%chk=000227605.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227605

0 1
S 0.021879 2.146382 -0.402765
O -0.039624 2.530753 -1.801204
O 0.159559 3.151822 0.637826
O 5.013594 -2.261842 -0.801569
O 5.179551 -1.729194 1.289252
O -5.152933 -2.253280 -1.084181
N -4.678483 -1.238868 0.939871
N 4.667254 -1.637720 0.186601
C -1.337936 1.152725 -0.030184
C 1.385822 1.044034 -0.233236
C -1.845121 1.121576 1.274553
C -1.965501 0.406892 -1.035424
C 1.824457 0.314995 -1.339005
C 2.027729 0.929148 1.000425
C -3.558798 -0.440532 0.573052
C -2.944223 0.329037 1.589670
C -3.065012 -0.395805 -0.745061
C 2.901955 -0.568001 -1.210993
C 3.106659 0.051394 1.147531
C 3.525202 -0.692986 0.037090
C -5.418652 -2.100218 0.085688
H -1.379985 1.734997 2.056591
H -1.598464 0.459280 -2.067814
H 1.341435 0.442418 -2.315683
H 1.703149 1.537520 1.853523
H -3.324592 0.315267 2.608067
H -3.546038 -0.980658 -1.538440
H 3.260550 -1.150721 -2.066546
H 3.623238 -0.054654 2.107565
H -4.970173 -1.172817 1.919372
H -6.247694 -2.604141 0.611827


%chk=000227605-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227605

0 1
S 0.038897 2.113639 -0.401104
O -0.034988 2.498973 -1.989369
O 0.170632 3.212848 0.805578
O 5.342625 -2.173803 -0.890339
O 5.509032 -1.614320 1.314704
O -5.510655 -2.241850 -1.107897
N -4.895251 -1.201916 0.925554
N 4.944419 -1.537353 0.157920
C -1.469964 1.048330 -0.006347
C 1.539955 0.952601 -0.216578
C -1.958639 1.064313 1.310135
C -2.088394 0.341524 -1.049141
C 1.987494 0.272091 -1.360470
C 2.172438 0.885459 1.035404
C -3.743820 -0.451232 0.568005
C -3.105930 0.301538 1.594662
C -3.236344 -0.425179 -0.762400
C 3.120467 -0.558591 -1.236189
C 3.305526 0.055118 1.161200
C 3.750058 -0.656158 0.024552
C -5.685918 -2.020106 0.117397
H -1.471769 1.678053 2.074854
H -1.700614 0.408813 -2.071021
H 1.480615 0.414761 -2.320264
H 1.804186 1.487637 1.872185
H -3.512265 0.296206 2.613406
H -3.745341 -0.991663 -1.544014
H 3.522122 -1.117960 -2.084721
H 3.846015 -0.044871 2.105750
H -5.185459 -1.137535 1.905478
H -6.520325 -2.472560 0.699468


