%chk=000236934.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236934

0 1
O -0.848944 0.947084 -2.880015
O -0.650635 -1.306690 1.928651
N -2.699444 -0.134966 0.044782
C -2.003262 -0.274372 -1.268131
C -1.783983 -1.292073 -0.158744
C -0.983039 0.769795 -1.685734
C -0.549716 -1.341828 0.724537
C -4.150784 -0.403013 0.086145
C -0.147701 1.501020 -0.694187
C 0.763275 -1.518436 0.037006
C 1.195995 1.738822 -1.040211
C 0.865474 -1.974544 -1.285265
C -0.649516 1.987644 0.518767
C 1.927932 -1.223360 0.764822
C 2.031896 2.434227 -0.166718
C 2.122566 -2.129932 -1.874126
C 0.191339 2.691161 1.388436
C 3.183321 -1.376135 0.171323
C 1.528925 2.910590 1.050329
C 3.280690 -1.829303 -1.147937
H -2.570239 -0.610144 -2.158908
H -2.189943 -2.309903 -0.300965
H -4.681045 0.532187 -0.169815
H -4.416639 -0.661633 1.128643
H -4.523421 -1.200779 -0.572175
H 1.576390 1.375921 -1.997651
H -0.029458 -2.209473 -1.861673
H -1.695080 1.821635 0.796361
H 1.839315 -0.873455 1.797523
H 3.071955 2.611070 -0.433642
H 2.200540 -2.482570 -2.901729
H -0.201853 3.063133 2.333456
H 4.083894 -1.143426 0.737547
H 2.181326 3.455108 1.732007
H 4.259469 -1.949460 -1.612008


%chk=000236934-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236934

0 1
O -0.366903 0.981743 -2.805463
O -0.145936 -0.832565 1.826816
N -2.437806 -0.125031 0.140677
C -1.749642 -0.016736 -1.186093
C -1.446480 -1.176089 -0.194750
C -0.749128 1.049515 -1.591311
C -0.187090 -1.291258 0.649719
C -3.871229 -0.502013 0.119809
C -0.229771 2.108518 -0.675051
C 0.973890 -2.015132 0.039254
C 0.678718 3.056042 -1.232235
C 1.040953 -2.294374 -1.353328
C -0.599180 2.217648 0.695584
C 2.045722 -2.413297 0.884440
C 1.202206 4.093272 -0.440793
C 2.160255 -2.967991 -1.886361
C -0.069128 3.262416 1.483285
C 3.158074 -3.091189 0.350694
C 0.827887 4.199846 0.922871
C 3.216654 -3.371907 -1.037106
H -2.313311 -0.356044 -2.072539
H -1.824319 -2.150692 -0.551088
H -4.475294 0.410087 -0.020860
H -4.127670 -0.951622 1.093932
H -4.127956 -1.226745 -0.688118
H 0.950811 2.952064 -2.287931
H 0.242313 -1.960176 -2.024206
H -1.287865 1.483587 1.124414
H 1.979611 -2.175044 1.951395
H 1.898823 4.817829 -0.876747
H 2.214187 -3.169422 -2.961560
H -0.351975 3.337680 2.538767
H 3.979069 -3.399661 1.006938
H 1.237194 5.006983 1.541493
H 4.083914 -3.896340 -1.453846


