%chk=000268551.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268551

0 1
S 4.906415 0.746737 -1.232148
O -1.530126 -2.302455 0.527599
O -1.053390 0.710664 1.953626
O -4.086084 0.831740 -1.611149
N -3.176840 0.254409 0.394244
C -1.843373 0.036429 -0.202943
C -0.757697 0.460089 0.804551
C -1.656917 -1.445459 -0.606619
C 0.637434 0.529071 0.297051
C 0.933668 0.888606 -1.028919
C 1.681463 0.238937 1.188844
C -4.231956 0.719445 -0.405671
C 2.256786 0.948475 -1.460182
C 3.011500 0.288337 0.760487
C 3.290062 0.641944 -0.560121
C -5.506140 1.008659 0.330972
C 6.038322 0.302309 0.097013
H -1.759540 0.661385 -1.142752
H -2.499366 -1.783240 -1.239402
H -0.697584 -1.597726 -1.140285
H -3.208964 0.283485 1.415450
H 0.129565 1.133647 -1.725651
H 1.445669 -0.026751 2.223572
H 2.479535 1.232758 -2.490081
H 3.805672 0.052434 1.466399
H -2.355194 -2.293897 1.057413
H -6.295903 1.295319 -0.384181
H -5.878608 0.139738 0.889638
H -5.397774 1.841788 1.039092
H 5.878917 -0.720786 0.457456
H 5.980363 0.994924 0.944844
H 7.057881 0.358586 -0.313748


%chk=000268551-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268551

0 1
S 5.109502 0.674542 -1.217273
O -1.971934 -2.354750 0.064790
O -0.995162 0.330056 1.964186
O -4.337795 0.741304 -1.513065
N -3.127483 0.342648 0.425543
C -1.865855 0.121104 -0.289603
C -0.717519 0.289002 0.723184
C -1.847986 -1.301718 -0.939336
C 0.682274 0.371915 0.235106
C 1.021250 0.573313 -1.134068
C 1.736165 0.266471 1.183220
C -4.289411 0.690689 -0.243647
C 2.363668 0.663539 -1.536222
C 3.081925 0.348022 0.788701
C 3.408169 0.547750 -0.577971
C -5.495057 0.998681 0.637402
C 6.155059 0.465700 0.327922
H -1.784095 0.855516 -1.115045
H -2.670076 -1.337849 -1.680732
H -0.886783 -1.491199 -1.441751
H -3.035060 0.415000 1.447095
H 0.240623 0.681409 -1.894471
H 1.470653 0.115672 2.234758
H 2.606919 0.827109 -2.591721
H 3.866079 0.254345 1.545484
H -2.807665 -2.193780 0.574125
H -6.327568 0.329113 0.360652
H -5.288482 0.888331 1.715613
H -5.829944 2.031774 0.440377
H 5.980285 -0.520376 0.784827
H 5.955804 1.275863 1.046048
H 7.197297 0.530401 -0.019727


