%chk=000220263.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220263

0 1
S 1.918103 2.204293 0.604661
O 0.316727 0.419593 1.631843
O 1.138926 2.729156 1.723429
O 3.070068 1.359975 0.838179
C 0.011944 0.292015 0.234490
C 0.778894 1.420631 -0.500614
C -1.498909 0.371089 0.037271
C 0.585418 -1.070747 -0.143259
C -2.333624 -0.020404 1.094501
C -0.070638 -1.915966 -1.047342
C -2.069032 0.786441 -1.173725
C 1.803629 -1.472297 0.426688
C 2.465154 3.585927 -0.332839
C -3.722369 0.029139 0.950761
C 0.489939 -3.152745 -1.380678
C -3.458986 0.833639 -1.316039
C 2.357120 -2.711045 0.094293
C -4.287758 0.459842 -0.253611
C 1.702413 -3.552649 -0.810509
H 1.289954 0.994383 -1.386014
H 0.069850 2.159856 -0.918028
H -0.092665 1.236323 2.049357
H -1.888440 -0.372802 2.029564
H -1.022755 -1.625177 -1.489747
H -1.435831 1.065908 -2.013912
H 2.320299 -0.806969 1.132925
H 3.346166 4.063522 0.127003
H 2.780884 3.343298 -1.352638
H 1.718004 4.386452 -0.403982
H -4.363738 -0.271880 1.778149
H -0.023486 -3.807091 -2.082096
H -3.896519 1.160301 -2.257810
H 3.300925 -3.017377 0.542976
H -5.369923 0.500031 -0.365009
H 2.134553 -4.517464 -1.068635


%chk=000220263-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220263

0 1
S 2.014092 2.292409 0.727447
O 0.256627 0.212922 1.775073
O 1.110871 2.797761 2.021968
O 3.404270 1.463229 0.929825
C -0.006355 0.181147 0.328217
C 0.742374 1.351308 -0.422827
C -1.519621 0.329066 0.049256
C 0.560313 -1.177837 -0.143200
C -2.444522 0.146744 1.104270
C -0.240004 -2.170768 -0.754161
C -2.010144 0.610769 -1.252920
C 1.937866 -1.438883 0.081677
C 2.440434 3.875407 -0.253219
C -3.833060 0.266441 0.868529
C 0.328398 -3.406230 -1.145445
C -3.397266 0.730457 -1.489837
C 2.501896 -2.671033 -0.308375
C -4.315117 0.561987 -0.426994
C 1.699709 -3.660245 -0.926746
H 1.354994 1.011262 -1.272141
H 0.064635 2.172916 -0.704440
H 0.260990 1.161974 2.122202
H -2.058107 -0.087506 2.100492
H -1.307243 -1.993230 -0.918361
H -1.314500 0.720226 -2.094937
H 2.563300 -0.686537 0.578429
H 3.117363 4.431373 0.410291
H 2.940900 3.562560 -1.180176
H 1.500440 4.416686 -0.426322
H -4.537106 0.127144 1.696580
H -0.303823 -4.169032 -1.613853
H -3.760542 0.948644 -2.500437
H 3.565135 -2.861767 -0.124128
H -5.391621 0.656027 -0.608170
H 2.138721 -4.618190 -1.227965


