%chk=000209199.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209199

0 1
S -1.323154 -1.178057 -1.074973
O 0.989982 -2.270386 -1.672317
O 0.989991 -0.094601 2.501052
C 2.482040 -1.486710 0.576663
C 1.026945 -1.147888 0.388298
C 3.358075 -0.372984 0.059700
C 0.395192 -0.365316 1.474207
C -1.816963 -0.175981 0.281731
C 0.365329 -1.532728 -0.722255
C -1.008101 0.101026 1.304006
C -3.208093 0.267427 0.112865
C 3.912287 -0.446241 -1.226127
C 3.618429 0.743850 0.868887
C -3.527240 1.235614 -0.852270
C -4.215614 -0.280656 0.923542
C 4.732097 0.585660 -1.692484
C 4.437260 1.771668 0.397304
C 4.998010 1.693833 -0.882566
C -4.853013 1.650472 -1.003624
C -5.538164 0.138902 0.762846
C -5.857872 1.102893 -0.199440
H 2.721252 -2.446236 0.069502
H 2.683220 -1.659209 1.660294
H -1.351752 0.733366 2.136105
H 3.698915 -1.303492 -1.861636
H 3.169060 0.804881 1.863347
H -2.744703 1.668208 -1.476276
H -3.964513 -1.030025 1.674336
H 5.163985 0.525056 -2.689300
H 4.639149 2.635648 1.027851
H 5.637937 2.494040 -1.246112
H -5.102672 2.403833 -1.750236
H -6.321523 -0.285491 1.390193
H -6.890493 1.428398 -0.321282
H 0.417214 -2.480874 -2.457030


%chk=000209199-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209199

0 1
S -1.311721 -1.022144 -1.407891
O 1.139819 -2.004073 -2.006217
O 0.901467 -0.354986 2.494152
C 2.485179 -1.542615 0.451288
C 1.019764 -1.169087 0.237241
C 3.437792 -0.406875 0.066597
C 0.307028 -0.539798 1.371109
C -1.907398 -0.216624 0.121500
C 0.418826 -1.401559 -0.974655
C -1.091303 -0.096955 1.216016
C -3.314447 0.247645 0.051711
C 4.094408 -0.404947 -1.190645
C 3.670768 0.668801 0.963595
C -3.883193 0.722042 -1.162813
C -4.122973 0.232315 1.223912
C 4.965508 0.650160 -1.547288
C 4.540546 1.723638 0.607105
C 5.190878 1.719245 -0.649434
C -5.218089 1.175742 -1.202321
C -5.454975 0.691458 1.181671
C -6.009358 1.165340 -0.030746
H 2.724049 -2.446413 -0.134040
H 2.597991 -1.769464 1.525964
H -1.486322 0.416274 2.101017
H 3.916407 -1.231751 -1.888381
H 3.161076 0.668541 1.933839
H -3.271643 0.762911 -2.071655
H -3.714113 -0.164875 2.159029
H 5.470486 0.636193 -2.520384
H 4.713842 2.546626 1.310246
H 5.867944 2.536459 -0.923796
H -5.637367 1.545268 -2.144323
H -6.064484 0.668084 2.091453
H -7.045931 1.517789 -0.062277
H 0.622041 -2.094462 -2.845779


