%chk=000279313.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279313

0 1
O -2.650107 0.784027 1.102011
O -3.814456 -2.238807 0.607865
O -3.482773 0.156545 -2.011357
O -6.110115 1.394011 0.247741
O 0.208789 -1.298339 2.156046
O 5.326480 0.610566 -1.190382
O 4.539695 -1.080658 0.145823
N -0.731880 -0.334929 0.286903
N 1.701222 -0.499353 0.558151
N 3.122069 0.326704 -1.155904
C -3.052669 -1.272907 -0.088895
C -3.956633 -0.167014 -0.698015
C -2.085632 -0.518081 0.866921
C -3.697654 1.099238 0.144850
C -4.905635 1.507937 1.007610
C -0.554127 0.306807 -0.928799
C 0.447441 -0.761190 1.103824
C 0.706144 0.527178 -1.424035
C 1.833518 0.093735 -0.634935
C 4.338982 -0.165013 -0.599975
C 6.710833 0.313147 -0.805179
C 6.975695 0.796679 0.602630
H -2.528601 -1.877839 -0.864155
H -5.029600 -0.459241 -0.733001
H -1.988618 -0.984528 1.885327
H -3.310838 1.933308 -0.480031
H -4.789585 2.528762 1.411029
H -5.059341 0.806719 1.851793
H -4.315365 -1.839219 1.356427
H -3.885130 -0.440201 -2.679475
H -1.453460 0.620199 -1.489841
H -6.180912 2.126892 -0.400505
H 0.847675 1.007535 -2.385915
H 3.205210 0.993402 -1.933901
H 6.878369 -0.772030 -0.925162
H 7.254114 0.887428 -1.578856
H 8.037673 0.715227 0.863671
H 6.676921 1.844411 0.737317
H 6.411500 0.204693 1.342479


%chk=000279313-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279313

0 1
O -2.750573 0.468208 1.289893
O -4.157699 -2.231423 0.478155
O -3.437224 0.399252 -2.047674
O -5.943913 2.058002 0.126758
O 0.062187 -1.764739 2.085330
O 5.321384 0.431454 -1.182399
O 4.561746 -0.794591 0.685443
N -0.800056 -0.579915 0.234050
N 1.608388 -0.797569 0.609379
N 3.103386 0.199307 -0.937299
C -3.224882 -1.335204 -0.209465
C -3.972885 -0.074484 -0.756694
C -2.161749 -0.783238 0.776929
C -3.691917 1.036524 0.281538
C -4.938436 1.515702 1.047777
C -0.564165 0.126830 -0.927976
C 0.323451 -1.094949 1.052799
C 0.724837 0.383983 -1.351329
C 1.800575 -0.100988 -0.513926
C 4.333574 -0.136561 -0.342353
C 6.730496 0.241218 -0.730081
C 7.130158 1.307313 0.293498
H -2.786197 -1.949093 -1.011810
H -5.051758 -0.294991 -0.849651
H -2.013658 -1.450509 1.643137
H -3.203243 1.887941 -0.234019
H -4.642011 2.251210 1.821053
H -5.434565 0.666771 1.546782
H -4.428194 -1.831066 1.344950
H -3.783026 -0.168785 -2.780394
H -1.439720 0.451781 -1.502102
H -5.600295 2.891119 -0.284336
H 0.902662 0.938560 -2.275164
H 3.199490 0.746969 -1.795609
H 6.828103 -0.774847 -0.308483
H 7.312801 0.321578 -1.662150
H 8.201295 1.196513 0.545525
H 6.974906 2.322016 -0.111970
H 6.545928 1.196503 1.221989


