%chk=000259446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259446

0 1
S -1.962727 -0.495136 -1.432047
S 1.963299 0.499559 -1.432741
O -5.947755 0.545772 0.951279
O 5.947737 -0.547481 0.948751
O -0.693883 1.567619 -2.515252
O 0.693366 -1.561502 -2.517861
N -3.688756 0.261152 1.048034
N 3.688711 -0.263168 1.045889
C -3.435739 1.296400 0.024384
C 3.435890 -1.295792 0.019551
C -3.323180 0.704816 -1.377452
C 3.323623 -0.700644 -1.380793
C -5.002795 -0.072140 1.409800
C 5.002691 0.069244 1.408691
C -0.623359 0.442768 -2.126932
C 0.623336 -0.437158 -2.127942
C -5.123318 -1.191341 2.403996
C 5.123034 1.185907 2.405759
H -4.282904 2.033633 0.040159
H -2.515434 1.860010 0.299626
H 4.283033 -2.033083 0.033619
H 2.515517 -1.860088 0.293158
H -3.171214 1.504246 -2.134481
H -4.252251 0.168241 -1.668047
H 3.171779 -1.498158 -2.139855
H 4.252774 -0.163354 -1.669827
H -2.896599 -0.304852 1.331524
H 2.896521 0.302196 1.330566
H -4.583105 -0.985188 3.337262
H -6.183311 -1.338346 2.673201
H -4.759758 -2.147041 2.005003
H 4.582694 0.977343 3.338417
H 6.182984 1.332256 2.675494
H 4.759497 2.142612 2.009166


%chk=000259446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259446

0 1
S -2.129545 -0.698504 -1.291097
S 2.127341 0.683225 -1.297865
O -6.529174 0.501194 0.225905
O 6.534167 -0.522587 0.257887
O -0.693791 1.643456 -1.104020
O 0.691528 -1.656606 -1.085440
N -4.371303 0.103539 0.982245
N 4.371630 -0.090865 0.982708
C -3.789089 1.152041 0.135582
C 3.787734 -1.149685 0.150280
C -3.444861 0.670742 -1.286900
C 3.442422 -0.686393 -1.277806
C -5.735536 -0.160828 0.962542
C 5.738467 0.160851 0.972310
C -0.655914 0.393590 -1.168079
C 0.653436 -0.407605 -1.163290
C -6.208040 -1.280150 1.884432
C 6.211002 1.294818 1.876170
H -4.542886 1.955278 0.039244
H -2.893321 1.570219 0.625645
H 4.541620 -1.953971 0.064325
H 2.892088 -1.561351 0.646165
H -3.043617 1.502178 -1.889859
H -4.324274 0.228872 -1.780780
H 3.039956 -1.525090 -1.869805
H 4.321160 -0.250849 -1.778501
H -3.750555 -0.482082 1.541424
H 3.750646 0.511374 1.523816
H -5.389191 -1.773169 2.436381
H -6.928846 -0.867153 2.611237
H -6.744895 -2.037168 1.287818
H 5.391255 1.803102 2.412731
H 6.924353 0.891638 2.615678
H 6.756431 2.037241 1.269017


