%chk=000295447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295447

0 1
S 6.998503 -0.322980 -0.855107
O 1.261238 0.324021 0.352690
O 0.259494 -1.282788 -0.988493
O -5.318218 1.680234 2.054071
O -6.871134 0.504280 1.128298
N -0.950701 0.194016 0.387802
N -5.699264 0.797566 1.299253
C -4.978607 -0.990365 -0.337523
C -2.291361 -0.229649 0.121691
C -4.660452 0.048761 0.555198
C 4.854445 0.730762 0.512185
C -3.325712 0.432807 0.788762
C -3.909175 -1.640426 -0.996013
C -2.589826 -1.278389 -0.780658
C 5.292154 -0.186018 -0.463772
C 2.594852 0.063705 -0.000062
C 3.477780 0.854690 0.748159
C 4.389135 -0.959788 -1.194509
C 3.013038 -0.845466 -0.970170
C -6.374443 -1.419548 -0.606563
C 5.816680 1.559280 1.290744
C 0.183962 -0.379224 -0.192867
C 7.561822 -1.629765 0.264545
H -3.126053 1.248989 1.493853
H -4.133289 -2.450974 -1.694192
H -1.779757 -1.802363 -1.307303
H 3.088951 1.547618 1.490655
H 4.749048 -1.661758 -1.951942
H 2.301835 -1.449977 -1.537463
H -0.816940 0.965503 1.051632
H -6.886761 -1.740330 0.319253
H -6.988989 -0.584925 -0.991741
H -6.448876 -2.243434 -1.326917
H 6.490206 2.126735 0.626073
H 5.323664 2.288240 1.946944
H 6.463295 0.934767 1.926188
H 8.633137 -1.783262 0.080747
H 7.040889 -2.574746 0.078197
H 7.425235 -1.355996 1.314955


%chk=000295447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295447

0 1
S 7.166695 -0.390331 -0.979273
O 1.245744 0.194139 0.270595
O 0.187813 -1.357257 -1.199021
O -5.158940 1.674093 2.298763
O -6.911554 0.596448 1.334737
N -0.983299 0.043032 0.307304
N -5.645287 0.813227 1.463647
C -5.133105 -0.934706 -0.322078
C -2.334871 -0.311246 0.066647
C -4.692184 0.044286 0.617978
C 4.909867 0.648400 0.463942
C -3.328265 0.354205 0.814415
C -4.096742 -1.578651 -1.050380
C -2.729890 -1.294605 -0.881294
C 5.374518 -0.240757 -0.550969
C 2.610257 -0.032738 -0.085896
C 3.514178 0.731936 0.681017
C 4.453339 -0.994255 -1.313845
C 3.060054 -0.904716 -1.101117
C -6.571472 -1.325875 -0.592547
C 5.852058 1.491575 1.300778
C 0.144562 -0.476240 -0.310765
C 7.799567 -1.377411 0.506962
H -3.078101 1.118305 1.557011
H -4.382635 -2.339331 -1.784951
H -1.972303 -1.818385 -1.467397
H 3.115381 1.403511 1.448255
H 4.834283 -1.664635 -2.090554
H 2.359870 -1.492417 -1.694430
H -0.798818 0.761484 1.011088
H -7.073797 -1.698496 0.316880
H -7.173650 -0.465093 -0.931103
H -6.605155 -2.111550 -1.366190
H 6.742579 1.781215 0.716090
H 5.351598 2.403556 1.668356
H 6.208955 0.932667 2.187950
H 8.861218 -1.587223 0.301713
H 7.238475 -2.319718 0.593398
H 7.708861 -0.786642 1.430881


