%chk=000217135.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217135

0 1
O -2.483298 -1.488017 1.380865
O 1.794563 -3.104241 -0.471687
O 1.747796 1.816224 0.474050
N -2.922240 0.535347 0.437648
N 1.328409 -0.827926 -0.277908
N -5.479504 1.280015 -0.694902
C -1.080011 -0.897528 -0.493484
C 0.115252 0.038182 -0.176177
C -0.517332 -2.324894 -0.397926
C -2.225710 -0.686275 0.496718
C 0.994392 -2.198194 -0.384779
C -4.126341 0.691384 1.305822
C -3.005832 1.372759 -0.786553
C -5.422054 0.407468 0.519072
C -4.294629 1.064191 -1.581005
C 2.643824 -0.280460 -0.194607
C 2.885835 1.073437 0.193300
C 3.757106 -1.076927 -0.505793
C 4.180151 1.588732 0.254321
C 5.055149 -0.558009 -0.436763
C 5.268761 0.765419 -0.061306
C 1.928863 3.131803 1.050956
H -1.444760 -0.714968 -1.531884
H 0.187372 0.883417 -0.892418
H 0.043861 0.474480 0.848176
H -0.849440 -2.973447 -1.227264
H -0.857079 -2.836298 0.536615
H -4.129993 1.734667 1.693865
H -4.046526 0.003458 2.180174
H -2.112491 1.241407 -1.428366
H -3.016897 2.441478 -0.460988
H -5.488712 -0.677295 0.285158
H -6.300894 0.658795 1.153372
H -4.381524 1.770869 -2.435774
H -4.243431 0.039518 -2.006815
H -6.337258 1.074041 -1.220108
H 3.615073 -2.126310 -0.796434
H 4.359071 2.619842 0.544300
H 5.898079 -1.203579 -0.679424
H 6.278856 1.167533 -0.009509
H 2.488229 3.064816 1.988987
H 0.891686 3.439350 1.234839
H 2.415530 3.796533 0.331635


%chk=000217135-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217135

0 1
O -2.529089 -1.083488 1.895499
O 1.952706 -2.998946 0.092258
O 2.127360 1.623779 1.321818
N -3.213906 0.319736 0.174736
N 1.317641 -0.706479 -0.001477
N -5.520256 1.261902 -1.206152
C -1.062716 -0.958353 -0.059790
C 0.073619 0.093305 0.154395
C -0.414391 -2.275314 0.414180
C -2.325814 -0.590346 0.739027
C 1.082670 -2.089600 0.150976
C -4.424757 0.721871 0.932372
C -3.075325 1.010405 -1.126508
C -5.682988 0.519627 0.064965
C -4.348452 0.801992 -1.978533
C 2.597362 -0.127975 -0.265060
C 3.021227 1.074710 0.382736
C 3.485496 -0.758242 -1.170317
C 4.282304 1.640554 0.081791
C 4.753843 -0.206003 -1.450103
C 5.148278 0.999194 -0.832026
C 2.565114 2.806097 2.067781
H -1.282132 -1.037932 -1.139788
H 0.049202 0.913362 -0.584636
H 0.023099 0.538064 1.162662
H -0.784275 -3.171114 -0.108802
H -0.597020 -2.416717 1.496143
H -4.340122 1.792184 1.206325
H -4.461165 0.113475 1.849763
H -2.192429 0.645538 -1.671680
H -2.950002 2.097155 -0.945544
H -5.832594 -0.577100 -0.089183
H -6.562588 0.915067 0.603951
H -4.266940 1.398111 -2.905738
H -4.407516 -0.278973 -2.262154
H -6.380817 1.299776 -1.765144
H 3.174861 -1.695641 -1.637251
H 4.602267 2.566515 0.568468
H 5.423625 -0.715456 -2.150229
H 6.126731 1.440784 -1.049691
H 3.487269 2.596173 2.642827
H 1.739221 3.028964 2.759324
H 2.733307 3.670134 1.395807


