%chk=000262738.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262738

0 1
S -0.602114 -0.762742 2.079846
S -2.077361 -0.270004 0.732612
O -3.803362 -0.047758 -0.738920
O 3.238049 1.417595 -0.387924
O 3.101071 -0.810959 -0.758504
C 1.387421 0.353874 0.564107
C 0.921752 -0.978768 1.123480
C -3.557810 -1.458344 -0.990569
C -2.617317 -1.907451 0.118001
C -5.047691 0.233642 -0.023516
C 2.639210 0.185276 -0.253591
C 4.481142 1.504129 -1.153140
C -5.029374 1.739442 0.155654
C 5.637902 1.000014 -0.315499
H 1.556629 1.100496 1.373963
H 0.603538 0.818288 -0.082298
H 1.669776 -1.410058 1.822374
H 0.788870 -1.728190 0.317832
H -4.491434 -2.036975 -1.045270
H -3.073250 -1.442659 -1.986647
H -3.113331 -2.484797 0.915075
H -1.774488 -2.516268 -0.246692
H -5.883484 -0.107103 -0.658579
H -5.051689 -0.310059 0.936150
H 4.356147 0.935023 -2.091339
H 4.526681 2.590351 -1.352507
H -4.207853 2.052428 0.816528
H -4.868689 2.249977 -0.804269
H -5.968113 2.104450 0.585468
H 5.660161 1.479719 0.671358
H 5.561805 -0.085116 -0.147468
H 6.600605 1.191046 -0.803316


%chk=000262738-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262738

0 1
S -0.371233 -0.801388 2.388942
S -1.800775 0.287090 0.993562
O -4.244537 0.382126 -0.870390
O 3.679089 1.308053 -0.185364
O 3.086996 -0.844791 -0.870396
C 1.755382 0.330812 0.856046
C 1.122340 -1.012150 1.240205
C -3.338667 -0.741865 -1.115055
C -2.593368 -1.223355 0.139904
C -5.396635 0.051220 -0.010558
C 2.885356 0.160721 -0.148258
C 4.819824 1.305216 -1.156625
C -6.314764 1.272720 -0.004191
C 6.065669 0.677950 -0.525145
H 2.129742 0.873808 1.740753
H 0.983683 0.979547 0.393019
H 1.816213 -1.644437 1.823423
H 0.811046 -1.578703 0.348985
H -3.892418 -1.603702 -1.553727
H -2.624322 -0.360660 -1.864354
H -3.255230 -1.714287 0.870936
H -1.785023 -1.919049 -0.141624
H -5.917872 -0.843361 -0.419788
H -5.051776 -0.183108 1.018621
H 4.508795 0.756238 -2.062786
H 4.964090 2.372831 -1.386946
H -5.774561 2.152961 0.384499
H -6.661561 1.502346 -1.026222
H -7.196380 1.090430 0.637069
H 6.331694 1.191659 0.414696
H 5.901988 -0.392398 -0.315716
H 6.920615 0.766024 -1.221118


