%chk=000233927.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233927

0 1
O -3.461764 1.121685 -0.422461
O -3.020711 -1.126301 -0.618421
N -5.180732 -0.313267 -0.228002
C 2.222736 0.238558 0.092040
C 2.938387 1.379067 0.582268
C 4.410121 1.154169 0.340937
C 4.514991 -0.245683 -0.349629
C 3.097595 -0.748965 -0.467421
C 0.831642 0.100683 0.150968
C 0.114852 1.198123 0.751336
C 2.233997 2.407234 1.145267
C 2.559375 -1.898213 -0.978883
C 0.808135 2.296574 1.220573
C -1.381167 1.130455 0.861378
C 0.296138 -1.111931 -0.392566
C 1.136153 -2.060991 -0.930430
C -2.031815 1.416726 -0.491123
C -3.815523 -0.220471 -0.459154
C -5.870780 -1.594156 -0.485442
H 4.835611 1.944940 -0.300692
H 4.977271 1.171667 1.287688
H 5.135229 -0.936100 0.247747
H 4.993408 -0.163403 -1.340772
H 2.715575 3.297863 1.535417
H 3.168738 -2.682527 -1.415226
H 0.268147 3.127523 1.674312
H -1.767573 1.830287 1.628819
H -1.688262 0.119400 1.216834
H -0.787409 -1.272916 -0.376496
H 0.719120 -2.980890 -1.341636
H -1.584827 0.825936 -1.311870
H -2.053164 2.491248 -0.745933
H -5.748214 0.529948 -0.212637
H -6.368731 -1.606076 -1.469312
H -6.623838 -1.766501 0.302965
H -5.151411 -2.437195 -0.457046


%chk=000233927-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233927

0 1
O -3.536407 1.132693 -0.403863
O -3.177832 -1.191770 -0.656211
N -5.326402 -0.264349 -0.409831
C 2.299371 0.244499 0.097378
C 2.989188 1.396088 0.578343
C 4.487077 1.219420 0.331122
C 4.620671 -0.193449 -0.359707
C 3.188763 -0.720503 -0.460565
C 0.881816 0.072737 0.168619
C 0.125941 1.147260 0.775393
C 2.245485 2.423698 1.158930
C 2.659623 -1.906769 -0.971870
C 0.818486 2.277063 1.248094
C -1.388994 1.061664 0.883252
C 0.360417 -1.156844 -0.366913
C 1.236958 -2.106647 -0.915352
C -2.064690 1.337484 -0.478955
C -3.955213 -0.210529 -0.502314
C -6.064877 -1.526929 -0.482838
H 4.886965 2.021988 -0.316655
H 5.060180 1.260043 1.276348
H 5.259307 -0.872527 0.235792
H 5.091031 -0.110067 -1.357425
H 2.720994 3.330374 1.549834
H 3.299738 -2.680714 -1.410850
H 0.239865 3.085410 1.713707
H -1.765607 1.789170 1.624426
H -1.693545 0.053114 1.218399
H -0.717337 -1.359162 -0.357442
H 0.821566 -3.037861 -1.318441
H -1.653102 0.678222 -1.262265
H -1.956227 2.391696 -0.779307
H -5.820125 0.620982 -0.295096
H -6.752756 -1.541971 -1.348702
H -6.646959 -1.706312 0.440121
H -5.332071 -2.340698 -0.601758


