%chk=000290070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290070

0 1
S 3.085696 -1.208549 0.768477
O 0.733051 1.786929 0.138595
O -1.472818 2.231396 0.543349
O -1.661016 -0.637807 -1.028974
O 1.422065 -1.503093 0.579372
O -2.795538 -0.942213 0.974813
O 3.213577 -0.268974 1.844256
O 3.593731 -0.920504 -0.544379
C 0.212634 0.577881 0.734355
C -1.295426 0.856298 0.931442
C 0.626363 -0.585205 -0.191616
C -0.534628 -1.484034 -0.681116
C -2.271018 0.029534 0.066914
C -0.350362 2.652358 -0.285392
C -0.210789 -2.208756 -1.975246
C -0.001271 4.068868 0.111979
C -0.659005 2.420550 -1.751210
C -3.894994 -1.719338 0.454706
C 3.526422 -2.806378 1.283106
H 0.749483 0.498855 1.712790
H -1.602697 0.820364 2.002323
H 1.227476 -0.180038 -1.044607
H -0.850568 -2.176516 0.133605
H -3.060575 0.642034 -0.417540
H -0.089154 -1.505038 -2.810934
H -1.019777 -2.894402 -2.256657
H 0.716270 -2.787794 -1.884477
H 0.304268 4.110591 1.168633
H -0.860558 4.739391 -0.009074
H 0.834806 4.456675 -0.482749
H -0.935163 1.369695 -1.940596
H 0.212401 2.642407 -2.378862
H -1.493765 3.043766 -2.089599
H -3.617475 -2.178119 -0.499975
H -4.779259 -1.084111 0.350531
H -4.043917 -2.477804 1.231844
H 4.204676 -3.319051 0.582788
H 4.028084 -2.824390 2.264290
H 2.654472 -3.475775 1.391633


%chk=000290070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290070

0 1
S 3.099183 -0.659778 0.225938
O 0.649595 1.544545 0.741674
O -1.195090 1.871265 -0.720898
O -1.917424 -1.166314 -1.009550
O 1.406110 -1.443245 0.621304
O -3.332332 -0.615456 0.870348
O 3.677118 0.244417 1.430514
O 3.042970 -0.096873 -1.296088
C -0.251111 0.377313 0.836927
C -1.607739 0.929656 0.339844
C 0.273886 -0.778340 -0.034251
C -0.833602 -1.845586 -0.248342
C -2.575585 -0.098999 -0.262786
C 0.042897 2.529907 -0.226042
C -0.394876 -3.040377 -1.088381
C -0.286070 3.805028 0.560548
C 0.975653 2.748927 -1.413429
C -4.460648 -1.469378 0.467103
C 3.989668 -2.336448 0.255848
H -0.276685 0.065062 1.894680
H -2.128854 1.464240 1.156955
H 0.579350 -0.399063 -1.030286
H -1.233737 -2.168211 0.734098
H -3.237187 0.378125 -1.011945
H -0.017626 -2.706133 -2.070902
H -1.249927 -3.717130 -1.257334
H 0.402872 -3.598086 -0.569822
H -1.042792 3.603763 1.338034
H -0.670602 4.585119 -0.119157
H 0.626220 4.178288 1.056161
H 1.273089 1.786650 -1.858098
H 1.890542 3.266608 -1.078943
H 0.471768 3.367834 -2.176080
H -4.112585 -2.343074 -0.114172
H -5.189192 -0.894327 -0.139735
H -4.935208 -1.799544 1.403482
H 3.550502 -2.929011 -0.556103
H 5.054831 -2.116818 0.099396
H 3.788319 -2.764851 1.246288


