%chk=000259718.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259718

0 1
O -2.053050 -2.565342 -0.364729
O -3.344394 -1.015256 2.136361
O -3.414184 0.415127 -1.071410
O -5.630902 -3.297113 -0.330957
N 0.360698 0.056672 -0.489117
N 1.595195 0.348048 0.017288
C -3.611713 -1.107715 0.744626
C -2.624901 -0.227893 -0.066893
C -3.381042 -2.540075 0.215016
C -1.649337 -1.219574 -0.755696
C -4.372436 -2.926798 -0.896214
C -0.218588 -1.092170 -0.298086
C 2.169675 1.587859 -0.621830
C 2.597831 -0.698957 0.224534
C 1.360727 2.806073 -0.242224
C 3.329843 -0.643593 1.421076
C 2.825977 -1.721440 -0.709862
C 0.924753 3.689097 -1.240531
C 1.068518 3.075358 1.103182
C 4.293597 -1.621812 1.677873
C 3.789469 -2.694856 -0.435674
C 0.210010 4.838767 -0.891363
C 0.349385 4.223061 1.445294
C 4.523841 -2.646672 0.754110
C -0.078049 5.108305 0.449932
H -4.668096 -0.760146 0.657697
H -2.115937 0.529005 0.564946
H -3.342294 -3.295783 1.025940
H -1.742929 -1.178190 -1.864275
H -3.966778 -3.746780 -1.515030
H -4.628595 -2.066941 -1.549172
H 0.195822 -2.002754 0.154867
H -2.432164 -1.316203 2.344792
H -2.961695 1.230097 -1.381799
H -5.551948 -4.131664 0.173834
H 2.233850 1.478445 -1.728099
H 3.214254 1.709476 -0.248200
H 3.139920 0.151510 2.141717
H 2.259514 -1.759420 -1.639431
H 1.134970 3.481971 -2.287706
H 1.390766 2.378973 1.876295
H 4.865262 -1.586441 2.605079
H 3.969934 -3.493777 -1.154759
H -0.124866 5.524381 -1.667938
H 0.120075 4.427851 2.489839
H 5.274252 -3.407893 0.961540
H -0.635636 6.002983 0.719157


%chk=000259718-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259718

0 1
O -2.142677 -2.720744 0.083227
O -2.660735 0.293366 0.792008
O -3.633635 -1.270340 -2.417313
O -5.866226 -2.407327 0.687187
N 0.175654 -0.303152 -1.152988
N 1.427093 0.209580 -0.871458
C -3.377144 -0.656976 -0.073629
C -2.634174 -0.850524 -1.421560
C -3.409647 -2.072043 0.533979
C -1.611924 -1.977338 -1.112088
C -4.621061 -2.921026 0.093045
C -0.220838 -1.492796 -0.749316
C 1.570295 1.645068 -1.222539
C 2.496871 -0.499991 -0.217260
C 1.154832 2.639978 -0.135244
C 3.187970 0.090460 0.872704
C 2.906397 -1.774781 -0.696572
C 2.085936 3.584437 0.365283
C -0.171863 2.650561 0.369130
C 4.278877 -0.583173 1.466163
C 3.987100 -2.444907 -0.087701
C 1.705402 4.519279 1.356206
C -0.550661 3.576201 1.366305
C 4.680321 -1.853631 0.995849
C 0.385945 4.513602 1.863525
H -4.380453 -0.231464 -0.213486
H -2.126126 0.081324 -1.724632
H -3.362770 -2.017956 1.639359
H -1.581758 -2.711254 -1.942330
H -4.437805 -3.978802 0.370196
H -4.767909 -2.844794 -0.994394
H 0.384478 -2.191838 -0.152132
H -1.757447 -0.071815 0.987173
H -3.233925 -1.218013 -3.320992
H -5.827470 -2.523387 1.670657
H 0.941066 1.791194 -2.118993
H 2.622483 1.820242 -1.509328
H 2.864752 1.062070 1.257913
H 2.396995 -2.221468 -1.556864
H 3.112804 3.591518 -0.023365
H -0.913146 1.940855 -0.014837
H 4.806596 -0.117001 2.305768
H 4.297852 -3.423992 -0.469090
H 2.435472 5.245768 1.731001
H -1.577791 3.565495 1.747307
H 5.521458 -2.376259 1.463620
H 0.089140 5.233595 2.634508


