%chk=000211227.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211227

0 1
I -2.197068 -0.480752 2.857116
I -2.730661 0.004266 -3.214216
I -7.581974 -0.975919 0.210379
O 4.069514 0.586257 -0.474273
O 2.665786 -2.540652 0.257574
O 3.744634 -1.307890 1.788015
O -0.508581 -1.085868 -0.399850
N -0.822074 1.206049 -0.208190
C 3.990942 -0.847978 -0.663079
C 5.427210 -1.263560 -1.005653
C 2.901966 1.315937 -0.374521
C 0.533815 1.661496 -0.243258
C 6.416732 -0.979536 0.116718
C 1.614168 0.773925 -0.373209
C 3.507038 -1.516365 0.627998
C 3.145073 2.699245 -0.266782
C 0.743558 3.051964 -0.136144
C 2.050176 3.550330 -0.149010
C -2.749586 -0.279875 -0.156133
C -1.245402 -0.135786 -0.271017
C -3.347788 -0.477295 1.092065
C -3.556342 -0.285782 -1.297298
C -4.724170 -0.678891 1.210453
C -4.935379 -0.485351 -1.207197
C -5.502679 -0.678484 0.052609
H 3.283748 -1.070688 -1.499884
H 5.736512 -0.713206 -1.920955
H 5.434884 -2.341170 -1.270544
H 7.442847 -1.214092 -0.184836
H 6.193229 -1.556605 1.024003
H 6.385363 0.081533 0.407451
H 1.433271 -0.301077 -0.462594
H 4.165999 3.070211 -0.269913
H -0.090545 3.739192 -0.039545
H -1.536113 1.934575 -0.108015
H 2.212336 4.626374 -0.063470
H -5.183126 -0.836882 2.193970
H -5.558992 -0.492683 -2.109344
H 2.253178 -3.015366 1.027280


%chk=000211227-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211227

0 1
I -2.219662 -0.441941 2.856410
I -2.798880 0.047030 -3.314216
I -7.702358 -1.000935 0.202901
O 4.101073 0.621263 -0.446664
O 3.174003 -2.821014 0.437274
O 3.510488 -0.997810 1.846458
O -0.539590 -1.117801 -0.496431
N -0.829026 1.206622 -0.228464
C 3.996976 -0.829502 -0.602825
C 5.395660 -1.333060 -1.030261
C 2.923513 1.382094 -0.329708
C 0.511171 1.695800 -0.238998
C 6.500600 -1.068298 0.012544
C 1.624886 0.825662 -0.354790
C 3.541329 -1.495462 0.706314
C 3.125288 2.776842 -0.200720
C 0.695344 3.095979 -0.110626
C 2.004415 3.622202 -0.092758
C -2.788391 -0.236488 -0.206641
C -1.275466 -0.101471 -0.330210
C -3.401900 -0.446496 1.056610
C -3.629081 -0.256907 -1.350047
C -4.791217 -0.663144 1.188373
C -5.022739 -0.468931 -1.255378
C -5.586924 -0.671973 0.022647
H 3.261238 -1.083943 -1.391483
H 5.641606 -0.823608 -1.980403
H 5.310470 -2.414349 -1.244427
H 7.480209 -1.396415 -0.378131
H 6.313035 -1.613850 0.955238
H 6.562479 0.006690 0.250901
H 1.439213 -0.245228 -0.446162
H 4.146334 3.167315 -0.183336
H -0.170097 3.763471 -0.020125
H -1.555968 1.917477 -0.109619
H 2.150861 4.702576 0.009043
H -5.236677 -0.823459 2.171663
H -5.645938 -0.477684 -2.151894
H 2.865222 -3.261652 1.274642


