%chk=000179703.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179703

0 1
S -2.362510 1.663798 0.025302
O -4.047371 -0.327329 0.457377
N -1.960852 -0.978064 -0.263496
C 0.291664 -0.481060 0.725455
C -0.548768 -0.637435 -0.556366
C 1.720880 -0.178309 0.370450
C 2.664469 -1.213100 0.285880
C 2.115953 1.143750 0.113044
C -2.276899 -2.421268 -0.114680
C -2.913788 -0.057896 0.122032
C 3.990512 -0.925520 -0.049612
C 3.442539 1.425044 -0.222486
C 4.382389 0.392227 -0.304547
C -3.888602 2.541711 0.422274
H -0.127250 0.325082 1.365833
H 0.222449 -1.397755 1.344626
H -0.498805 0.291612 -1.172555
H -0.116409 -1.442081 -1.195884
H 2.367644 -2.240624 0.483567
H 1.388258 1.951487 0.176674
H -1.661569 -2.890225 0.669218
H -2.105955 -2.943595 -1.070373
H -3.342329 -2.557201 0.159212
H 4.720251 -1.731246 -0.111811
H 3.745210 2.452339 -0.419958
H 5.415039 0.613939 -0.564959
H -4.702771 1.838605 0.678433
H -4.214821 3.138644 -0.437059
H -3.725558 3.199771 1.283407


%chk=000179703-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179703

0 1
S -2.314786 1.748576 0.007575
O -4.141782 -0.302324 0.380611
N -1.977661 -0.986160 -0.191055
C 0.324964 -0.566103 0.783843
C -0.568621 -0.659406 -0.489585
C 1.760913 -0.222011 0.420183
C 2.754085 -1.229459 0.317714
C 2.122785 1.119546 0.127211
C -2.339773 -2.416615 -0.118778
C -2.942956 -0.042995 0.091104
C 4.076346 -0.907884 -0.065859
C 3.442451 1.445202 -0.256555
C 4.424493 0.431458 -0.355573
C -3.943041 2.602660 0.392528
H -0.105623 0.208353 1.444929
H 0.283355 -1.530213 1.324875
H -0.517683 0.292763 -1.047170
H -0.173437 -1.445858 -1.159556
H 2.491700 -2.270178 0.547480
H 1.366409 1.910582 0.210464
H -1.701926 -2.942224 0.616195
H -2.214779 -2.895496 -1.108057
H -3.391774 -2.499849 0.191959
H 4.833041 -1.697783 -0.134655
H 3.706591 2.486346 -0.474249
H 5.449304 0.683378 -0.650625
H -4.679174 1.803986 0.587959
H -4.244292 3.204258 -0.476821
H -3.806127 3.232749 1.282905


