%chk=000286661.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286661

0 1
O -0.421624 1.940933 -0.668883
O -0.967691 -2.772646 0.100008
O -4.582916 0.187271 0.806955
O 1.063375 -0.778061 -1.945831
N 3.644895 -0.376227 -1.531731
C -0.591154 -0.352464 -0.324761
C -1.242834 0.911894 -0.294189
C -1.362879 -1.469694 0.033807
C 0.818300 -0.410286 -0.802093
C 1.886354 -0.036519 0.140620
C -2.570994 1.072665 0.090001
C -2.714122 -1.354094 0.435153
C -3.290713 -0.086864 0.449794
C 3.251170 0.019343 -0.266841
C 1.575463 0.302127 1.475968
C 4.251942 0.439279 0.662379
C 2.553755 0.689518 2.377116
C 3.897900 0.762085 1.957294
C -0.969784 3.284288 -0.705824
C 0.357163 -3.172352 -0.331487
C -5.437074 -0.922701 1.187654
H -3.070666 2.032548 0.115366
H -3.252344 -2.254301 0.706854
H 0.531749 0.255368 1.801665
H 5.288724 0.493751 0.345403
H 2.294207 0.941977 3.400352
H 4.662264 1.077924 2.669347
H 2.937672 -0.579721 -2.245014
H 4.571586 -0.175393 -1.861166
H -1.786304 3.338029 -1.432130
H -0.100781 3.865835 -1.041366
H -1.288781 3.589530 0.294836
H 0.494428 -2.938909 -1.395859
H 0.323996 -4.256652 -0.166252
H 1.120110 -2.702294 0.296921
H -6.383224 -0.411805 1.407220
H -5.038100 -1.417509 2.077988
H -5.547967 -1.617773 0.349930


%chk=000286661-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286661

0 1
O -0.343700 1.963776 -0.407689
O -1.074754 -2.872639 0.006884
O -4.717486 0.197605 0.683989
O 1.025485 -0.972214 -1.892319
N 3.581023 -0.380369 -1.668889
C -0.598451 -0.399565 -0.211997
C -1.210175 0.896637 -0.124596
C -1.442961 -1.522000 0.010337
C 0.826300 -0.478828 -0.716903
C 1.937592 -0.002000 0.123173
C -2.570284 1.074818 0.175794
C -2.822989 -1.362899 0.317130
C -3.372793 -0.073624 0.394004
C 3.293966 0.040675 -0.388446
C 1.702764 0.421298 1.465770
C 4.337289 0.526024 0.463869
C 2.736460 0.881777 2.291694
C 4.062090 0.936627 1.774253
C -0.895825 3.318895 -0.382694
C 0.322601 -3.310420 -0.099875
C -5.605179 -0.949031 0.893828
H -3.041513 2.058027 0.227388
H -3.403036 -2.270500 0.495219
H 0.677073 0.374897 1.846947
H 5.362855 0.564917 0.076284
H 2.530755 1.195737 3.319635
H 4.880595 1.297947 2.407994
H 2.791990 -0.737491 -2.229025
H 4.528064 -0.313222 -2.034180
H -1.700390 3.435987 -1.134111
H -0.049639 3.974450 -0.634967
H -1.284288 3.577268 0.621412
H 0.697045 -3.185947 -1.129441
H 0.298586 -4.375040 0.179045
H 0.972711 -2.755841 0.602373
H -6.596831 -0.513548 1.085479
H -5.284661 -1.550021 1.766769
H -5.645185 -1.594064 -0.004932


