%chk=000233046.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233046

0 1
O 2.049673 -0.002136 0.997992
O -1.453533 -0.000439 1.001534
N -1.266267 -0.000113 -1.285636
C 0.223674 -0.000521 -1.339768
C 0.779235 -1.254268 -0.701560
C 0.779982 1.252308 -0.700422
C 1.614520 -1.192331 0.422656
C 1.615250 1.188851 0.423723
C 0.457886 -2.525267 -1.203057
C 0.459377 2.523953 -1.200755
C -1.998075 -0.000164 -0.083113
C -3.503501 -0.000135 -0.292541
C 2.125878 -2.338380 1.055485
C 2.127333 2.334012 1.057566
C -4.233538 0.005524 1.058313
C 0.957255 -3.677711 -0.596142
C 0.959470 3.675546 -0.592815
C 1.784305 -3.582625 0.534061
C 1.786502 3.578938 0.537271
C -5.747735 0.003804 0.881730
H 0.508177 -0.000100 -2.431437
H -1.740836 -0.000104 -2.180084
H -0.193949 -2.609061 -2.071986
H -0.192459 2.608924 -2.069571
H -3.809352 0.883694 -0.886671
H -3.809668 -0.888715 -0.879470
H 2.761232 -2.233345 1.932072
H 2.762645 2.227804 1.934042
H -3.913126 0.888968 1.648767
H -3.912004 -0.872223 1.656678
H 0.700681 -4.656443 -0.994713
H 0.703463 4.654792 -0.990487
H 2.161729 -4.489292 1.006956
H 2.164494 4.484948 1.010973
H -6.095556 0.884985 0.331178
H -6.094549 -0.883309 0.340132
H -6.253914 0.008434 1.854996


%chk=000233046-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233046

0 1
O 1.858821 -0.001976 1.131556
O -1.392933 -0.003714 1.034669
N -1.287643 0.000780 -1.281430
C 0.206733 0.000134 -1.340566
C 0.792158 -1.263206 -0.714097
C 0.793473 1.262227 -0.712801
C 1.540092 -1.210669 0.485234
C 1.541465 1.207699 0.486392
C 0.571737 -2.531557 -1.301610
C 0.574430 2.531376 -1.299091
C -1.989217 -0.001694 -0.082127
C -3.518801 -0.001917 -0.233544
C 2.031964 -2.380621 1.103856
C 2.034716 2.376503 1.106081
C -4.254529 0.006540 1.121142
C 1.061571 -3.712073 -0.706858
C 1.065643 3.710774 -0.703265
C 1.789296 -3.632330 0.506888
C 1.793397 3.629053 0.510330
C -5.787560 0.002877 0.949001
H 0.435162 0.000630 -2.424991
H -1.806320 0.002635 -2.161308
H -0.007600 -2.589951 -2.231809
H -0.004914 2.591289 -2.229188
H -3.823227 0.882503 -0.831570
H -3.823194 -0.894073 -0.820005
H 2.592886 -2.286208 2.038263
H 2.595612 2.280574 2.040350
H -3.934748 0.892708 1.699365
H -3.931762 -0.870367 1.711604
H 0.879082 -4.683523 -1.177947
H 0.884206 4.682876 -1.173416
H 2.168912 -4.542948 0.982791
H 2.174089 4.538789 0.987059
H -6.132627 0.892081 0.387201
H -6.129535 -0.895206 0.399566
H -6.296140 0.008789 1.930173


