%chk=000221918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221918

0 1
O 2.076993 1.693019 0.602672
O -1.357005 0.793898 0.929036
O -1.553140 -0.052408 -1.158707
C -2.889885 -2.261211 0.592087
C -3.003200 -2.825619 -0.829277
C -3.094459 -0.741243 0.633837
C -2.730499 -4.335140 -0.856945
C 4.329332 2.310243 0.662165
C 3.387071 1.182353 0.242202
C 5.789290 1.956741 0.358569
C -2.848759 -4.899916 -2.270692
C -1.952468 -0.015324 -0.019727
C 0.999333 0.780119 0.297741
C -0.248080 1.638970 0.514452
C 6.734529 3.080630 0.776011
H -1.904277 -2.519808 1.028339
H -3.643536 -2.739838 1.249475
H -2.292545 -2.298368 -1.502239
H -4.007273 -2.615195 -1.244065
H -3.212927 -0.401815 1.686956
H -4.036318 -0.459893 0.114264
H -3.436692 -4.860627 -0.184830
H -1.718456 -4.542935 -0.457086
H 4.192835 2.522517 1.741602
H 4.036667 3.246694 0.146012
H 3.572237 0.246194 0.795061
H 3.412006 0.990136 -0.843882
H 5.911518 1.749772 -0.723159
H 6.069031 1.021010 0.881908
H -2.641830 -5.975625 -2.287024
H -2.141463 -4.418812 -2.956897
H -3.853328 -4.751744 -2.682993
H 1.079559 0.415139 -0.741419
H 1.036364 -0.071714 0.999816
H -0.134511 2.317911 1.382240
H -0.537798 2.203271 -0.387257
H 6.665945 3.288410 1.850244
H 7.777075 2.823502 0.557277
H 6.509266 4.014906 0.248435


%chk=000221918-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221918

0 1
O 1.809298 1.610575 0.800585
O -1.722660 0.593489 1.326012
O -2.249310 0.972336 -0.918736
C -3.143320 -2.038232 0.489397
C -2.561131 -2.539615 -0.850700
C -3.635715 -0.561970 0.446537
C -2.102001 -4.014192 -0.786217
C 4.161501 2.062607 0.422516
C 3.076373 0.983092 0.395923
C 5.553449 1.511404 0.035100
C -1.515981 -4.517195 -2.123317
C -2.503176 0.409389 0.170452
C 0.678817 0.683483 0.739535
C -0.541597 1.490297 1.197386
C 6.640910 2.607490 0.035148
H -2.388368 -2.142596 1.292607
H -4.004299 -2.674821 0.774769
H -1.704350 -1.903217 -1.151338
H -3.322557 -2.425501 -1.649787
H -4.098279 -0.303221 1.415684
H -4.386131 -0.437882 -0.353392
H -2.960058 -4.653162 -0.492765
H -1.343764 -4.124854 0.016057
H 4.199901 2.504482 1.437076
H 3.870464 2.875699 -0.270102
H 3.324728 0.152789 1.095980
H 2.974575 0.551460 -0.625938
H 5.500388 1.044728 -0.969936
H 5.841595 0.704794 0.739870
H -1.188651 -5.570702 -2.051365
H -0.641502 -3.910320 -2.425133
H -2.264797 -4.449923 -2.934940
H 0.531040 0.308190 -0.295763
H 0.842073 -0.184461 1.415972
H -0.381990 1.896234 2.207603
H -0.761481 2.299916 0.481530
H 6.731340 3.075320 1.033482
H 7.629713 2.195142 -0.236965
H 6.395552 3.407147 -0.688624


