%chk=000257994.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257994

0 1
O 2.011586 -0.331836 0.190219
N -7.748849 -1.067445 0.191757
C 3.386118 -0.195760 0.190143
C 6.170598 -0.239716 0.264112
C -2.646264 0.633556 -0.156728
C 1.210748 0.852431 -0.104205
C 4.089346 0.982056 -0.073405
C 4.047332 -1.405296 0.492458
C 5.489618 0.945475 -0.032758
C 5.435051 -1.414741 0.526328
C -1.260367 1.119905 -0.248357
C -0.194319 0.347626 -0.013548
C 7.663852 -0.278302 0.307382
C -3.011982 -0.616660 -0.685133
C -3.621225 1.440562 0.458327
C -4.331663 -1.059718 -0.597589
C -4.940674 1.001726 0.552929
C -5.297958 -0.250775 0.023440
C -6.653972 -0.702800 0.116572
H 1.433523 1.627914 0.652901
H 1.470845 1.212475 -1.117419
H 3.585092 1.912586 -0.305886
H 3.462240 -2.299965 0.691981
H 6.047590 1.858648 -0.236790
H 5.962591 -2.339720 0.758112
H -1.161732 2.175047 -0.516621
H -0.272438 -0.708666 0.270119
H -2.262452 -1.241049 -1.172235
H -3.343113 2.410522 0.870078
H 8.026033 -0.584687 1.299093
H 8.065416 -0.994493 -0.423594
H 8.119746 0.695100 0.086264
H -4.613752 -2.029924 -1.009268
H -5.694767 1.625623 1.034819


%chk=000257994-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257994

0 1
O 2.041501 -0.481419 0.027147
N -8.027697 -0.652735 -0.341951
C 3.438926 -0.296980 0.070912
C 6.288647 -0.138916 0.054170
C -2.667662 0.512765 -0.039974
C 1.203443 0.597767 0.585949
C 4.085043 0.859388 0.568062
C 4.208134 -1.373692 -0.436033
C 5.499635 0.923032 0.553460
C 5.611796 -1.288351 -0.441205
C -1.238877 0.874805 0.010095
C -0.222481 0.129459 0.528334
C 7.806235 -0.064811 0.041902
C -3.185023 -0.705405 0.490874
C -3.583022 1.418157 -0.649497
C -4.553679 -1.006285 0.413145
C -4.956178 1.128856 -0.733013
C -5.457100 -0.090729 -0.200542
C -6.860311 -0.397302 -0.278114
H 1.512628 0.781233 1.639151
H 1.344963 1.535425 0.010309
H 3.516296 1.708459 0.959075
H 3.687522 -2.257455 -0.817829
H 5.992603 1.823272 0.940104
H 6.195973 -2.128467 -0.836742
H -0.988960 1.854884 -0.423570
H -0.399544 -0.866619 0.954398
H -2.511600 -1.423993 0.968783
H -3.206225 2.360352 -1.064614
H 8.255429 -0.870721 0.652920
H 8.208065 -0.173014 -0.983324
H 8.166786 0.898328 0.442669
H -4.938118 -1.945187 0.823902
H -5.645349 1.835601 -1.205453


