%chk=000233821.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233821

0 1
S 0.687924 -1.137902 -1.053611
O -2.998108 -0.677634 1.728781
O 0.920219 -1.297164 -2.477033
O 0.314102 -2.288792 -0.258625
O -0.873719 -0.028999 1.902860
N -0.587595 0.019665 -0.924358
C -1.922648 -0.286895 -0.377189
C -2.934777 0.825558 -0.753045
C -2.545943 2.223983 -0.257184
C -2.452318 -1.652688 -0.822551
C -1.794541 -0.303111 1.171597
C -3.569802 3.269299 -0.691298
C 2.035041 -0.312624 -0.367144
C 2.050796 0.021317 0.989713
C 3.130658 0.003979 -1.182033
C 3.163348 0.673680 1.534442
C 4.240023 0.653793 -0.639409
C 4.255150 0.987930 0.721505
H -3.927645 0.550176 -0.335018
H -3.073256 0.835264 -1.852224
H -0.600431 0.789049 -1.605244
H -1.541990 2.506273 -0.631678
H -2.457622 2.224507 0.848570
H -2.518975 -1.730849 -1.913411
H -3.450522 -1.850121 -0.408012
H -1.809897 -2.486548 -0.478752
H -3.651876 3.332344 -1.782380
H -4.569387 3.045840 -0.299794
H -3.293858 4.266050 -0.326661
H 1.191366 -0.217979 1.634882
H 3.117239 -0.261289 -2.246407
H -2.963001 -0.718361 2.721036
H 3.172725 0.933451 2.592185
H 5.092426 0.898314 -1.270800
H 5.122995 1.494484 1.145688


%chk=000233821-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233821

0 1
S 0.676862 -1.252480 -0.873649
O -3.043275 -1.046440 1.655962
O 1.016437 -1.701534 -2.408093
O 0.243461 -2.360669 0.238933
O -0.978927 -0.025539 1.840922
N -0.692965 0.060868 -0.970925
C -2.021004 -0.342416 -0.415554
C -2.975363 0.876438 -0.717052
C -2.575370 2.223842 -0.078470
C -2.612879 -1.630089 -1.050905
C -1.896927 -0.455791 1.114420
C -3.496906 3.369219 -0.549293
C 2.150135 -0.242305 -0.251649
C 2.107079 0.303382 1.041184
C 3.238984 -0.128636 -1.130029
C 3.251408 1.012628 1.475177
C 4.371463 0.584009 -0.671091
C 4.375628 1.149975 0.625361
H -3.987177 0.579173 -0.381150
H -3.024164 0.985463 -1.820657
H -0.771032 0.209310 -1.998382
H -1.522189 2.447883 -0.327809
H -2.621522 2.144751 1.024926
H -2.699088 -1.490787 -2.144511
H -3.612866 -1.839742 -0.638735
H -1.963321 -2.497946 -0.850740
H -3.435494 3.508670 -1.645336
H -4.554692 3.165666 -0.295618
H -3.215047 4.325782 -0.073489
H 1.214367 0.197864 1.665392
H 3.197028 -0.587777 -2.123083
H -2.946424 -1.088452 2.645641
H 3.259547 1.458150 2.475363
H 5.243627 0.692019 -1.324147
H 5.256709 1.699511 0.974486


