%chk=000238363.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238363

0 1
O -2.230588 3.296596 0.102281
O -1.738271 2.231981 2.007622
N 3.373157 0.401422 -1.229806
C -1.152388 1.214456 -0.177718
C 0.323494 0.942184 0.178569
C 0.988456 0.030083 -0.859597
C -1.987381 -0.046747 -0.132606
C 2.423629 -0.237632 -0.490384
C -1.708685 2.232514 0.800585
C -2.284024 -0.667334 1.090228
C -2.450855 -0.609499 -1.330552
C 2.758356 -1.110108 0.566118
C -3.037319 -1.843138 1.111535
C -3.202995 -1.787600 -1.302635
C -3.496508 -2.406544 -0.083817
C 4.105384 -1.320964 0.862906
C 4.679759 0.183387 -0.927331
C 5.087923 -0.668426 0.110619
H -1.198480 1.662370 -1.210007
H 0.389847 0.489555 1.189673
H 0.878141 1.902189 0.236196
H 0.934688 0.497896 -1.868295
H 0.435828 -0.929966 -0.945097
H -1.935737 -0.222603 2.025859
H -2.230271 -0.132747 -2.284219
H 1.977349 -1.607696 1.135375
H -3.268914 -2.320264 2.063017
H -3.562250 -2.222176 -2.234424
H -4.083295 -3.323023 -0.064628
H 4.390157 -1.989929 1.675040
H -2.618915 3.996406 0.692988
H 5.408837 0.717417 -1.547901
H 6.142973 -0.816258 0.322409


%chk=000238363-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238363

0 1
O -2.364334 3.289136 -0.215402
O -1.578550 2.473539 1.809273
N 3.303159 0.709157 -0.712871
C -1.118562 1.214865 -0.282216
C 0.349261 0.921520 0.147955
C 1.011291 -0.167734 -0.733006
C -2.030673 -0.015709 -0.156840
C 2.479874 -0.342252 -0.392951
C -1.679320 2.350187 0.568031
C -2.285174 -0.605099 1.108879
C -2.610951 -0.593115 -1.312800
C 2.974906 -1.515697 0.231520
C -3.098854 -1.754657 1.210600
C -3.424574 -1.745003 -1.211826
C -3.669615 -2.330774 0.051012
C 4.352047 -1.612715 0.533294
C 4.629395 0.602797 -0.415217
C 5.201781 -0.532427 0.204295
H -1.127924 1.554594 -1.332989
H 0.362793 0.618847 1.211229
H 0.949448 1.846915 0.065038
H 0.931838 0.137977 -1.794654
H 0.476225 -1.127472 -0.618666
H -1.860307 -0.151522 2.012019
H -2.427735 -0.139008 -2.294211
H 2.288118 -2.333977 0.472314
H -3.292331 -2.198274 2.193899
H -3.866296 -2.180996 -2.114979
H -4.301654 -3.222264 0.131759
H 4.753171 -2.511598 1.013981
H -2.740259 3.996862 0.377041
H 5.250180 1.464060 -0.689992
H 6.274727 -0.564363 0.418484


