.934722 1.052887 -1.803498
H -5.670463 0.867143 0.592574


