%chk=000299555.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299555

0 1
S 2.580703 -0.766151 0.619630
S -2.590538 0.773503 0.623612
O 2.215145 -1.621838 -0.484950
O 2.981685 -1.240447 1.922625
O -2.231790 1.635067 -0.478642
O -2.995681 1.241215 1.927707
O 6.572376 -1.792053 -0.458856
O -6.590626 1.767618 -0.453322
O 4.552459 -2.204141 0.225139
O -4.574469 2.195381 0.232146
N 1.189603 0.252233 0.894201
N -1.190856 -0.233319 0.895992
N 5.438767 -1.462558 -0.164715
N -5.454276 1.447159 -0.159772
C -0.002140 0.014396 0.014310
C 0.697372 0.341874 2.303206
C -0.696759 -0.321583 2.304420
C 3.780599 0.402071 0.050978
C -3.780116 -0.403564 0.051710
C 5.076442 -0.017865 -0.286323
C -5.079466 0.005971 -0.284914
C 3.470325 1.751930 -0.075448
C -3.458109 -1.750362 -0.078001
C 6.049558 0.874378 -0.738088
C -6.044684 -0.893528 -0.739201
C 4.438065 2.666608 -0.530244
C -4.417767 -2.672245 -0.535393
C 5.719960 2.232374 -0.859381
C -5.703282 -2.248312 -0.863813
H -0.137967 0.920096 -0.633266
H 0.131230 -0.883853 -0.644003
H 0.630774 1.419025 2.573682
H 1.389504 -0.140859 3.029309
H -0.629720 -1.398519 2.575742
H -1.387928 0.161650 3.031137
H 2.469461 2.129552 0.175033
H -2.454064 -2.119958 0.171851
H 7.053039 0.514033 -0.992831
H -7.051180 -0.541264 -0.993328
H 4.174830 3.722590 -0.624112
H -4.145328 -3.725665 -0.631847
H 6.471986 2.941294 -1.212270
H -6.449034 -2.962833 -1.218709


%chk=000299555-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299555

0 1
S 2.619283 -0.795232 0.688725
S -2.618558 0.796079 0.686936
O 2.225202 -1.873990 -0.468177
O 2.911543 -1.223432 2.232358
O -2.223981 1.873383 -0.471154
O -2.911333 1.226165 2.229944
O 7.063798 -1.693649 -0.129793
O -7.062146 1.694489 -0.136420
O 4.947733 -2.293983 0.470503
O -4.946597 2.294834 0.465721
N 1.091096 0.550752 0.740167
N -1.090582 -0.549996 0.740610
N 5.818337 -1.432992 0.075415
N -5.817036 1.433655 0.070653
C 0.000398 -0.000298 -0.132824
C 0.560676 0.534579 2.143273
C -0.560541 -0.531994 2.143822
C 4.013638 0.374182 0.050379
C -4.012751 -0.373957 0.049473
C 5.350832 -0.038325 -0.162925
C -5.349703 0.038541 -0.165362
C 3.635524 1.705376 -0.198180
C -3.634789 -1.705612 -0.196851
C 6.310296 0.888560 -0.626961
C -6.309070 -0.888815 -0.628656
C 4.599054 2.630957 -0.664275
C -4.598220 -2.631671 -0.662194
C 5.933630 2.223128 -0.877797
C -5.932558 -2.223851 -0.877222
H -0.395979 0.817222 -0.770110
H 0.397033 -0.818785 -0.768711
H 0.154170 1.543036 2.347106
H 1.370686 0.312333 2.859217
H -0.154083 -1.540181 2.349084
H -1.370749 -0.308817 2.859252
H 2.595319 1.995863 -0.020027
H -2.594756 -1.996056 -0.017615
H 7.333425 0.534444 -0.780106
H -7.332005 -0.534679 -0.783047
H 4.296921 3.665267 -0.856159
H -4.296194 -3.666338 -0.852314
H 6.679518 2.938119 -1.237960
H -6.678378 -2.939209 -1.236797


