%chk=000235041.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235041

0 1
O -1.542526 2.021512 1.278356
O 6.098031 -2.044461 -0.526402
O 4.394546 -2.571123 0.699757
O -6.702117 -1.054532 -0.870496
O -6.070293 1.014652 -0.841328
N 5.008767 -1.811344 -0.031255
N -5.871380 -0.178766 -0.692409
C 2.550498 1.043057 -0.057602
C 1.238556 1.402147 0.550328
C -2.261678 -0.038680 0.380386
C 0.129946 0.737083 0.171644
C 3.142172 -0.189840 0.237986
C 3.193659 1.940896 -0.926476
C -1.227767 1.013974 0.677465
C 4.379149 -0.505455 -0.342149
C 1.284234 2.479308 1.571314
C -3.544109 0.372749 -0.001415
C 4.424661 1.608820 -1.499272
C -1.971250 -1.403199 0.517591
C 5.029487 0.383237 -1.210143
C -4.517015 -0.600695 -0.268285
C -2.956724 -2.363779 0.262755
C -4.234451 -1.970370 -0.136160
H 0.192104 -0.047968 -0.586534
H 2.656748 -0.903981 0.912826
H 2.725111 2.900426 -1.158750
H 1.437358 2.060920 2.579950
H 2.085758 3.209132 1.401815
H 0.328132 3.041581 1.623930
H -3.788870 1.440912 -0.086127
H 4.917532 2.309474 -2.175952
H -0.974523 -1.721506 0.833472
H 5.995863 0.110694 -1.649399
H -2.726121 -3.424219 0.376732
H -5.016588 -2.709957 -0.344454


%chk=000235041-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235041

0 1
O -1.654698 2.199371 0.658994
O 5.861402 -2.392171 -0.671508
O 3.752544 -2.891845 0.037381
O -6.888274 -1.330497 0.022371
O -6.317414 0.875635 0.108349
N 4.661438 -2.055797 -0.339986
N -6.018903 -0.377810 0.083157
C 2.628405 1.139056 -0.077373
C 1.250671 1.586913 0.288583
C -2.238670 -0.094413 0.236020
C 0.183708 0.741821 0.053530
C 2.996938 -0.231716 -0.035767
C 3.616946 2.086616 -0.473131
C -1.235575 1.035634 0.342015
C 4.300828 -0.612983 -0.401213
C 1.103818 2.970313 0.888860
C -3.611027 0.259331 0.204906
C 4.917021 1.680054 -0.843409
C -1.880220 -1.469264 0.200262
C 5.279428 0.318066 -0.811307
C -4.578563 -0.756028 0.126347
C -2.872311 -2.473591 0.131305
C -4.237252 -2.126905 0.087860
H 0.388188 -0.219749 -0.429990
H 2.304370 -1.003295 0.309998
H 3.358546 3.149371 -0.513824
H 0.253192 3.007541 1.586206
H 2.027883 3.289342 1.399453
H 0.862198 3.713492 0.103251
H -3.901120 1.313006 0.248016
H 5.650753 2.428736 -1.157768
H -0.829659 -1.771908 0.250398
H 6.279572 -0.028464 -1.083170
H -2.579286 -3.527874 0.113658
H -5.027977 -2.879289 0.029227


