%chk=000184835.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184835

0 1
S 2.079235 -1.689654 -0.062713
F -4.972846 0.225929 -1.332515
F -5.585954 -0.891395 0.349217
F -4.970853 1.116727 0.578659
O 3.051684 -2.446610 0.693695
O 1.613053 -2.134868 -1.352474
N 0.720777 -1.662120 1.028829
C 2.548184 -0.042941 -0.146532
C -0.604216 -1.302943 0.721208
C 3.532082 0.446854 0.722353
C 1.965479 0.816014 -1.088165
C 3.332115 2.649426 -0.274691
C -1.032549 -1.105599 -0.609439
C -1.521437 -1.115837 1.786454
C -3.237416 -0.479721 0.191992
C 3.922586 1.783552 0.662773
C 2.350315 2.153109 -1.152796
C -2.337604 -0.696717 -0.863194
C -2.820361 -0.707003 1.516383
C 3.738008 4.081335 -0.350140
C -4.638541 -0.024772 -0.054913
H 0.876646 -1.997668 1.991204
H 4.005853 -0.224993 1.448578
H 1.207771 0.437283 -1.783688
H -0.369632 -1.326499 -1.453276
H -1.212067 -1.287855 2.814573
H 4.688536 2.155019 1.341926
H 1.891823 2.815917 -1.885576
H -2.651320 -0.554590 -1.900694
H -3.519524 -0.560497 2.344030
H 2.875727 4.752756 -0.214374
H 4.482312 4.361103 0.408094
H 4.176333 4.321757 -1.331688


%chk=000184835-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184835

0 1
S 1.877164 -1.478615 0.241141
F -5.154042 0.013133 -1.374129
F -5.724861 -1.774688 -0.088429
F -5.703798 0.306071 0.802078
O 2.917321 -2.365461 1.126507
O 1.233795 -2.011748 -1.155173
N 0.475820 -1.092908 1.561582
C 2.623786 0.211581 -0.089149
C -0.860989 -1.019588 1.103312
C 3.487585 0.757001 0.871967
C 2.319660 0.838763 -1.308937
C 3.787896 2.699855 -0.621081
C -1.238132 0.013008 0.198085
C -1.853767 -1.923121 1.581000
C -3.559815 -0.742348 0.295254
C 4.067076 2.014482 0.590763
C 2.913731 2.092820 -1.563479
C -2.575162 0.144350 -0.207506
C -3.197466 -1.770121 1.198221
C 4.413028 4.050502 -0.915488
C -4.996333 -0.559852 -0.088457
H 0.648613 -1.848094 2.252336
H 3.713719 0.215971 1.795853
H 1.666442 0.347414 -2.037681
H -0.481687 0.717723 -0.160019
H -1.567508 -2.738161 2.255708
H 4.746717 2.465285 1.322227
H 2.700866 2.603119 -2.509928
H -2.860370 0.934220 -0.908891
H -3.957465 -2.462235 1.573058
H 3.638909 4.834385 -1.013436
H 5.107550 4.361106 -0.117416
H 4.975915 4.030647 -1.866792


