%chk=000253340.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253340

0 1
O 0.254730 1.985081 1.099250
O 3.613158 0.580139 0.528723
O -3.526443 0.104084 0.048118
O 2.584546 1.057353 -1.430006
O -2.488451 2.108999 -0.046204
N -0.027496 -1.962166 0.749340
C 1.117470 -1.447959 -0.082640
C -1.211666 -1.333634 0.062039
C 1.340921 0.008055 0.418075
C -1.219140 0.123485 0.594719
C 0.626240 -1.475966 -1.557175
C -0.910246 -1.393858 -1.461443
C 0.082360 0.879457 0.202563
C -0.095755 -3.446750 0.803150
C 2.521082 0.621239 -0.303897
C -2.423794 0.916693 0.160152
C 4.848042 1.156594 0.023851
C -4.778252 0.751157 -0.312530
H 2.040251 -2.046224 0.070203
H -2.166954 -1.838414 0.323611
H 1.554949 -0.020376 1.525571
H -1.245588 0.071691 1.723923
H 0.950808 -2.400217 -2.060051
H 1.049293 -0.643268 -2.149156
H -1.311674 -0.521002 -1.998852
H -1.388924 -2.276134 -1.916239
H 0.025660 1.264853 -0.841760
H -0.175695 -3.946319 -0.173577
H -0.963732 -3.739779 1.417204
H 0.804167 -3.824824 1.316627
H -0.424109 2.680523 0.909362
H 5.593462 0.793576 0.738740
H 4.757725 2.247260 0.047289
H 5.045612 0.804642 -0.993766
H -5.466815 -0.095834 -0.397643
H -4.660145 1.284161 -1.261396
H -5.071999 1.441180 0.484728


%chk=000253340-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253340

0 1
O 0.207511 2.092202 1.003825
O 3.661669 0.566415 0.593579
O -3.592238 0.115107 0.054414
O 2.553729 1.196370 -1.352637
O -2.470778 2.144362 0.011541
N -0.015443 -2.012183 0.735438
C 1.120012 -1.440985 -0.055054
C -1.197421 -1.372213 0.076601
C 1.325790 0.025488 0.456079
C -1.227106 0.091623 0.599279
C 0.654903 -1.499045 -1.554863
C -0.907822 -1.448398 -1.465594
C 0.062091 0.871887 0.205326
C -0.057372 -3.493191 0.738752
C 2.527811 0.672462 -0.213576
C -2.451192 0.897045 0.188099
C 4.904193 1.150295 0.031556
C -4.842402 0.844095 -0.283905
H 2.041181 -2.018364 0.132837
H -2.127553 -1.886323 0.364162
H 1.512773 -0.027881 1.541285
H -1.242749 0.030051 1.707502
H 0.993750 -2.440875 -2.021173
H 1.073416 -0.666655 -2.145659
H -1.332377 -0.586892 -2.011124
H -1.363242 -2.358175 -1.894117
H 0.013921 1.138220 -0.871005
H -0.122364 -3.961236 -0.272438
H -0.930137 -3.827228 1.326863
H 0.850617 -3.877855 1.235608
H -0.554780 2.682784 0.755342
H 5.668094 0.978808 0.802674
H 4.762757 2.227445 -0.157366
H 5.170802 0.649577 -0.914651
H -5.612909 0.063207 -0.342677
H -4.727210 1.367669 -1.247242
H -5.076327 1.579886 0.503224


