%chk=000269307.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269307

0 1
O -4.679522 0.006843 1.014477
O -3.284804 2.294000 0.849226
O 6.356739 0.248781 1.097653
O 5.899001 -0.458655 -0.973352
C 1.618816 -0.032828 0.039248
C 0.592709 0.068904 -1.100318
C 3.052030 0.015846 -0.500081
C -0.809187 0.008733 -0.557152
C 4.073637 -0.067158 0.639155
C -1.424417 1.188405 -0.095559
C -1.496059 -1.207611 -0.501765
C -2.719754 1.124418 0.409434
C -2.802808 -1.279365 0.008031
C -3.413958 -0.117917 0.463268
C 5.472337 -0.133113 0.108070
C -5.544883 -1.150575 0.941600
H 1.452158 -0.970457 0.605637
H 1.451509 0.789193 0.763671
H 0.760698 -0.742749 -1.837415
H 0.744672 1.010500 -1.667673
H 3.212397 0.946172 -1.081669
H 3.223909 -0.813593 -1.218137
H 3.968580 0.796913 1.332904
H 3.888352 -0.964567 1.271822
H -0.909061 2.146518 -0.127621
H -1.018878 -2.119300 -0.855823
H -3.314955 -2.236769 0.041807
H -4.216419 2.138936 1.172862
H 7.304526 0.211041 0.803066
H -5.134375 -1.964550 1.546413
H -5.694503 -1.450473 -0.099641
H -6.474087 -0.764021 1.379861


%chk=000269307-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269307

0 1
O -4.772526 0.060022 0.954494
O -3.369676 2.332696 0.811234
O 6.462287 -0.043355 1.242908
O 5.970786 0.029413 -1.024427
C 1.651029 -0.034047 0.017589
C 0.604434 0.042506 -1.128636
C 3.102527 0.027240 -0.504091
C -0.829168 0.003278 -0.619136
C 4.130448 -0.056930 0.639890
C -1.453457 1.191035 -0.153568
C -1.549985 -1.213738 -0.558256
C -2.759937 1.156378 0.359586
C -2.869196 -1.261969 -0.041820
C -3.471358 -0.076431 0.417001
C 5.567055 -0.017457 0.157767
C -5.590824 -1.147696 1.054572
H 1.491889 -0.971748 0.587870
H 1.468791 0.797523 0.728181
H 0.781115 -0.799415 -1.826468
H 0.779395 0.974082 -1.702466
H 3.259233 0.964582 -1.072150
H 3.282219 -0.796862 -1.221167
H 3.992556 0.769028 1.364927
H 3.997100 -0.988407 1.225270
H -0.934353 2.154813 -0.191294
H -1.082724 -2.136887 -0.920310
H -3.406851 -2.214759 -0.008983
H -4.285042 2.106680 1.126820
H 7.394948 -0.019878 0.894315
H -5.112755 -1.896452 1.715174
H -5.767722 -1.590665 0.055519
H -6.545838 -0.821080 1.491654


