%chk=000268550.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268550

0 1
S -0.863288 1.319461 0.769397
O -1.058182 2.733136 0.523955
O -0.480707 0.862440 2.083165
O 4.532875 0.778030 -0.178053
N 0.388750 0.862441 -0.363379
C 1.216827 1.974140 -0.920085
C 1.079265 -0.381254 -0.223489
C 2.559201 2.110801 -0.203095
C 2.492902 -0.430750 -0.187160
C 3.320528 0.801298 -0.195586
C -2.244683 0.434244 0.235535
C 0.337103 -1.579761 -0.176573
C 3.138976 -1.675905 -0.110462
C 1.003342 -2.800760 -0.089770
C 2.402943 -2.857260 -0.058936
C -2.839263 -0.496850 1.096238
C -2.790933 0.671055 -1.029718
C -3.975936 -1.197845 0.686752
C -3.928064 -0.031703 -1.440701
C -4.519276 -0.964642 -0.582258
H 0.645679 2.933820 -0.866031
H 1.380480 1.758885 -2.002566
H 3.175419 2.905854 -0.672307
H 2.425372 2.447119 0.849115
H -0.748691 -1.567434 -0.232316
H 4.234305 -1.696634 -0.086171
H 0.425425 -3.725759 -0.051836
H 2.910009 -3.817177 0.006702
H -2.412782 -0.676161 2.091769
H -2.336711 1.405772 -1.701301
H -4.440478 -1.921508 1.355869
H -4.354167 0.151074 -2.426609
H -5.408241 -1.511165 -0.901794


%chk=000268550-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268550

0 1
S -0.800215 1.389818 0.574761
O -1.040683 2.966233 0.212781
O -0.334129 0.927619 2.072750
O 4.575224 0.826109 0.316496
N 0.514430 0.735815 -0.910346
C 1.393483 1.912513 -1.174589
C 1.187800 -0.445786 -0.487381
C 2.542099 2.099485 -0.162634
C 2.567616 -0.456602 -0.091200
C 3.342893 0.817340 0.032106
C -2.375761 0.440887 0.160126
C 0.471860 -1.674419 -0.543904
C 3.200500 -1.689344 0.202314
C 1.109767 -2.885345 -0.219527
C 2.480549 -2.898019 0.150744
C -2.727166 -0.629527 0.998441
C -3.144271 0.872623 -0.933078
C -3.929978 -1.315898 0.709611
C -4.341343 0.170736 -1.204899
C -4.728747 -0.919324 -0.388733
H 0.748041 2.808945 -1.203393
H 1.790004 1.753225 -2.197358
H 3.223120 2.910552 -0.472573
H 2.123027 2.386090 0.824787
H -0.570031 -1.661455 -0.879191
H 4.258391 -1.663422 0.485280
H 0.548923 -3.824789 -0.273434
H 2.974890 -3.844629 0.392460
H -2.091899 -0.895667 1.849694
H -2.830703 1.731294 -1.534365
H -4.240659 -2.152192 1.344258
H -4.969424 0.478788 -2.047070
H -5.659607 -1.454651 -0.604636


