%chk=000241076.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241076

0 1
O 2.972150 -1.638167 0.454213
O 4.213902 0.555394 0.469945
O -3.050874 0.608025 -0.005080
O -2.007620 -1.401331 -0.033296
C 0.261531 0.549787 -0.860649
C -1.155222 0.483065 -1.364383
C 0.901351 -0.637005 -0.434204
C 2.214214 -0.584135 0.005001
C 0.940889 1.761931 -0.841182
C 2.919044 0.668263 0.016705
C 2.279535 1.824755 -0.403323
C -2.057829 -0.256164 -0.413209
C -4.076357 0.100865 0.902987
C 2.324447 -2.934447 0.517565
C 4.998143 1.771763 0.528646
C -5.296235 -0.228799 0.101360
C -6.426000 -0.666736 0.650155
H -1.561017 1.503063 -1.558942
H -1.174032 -0.039769 -2.349792
H 0.341521 -1.573766 -0.442039
H 0.453260 2.680216 -1.161094
H 2.789466 2.783731 -0.400016
H -3.681797 -0.772016 1.461078
H -4.227051 0.959287 1.585652
H 2.040505 -3.266587 -0.484839
H 1.465025 -2.901066 1.194056
H 3.127500 -3.559343 0.929141
H 4.547159 2.484761 1.224186
H 5.121795 2.195827 -0.471497
H 5.954175 1.395520 0.916865
H -5.184859 -0.074785 -0.974640
H -7.308875 -0.902613 0.072059
H -6.562544 -0.828325 1.709871


%chk=000241076-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241076

0 1
O 2.899839 -1.746637 0.509683
O 4.218881 0.550322 0.528236
O -3.045430 0.903702 0.013905
O -2.212657 -1.280322 0.015282
C 0.229711 0.495507 -0.928170
C -1.202546 0.429960 -1.460499
C 0.872217 -0.681521 -0.458707
C 2.195698 -0.639841 0.023366
C 0.932431 1.715429 -0.906099
C 2.908748 0.604361 0.037212
C 2.265764 1.769961 -0.428967
C -2.181082 -0.106403 -0.420972
C -4.081187 0.503639 1.033138
C 2.193983 -3.030683 0.525147
C 4.969093 1.806470 0.560428
C -5.360743 0.097451 0.346154
C -5.907536 -1.138900 0.451777
H -1.535510 1.426334 -1.789945
H -1.251029 -0.257301 -2.327190
H 0.310664 -1.620453 -0.456156
H 0.448279 2.632949 -1.258682
H 2.792218 2.728865 -0.423708
H -3.674936 -0.314288 1.651811
H -4.205722 1.421226 1.631987
H 1.910279 -3.347491 -0.497619
H 1.288379 -2.986481 1.160806
H 2.914604 -3.744875 0.949636
H 4.478199 2.554473 1.213961
H 5.094814 2.229368 -0.455973
H 5.952008 1.539343 0.975293
H -5.850549 0.871805 -0.260483
H -6.848765 -1.393837 -0.048202
H -5.422817 -1.930932 1.034849


