%chk=000281556.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281556

0 1
O -0.691346 1.561965 0.301398
O 2.543487 -2.527450 0.722252
O 3.343621 -0.513950 -1.987074
O 5.483640 -0.596267 -1.319559
O 3.553744 3.187154 0.980720
N 1.028971 -0.788623 0.754821
N 2.782231 1.521422 -0.358666
C -1.317247 -0.765488 0.179961
C -2.549206 -1.438765 -0.108556
C -3.591396 -0.406720 -0.326144
C -2.988167 0.883502 -0.181238
C -0.155399 -1.496387 0.434907
C -1.531973 0.703067 0.133452
C -2.617035 -2.812175 -0.153067
C 3.411090 -0.339684 1.212627
C 3.843571 0.601815 0.074857
C -0.227039 -2.918875 0.378011
C -4.935687 -0.523650 -0.620009
C -3.728369 2.037901 -0.327939
C 2.328567 -1.342684 0.862497
C -1.426032 -3.544514 0.093268
C -5.691124 0.661800 -0.770697
C -5.103907 1.914086 -0.628257
C 4.360181 -0.219389 -1.111428
C 2.719306 2.829826 0.169368
C 1.587786 3.657995 -0.343739
H -3.543564 -3.335285 -0.370277
H 4.301860 -0.915076 1.566764
H 3.109453 0.277019 2.091091
H 4.717387 1.222828 0.463533
H 0.919156 0.240814 0.849227
H 0.680535 -3.508327 0.558627
H -5.410744 -1.495526 -0.733658
H -3.269550 3.020448 -0.214909
H -1.467837 -4.635995 0.054915
H -6.754364 0.582863 -1.002467
H -5.704173 2.815768 -0.747175
H 2.097686 1.165919 -1.026438
H 1.612574 4.662061 0.110234
H 1.613518 3.790131 -1.433170
H 0.602916 3.217645 -0.089665
H 3.645478 -1.073901 -2.755199


%chk=000281556-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281556

0 1
O -0.724170 1.547140 0.579826
O 2.614141 -2.466862 0.729278
O 3.830240 -0.511400 -2.003920
O 5.686150 -0.874490 -0.646353
O 3.118368 3.108215 1.118972
N 0.982305 -0.776543 0.708412
N 2.914284 1.491940 -0.525712
C -1.372656 -0.793719 0.168343
C -2.596084 -1.438041 -0.180877
C -3.653984 -0.392214 -0.272190
C -3.060648 0.876471 0.015751
C -0.162928 -1.510504 0.339169
C -1.604409 0.666398 0.296994
C -2.630855 -2.825174 -0.372440
C 3.295517 -0.194750 1.332116
C 3.897591 0.630092 0.135013
C -0.197558 -2.927282 0.139278
C -5.023372 -0.475007 -0.571079
C -3.811697 2.061269 0.009990
C 2.283430 -1.255871 0.902890
C -1.413641 -3.549762 -0.207084
C -5.789690 0.723137 -0.578344
C -5.196021 1.976128 -0.292084
C 4.593507 -0.311912 -0.841457
C 2.596032 2.730210 0.024364
C 1.574509 3.554003 -0.742746
H -3.553765 -3.348850 -0.640593
H 4.123660 -0.718916 1.836678
H 2.859335 0.543897 2.027762
H 4.669180 1.280082 0.587778
H 0.816388 0.238313 0.823305
H 0.719805 -3.505003 0.259351
H -5.501925 -1.434668 -0.793867
H -3.336647 3.021191 0.236867
H -1.417138 -4.635836 -0.352659
H -6.859781 0.675654 -0.808883
H -5.810654 2.882270 -0.303062
H 2.523064 1.184108 -1.417922
H 1.817530 4.622079 -0.628866
H 1.535470 3.299068 -1.816435
H 0.575664 3.375617 -0.304521
H 4.274053 -1.183181 -2.587845


