%chk=000233513.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233513

0 1
S 1.661174 2.108542 0.056056
O -3.891386 1.693301 0.016110
C -1.541471 -1.080785 -0.062059
C -2.513365 -2.227673 -0.123696
C -1.989461 0.262049 -0.032229
C -3.873463 -1.872626 0.482297
C -4.415989 -0.598132 -0.154482
C -1.048372 1.322597 0.010084
C 0.757826 -0.350772 -0.023667
C 0.308104 0.987823 0.011606
C -0.174882 -1.388722 -0.060253
C -3.445626 0.562781 -0.041509
C 2.218869 -0.454601 -0.014753
C 2.847598 0.812603 0.027558
C -1.475120 2.744495 0.050111
C 3.009866 -1.608869 -0.042069
C 4.230136 0.952848 0.042966
C 4.400899 -1.477854 -0.026891
C 5.005051 -0.211426 0.015150
H -2.636358 -2.528554 -1.187944
H -2.099611 -3.120766 0.388631
H -4.586780 -2.706967 0.339506
H -3.776398 -1.737773 1.578993
H -5.384942 -0.308060 0.303342
H -4.642685 -0.757579 -1.229869
H 0.161140 -2.421802 -0.085504
H -0.655405 3.470549 0.075887
H -2.114688 2.994413 -0.817081
H -2.122100 2.940438 0.926302
H 2.546217 -2.592871 -0.074531
H 4.698898 1.934518 0.075660
H 5.026697 -2.368954 -0.047825
H 6.092126 -0.134973 0.026304


%chk=000233513-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233513

0 1
S 1.677613 2.204930 0.070334
O -3.973918 1.717694 -0.150384
C -1.561617 -1.101450 -0.103148
C -2.549961 -2.259443 -0.171042
C -2.018808 0.266964 -0.065090
C -3.874870 -1.921331 0.537187
C -4.461175 -0.646132 -0.092470
C -1.070807 1.350038 -0.004541
C 0.767099 -0.345220 -0.037465
C 0.297032 1.000757 0.003570
C -0.186055 -1.387853 -0.085462
C -3.492040 0.542922 -0.097910
C 2.223681 -0.448365 -0.015008
C 2.864717 0.826874 0.040885
C -1.467933 2.811826 0.050548
C 3.029500 -1.615787 -0.043468
C 4.267088 0.956862 0.068399
C 4.432233 -1.498990 -0.015917
C 5.048145 -0.219312 0.039682
H -2.768502 -2.497187 -1.234266
H -2.087633 -3.165277 0.262242
H -4.590816 -2.758714 0.442409
H -3.693805 -1.762187 1.617863
H -5.386367 -0.309899 0.407322
H -4.731565 -0.848511 -1.151124
H 0.146728 -2.432048 -0.106326
H -0.581010 3.459923 0.158110
H -2.021308 3.110546 -0.856013
H -2.159157 3.010299 0.886761
H 2.560093 -2.604851 -0.087362
H 4.744295 1.940924 0.111241
H 5.055068 -2.399439 -0.037804
H 6.140555 -0.141368 0.060449


