%chk=000229674.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229674

0 1
O 0.370269 0.289232 -0.780004
O -0.077536 -1.980907 -0.463448
C 1.933047 -0.991641 0.587546
C 1.781620 0.181333 -0.431017
C 2.102431 1.611483 0.074208
C 1.278581 -2.245265 -0.060260
C -0.196623 -0.879751 -1.378836
C 3.409341 -1.324208 0.838879
C 1.214171 -0.674618 1.901726
C -1.690858 -0.612621 -1.554966
C 3.598255 1.796635 0.341952
C 1.623923 2.642941 -0.956502
C -2.367730 -0.247575 -0.227432
C -3.865124 0.021436 -0.409750
C -4.555970 0.382902 0.913644
C -4.210239 1.789551 1.397783
H 2.348205 -0.042072 -1.360043
H 1.534963 1.779008 1.023931
H 1.846154 -2.607385 -0.933458
H 1.149332 -3.068390 0.664424
H 0.344988 -1.120579 -2.315441
H 3.516404 -2.206510 1.479518
H 3.956585 -1.517374 -0.088829
H 3.919483 -0.493753 1.352455
H 1.640896 0.198736 2.403894
H 0.152064 -0.460153 1.697464
H 1.251669 -1.513744 2.602196
H -2.163978 -1.516365 -1.988345
H -1.822929 0.206820 -2.288687
H 3.810876 2.821526 0.667320
H 3.956436 1.120961 1.132625
H 4.200377 1.610377 -0.553575
H 0.558532 2.489970 -1.186973
H 2.173158 2.567016 -1.899502
H 1.740335 3.663645 -0.581171
H -2.203871 -1.067679 0.501054
H -1.862272 0.640108 0.205819
H -4.016594 0.835008 -1.144782
H -4.354680 -0.872310 -0.843067
H -5.653090 0.296486 0.785685
H -4.285123 -0.357246 1.692256
H -3.131007 1.903934 1.556008
H -4.709190 2.017797 2.345403
H -4.513178 2.551247 0.670897


%chk=000229674-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229674

0 1
O 0.327350 0.361545 -0.636133
O -0.133745 -1.962753 -0.250217
C 2.040709 -0.964072 0.600846
C 1.795126 0.231294 -0.391948
C 2.217904 1.669111 0.014083
C 1.292500 -2.201043 0.005593
C -0.271894 -0.846590 -1.187104
C 3.531686 -1.391594 0.660750
C 1.488734 -0.650128 2.010841
C -1.755391 -0.591089 -1.438859
C 3.700124 1.816347 0.432808
C 1.912792 2.643565 -1.152391
C -2.551820 -0.212840 -0.170567
C -4.041473 0.056019 -0.483090
C -4.905687 0.358081 0.766233
C -4.518119 1.664831 1.495460
H 2.285901 -0.031917 -1.362652
H 1.577291 1.955225 0.872071
H 1.789228 -2.507458 -0.945055
H 1.326488 -3.044709 0.715964
H 0.274837 -1.115604 -2.126485
H 3.615253 -2.399105 1.113286
H 3.982920 -1.440392 -0.349082
H 4.140766 -0.708398 1.271748
H 2.017748 0.203325 2.472148
H 0.413337 -0.408511 1.957169
H 1.614306 -1.523790 2.678125
H -2.180420 -1.506249 -1.895106
H -1.834854 0.218191 -2.190849
H 3.950338 2.889769 0.520562
H 3.917444 1.348471 1.408011
H 4.381016 1.377220 -0.320886
H 0.865953 2.546666 -1.482051
H 2.573020 2.436054 -2.017854
H 2.089757 3.688770 -0.838093
H -2.466209 -1.034545 0.566266
H -2.085126 0.678735 0.286526
H -4.121412 0.906672 -1.193385
H -4.463950 -0.827676 -1.006098
H -5.969830 0.418448 0.460592
H -4.831183 -0.493820 1.472916
H -3.489736 1.616594 1.896538
H -5.199268 1.865566 2.343156
H -4.570307 2.529792 0.806814


