%chk=000209553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209553

0 1
O 0.358943 0.083116 -2.046990
O 4.666681 -0.243978 2.855994
O 5.020732 -1.079731 -1.881353
O 6.236774 -1.113086 0.544350
N -4.682527 1.261902 -1.129713
N -1.359046 0.714982 -0.658147
N 0.804298 0.330085 0.235856
C -2.329310 0.826728 -1.776053
C -2.663827 2.304545 -2.097174
C -3.683358 0.174940 -1.378878
C -4.190468 2.435302 -1.929651
C -4.813022 1.609322 0.324496
C -5.315367 0.430799 1.124103
C -0.026409 0.354404 -0.921781
C -4.714797 0.113041 2.351113
C -6.399642 -0.331369 0.662972
C -5.197235 -0.958490 3.108893
C -6.874873 -1.402794 1.422148
C 2.186479 -0.025368 0.249584
C -6.275699 -1.718252 2.646627
C 2.879796 -0.389428 -0.914913
C 2.829837 0.011695 1.497407
C 4.196898 -0.318001 1.574682
C 4.233148 -0.723064 -0.818889
C 4.921104 -0.688629 0.423268
C 6.049721 -0.606507 3.114616
C 4.395474 -1.158321 -3.190591
C 7.188742 -0.288816 -0.184771
H -1.889272 0.317567 -2.673599
H -2.123253 3.001740 -1.435601
H -2.346252 2.562971 -3.121201
H -3.595370 -0.523769 -0.524989
H -4.073930 -0.427687 -2.228548
H -4.480823 3.400992 -1.479675
H -4.701668 2.376506 -2.915815
H -3.873294 2.012157 0.759782
H -5.569453 2.428599 0.397874
H -1.680715 0.992659 0.260900
H -3.877923 0.698778 2.722393
H -6.859845 -0.084770 -0.295404
H 0.394476 0.544890 1.147007
H -4.730190 -1.201234 4.061855
H -7.714847 -1.993467 1.059808
H -6.648520 -2.552486 3.237084
H 2.356554 -0.415164 -1.873921
H 2.315290 0.282564 2.413551
H 6.257014 -1.613180 2.731028
H 6.714367 0.127563 2.651821
H 6.088936 -0.567075 4.208445
H 3.598814 -1.909188 -3.184426
H 4.020801 -0.175286 -3.491140
H 5.236444 -1.477793 -3.817684
H 6.998420 -0.376286 -1.261388
H 7.128432 0.749248 0.145660
H 8.143360 -0.749777 0.085678


%chk=000209553-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209553

0 1
O 0.385591 0.263581 -2.261496
O 4.739378 -0.275437 2.797934
O 5.120969 -1.021474 -2.006122
O 6.312720 -1.039565 0.516302
N -4.677890 1.263529 -1.101426
N -1.278768 0.967790 -0.775709
N 0.846186 0.440752 0.052700
C -2.311709 1.104852 -1.814221
C -2.823621 2.577227 -1.991492
C -3.623615 0.286879 -1.504517
C -4.379537 2.449174 -1.960207
C -4.693851 1.581098 0.351999
C -5.168362 0.411834 1.210521
C 0.016015 0.536997 -1.076553
C -4.631904 0.210002 2.506243
C -6.180990 -0.464535 0.744538
C -5.101957 -0.840061 3.328449
C -6.649448 -1.516669 1.561664
C 2.215525 0.055216 0.104998
C -6.113421 -1.708031 2.857445
C 2.956345 -0.290251 -1.052844
C 2.829461 0.015762 1.378991
C 4.189980 -0.339453 1.502403
C 4.313164 -0.655786 -0.916430
C 4.961632 -0.665898 0.354908
C 5.409683 -1.497907 3.293983
C 4.484058 -1.078859 -3.326722
C 7.299525 -0.159471 -0.147777
H -1.831986 0.738355 -2.736679
H -2.458347 3.201600 -1.155518
H -2.453801 3.029309 -2.927088
H -3.470071 -0.482592 -0.730777
H -3.955520 -0.221317 -2.429207
H -4.889620 3.350265 -1.579405
H -4.761493 2.244481 -2.978808
H -3.706264 1.936941 0.748628
H -5.393433 2.431756 0.478500
H -1.539785 1.191307 0.186372
H -3.845957 0.880604 2.878514
H -6.577795 -0.311005 -0.264724
H 0.433697 0.663369 0.960600
H -4.677770 -0.983352 4.328836
H -7.431632 -2.188236 1.189365
H -6.476817 -2.525588 3.490226
H 2.451050 -0.270412 -2.018739
H 2.280968 0.264544 2.294240
H 4.675966 -2.322906 3.384159
H 6.232131 -1.793498 2.622398
H 5.793931 -1.229084 4.290056
H 3.648861 -1.804112 -3.334199
H 4.110112 -0.084944 -3.638033
H 5.277897 -1.413065 -4.011058
H 7.158694 -0.180681 -1.241659
H 7.208965 0.875832 0.232893
H 8.283462 -0.574769 0.120240


