%chk=000247787.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247787

0 1
S -6.002422 1.030997 0.087343
O -6.268768 1.023950 1.756976
O -5.904884 2.432267 -0.237201
O -7.043732 0.217068 -0.479122
O 7.458963 0.564144 0.421500
O 6.456560 2.361824 -0.244404
N -0.789542 -1.759884 -0.149736
N 0.377707 -1.066876 -0.103809
N 6.467638 1.182699 0.068815
C -4.490439 0.244463 0.016100
C -2.013408 -1.043278 -0.090029
C -4.430181 -1.151309 -0.099184
C -3.304167 0.992225 0.077434
C -3.203966 -1.805814 -0.153755
C -2.066483 0.362234 0.024227
C 2.770014 -0.940523 -0.082228
C 3.948342 -1.602444 0.316609
C 2.814583 0.421280 -0.431482
C 5.185554 0.447538 0.016933
C 5.156161 -0.911579 0.368757
C 4.019917 1.119070 -0.382410
C 1.514279 -1.715278 -0.131532
H -5.357729 -1.736802 -0.153872
H -3.350891 2.086131 0.161645
H -3.174635 -2.888967 -0.244336
H -1.144714 0.945152 0.072959
H -0.819647 -2.783814 -0.212298
H 3.921063 -2.656852 0.592234
H 1.899789 0.934827 -0.739007
H 6.080217 -1.412632 0.679538
H 4.067759 2.180848 -0.651219
H 1.636931 -2.806951 -0.182392
H -6.892969 1.680186 2.094548


%chk=000247787-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247787

0 1
S -6.207167 0.990572 -0.075216
O -6.391731 1.168552 1.768937
O -6.109018 2.471983 -0.719588
O -7.315363 -0.067283 -0.598198
O 7.696314 0.326597 -0.019382
O 6.654956 2.358277 -0.075910
N -0.775699 -1.650312 0.016974
N 0.386124 -0.931034 0.000230
N 6.635349 1.065946 -0.041375
C -4.531747 0.190158 -0.033401
C -2.026117 -1.010816 0.000127
C -4.468750 -1.213507 0.003406
C -3.392857 1.015341 -0.052266
C -3.199398 -1.816760 0.015964
C -2.125693 0.408025 -0.039508
C 2.812912 -0.889685 0.003538
C 4.017678 -1.651362 0.026751
C 2.895376 0.535265 -0.035056
C 5.318920 0.391848 -0.026005
C 5.272443 -1.019342 0.012259
C 4.141183 1.178249 -0.049881
C 1.530766 -1.592295 0.019959
H -5.384752 -1.811933 0.005254
H -3.497705 2.103960 -0.092192
H -3.119664 -2.909921 0.040960
H -1.212908 1.006327 -0.056069
H -0.754455 -2.680941 0.043556
H 3.965631 -2.746054 0.056238
H 1.969081 1.116366 -0.052834
H 6.206714 -1.586182 0.029633
H 4.227952 2.267517 -0.079198
H 1.564870 -2.699468 0.049669
H -7.266346 1.625813 1.940225


