%chk=000276809.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276809

0 1
O -2.995681 -2.422121 -0.645036
O -3.300554 1.831793 1.123904
O 3.470017 0.472474 1.764820
O 2.148226 2.322841 -1.443175
N 1.896632 -0.920157 0.868087
N 1.713189 0.085252 -1.341169
C 1.251641 0.147466 0.069556
C -0.267202 -0.033718 0.116220
C -1.028083 1.024299 0.613041
C -0.863943 -1.221752 -0.327078
C -2.263534 -1.326719 -0.254463
C -2.427811 0.879999 0.665196
C -3.069738 -0.291925 0.240891
C 3.014531 -0.650028 1.682526
C 2.183340 1.239691 -1.994325
C 3.552659 -1.844414 2.419113
C 2.686551 1.011243 -3.391621
C -2.288966 -3.559867 -1.194804
C -2.756206 3.101943 1.566030
H 1.565385 1.160263 0.491511
H -0.546377 1.941338 0.939203
H -0.265601 -2.025894 -0.729037
H 1.493611 -1.850029 0.822297
H 1.702972 -0.816175 -1.800797
H -4.150770 -0.392268 0.288800
H 2.816763 -2.274716 3.111121
H 4.424222 -1.544512 3.025997
H 3.891948 -2.638849 1.743164
H 3.540810 0.322876 -3.420358
H 3.030669 1.967006 -3.822587
H 1.907747 0.621586 -4.059209
H -1.614962 -3.986117 -0.447134
H -1.763009 -3.275180 -2.110182
H -3.115784 -4.248792 -1.415968
H -3.666504 3.647264 1.847511
H -2.237601 3.601041 0.741619
H -2.102484 2.953459 2.430337


%chk=000276809-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276809

0 1
O -3.042097 -2.554063 -0.518375
O -3.359608 1.997766 0.778556
O 3.927637 -0.053273 1.126630
O 1.554923 2.530620 -1.114014
N 1.857729 -1.085846 0.868129
N 1.786962 0.224485 -1.161230
C 1.230014 0.065899 0.202607
C -0.295173 -0.085158 0.194806
C -1.074660 1.043218 0.519695
C -0.904561 -1.313711 -0.165620
C -2.320830 -1.396226 -0.182269
C -2.490201 0.940015 0.486844
C -3.115486 -0.277756 0.146229
C 3.169088 -1.042101 1.341516
C 1.960479 1.484064 -1.709613
C 3.618073 -2.270602 2.130227
C 2.676661 1.530292 -3.054690
C -2.282022 -3.746319 -0.892642
C -2.760318 3.299485 1.096969
H 1.504664 0.998240 0.730978
H -0.570396 1.984620 0.751798
H -0.291092 -2.169989 -0.465725
H 1.241390 -1.841194 1.172465
H 2.129419 -0.609444 -1.640064
H -4.205289 -0.352104 0.125058
H 3.869171 -1.962636 3.160221
H 4.540140 -2.673563 1.677829
H 2.860174 -3.072030 2.172707
H 3.677716 1.974088 -2.910251
H 2.117653 2.188097 -3.740314
H 2.796276 0.537311 -3.521981
H -1.633000 -4.090827 -0.063020
H -1.666636 -3.568416 -1.796565
H -3.039814 -4.513547 -1.108947
H -3.613804 3.973180 1.261191
H -2.141516 3.672432 0.259024
H -2.145564 3.243593 2.015845


