%chk=000215879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215879

0 1
O 1.716904 -0.737874 0.358914
O -0.194728 -1.040043 1.882204
O 0.676018 0.479821 -1.238327
O -3.543836 -4.770088 -1.871892
N 4.946779 0.979316 -0.190129
C -0.636332 -0.582363 0.597758
C 3.476979 0.928155 0.074207
C -1.385389 -1.684683 -0.127423
C -1.528364 0.615984 0.878542
C 3.030129 -0.504141 -0.247628
C 5.347275 2.207418 -0.935230
C 5.737071 0.760854 1.066193
C 0.616159 -0.176380 -0.226917
C -1.972550 -2.714040 0.633828
C -1.542452 -1.672067 -1.517871
C -1.864089 1.509626 -0.148143
C -2.042077 0.805491 2.168992
C 5.123787 3.539389 -0.214869
C 7.171478 0.357969 0.721675
C -2.685422 -3.731417 0.015745
C -2.256499 -2.683995 -2.165103
C -2.819442 -3.705767 -1.389753
C -2.711850 2.587436 0.118782
C -2.888885 1.886258 2.429712
C -3.226142 2.776800 1.405833
C -3.762785 -4.851455 -3.301570
H 3.194187 1.190721 1.115946
H 2.919869 1.639412 -0.577331
H 2.965177 -0.694333 -1.331401
H 3.638180 -1.279377 0.250972
H 6.423985 2.096485 -1.196861
H 4.793507 2.201614 -1.901657
H 5.740556 1.652053 1.731017
H 5.254989 -0.062165 1.640012
H -1.864339 -2.700989 1.722511
H -1.104137 -0.865720 -2.114720
H -1.455159 1.373602 -1.152518
H -1.771891 0.108889 2.966532
H 5.442184 4.380715 -0.840344
H 5.691280 3.596007 0.720772
H 4.068668 3.700426 0.032048
H 7.701185 -0.001264 1.610001
H 7.744070 1.194833 0.306609
H 7.186285 -0.445857 -0.026749
H 0.525034 -1.713268 1.786513
H -3.144675 -4.537329 0.583568
H -2.365587 -2.661584 -3.243885
H -2.971012 3.281135 -0.679161
H -3.286051 2.032397 3.432563
H -3.887516 3.616773 1.609886
H -4.334308 -3.985764 -3.648302
H -2.808704 -4.950034 -3.827029
H -4.354915 -5.772481 -3.384622


%chk=000215879-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215879

0 1
O 1.654368 -0.736137 0.551040
O -0.407094 -1.086882 2.052321
O 0.582395 0.554953 -1.064527
O -3.606206 -4.826082 -2.017321
N 4.923051 1.052874 -0.122182
C -0.757854 -0.590589 0.717775
C 3.526785 0.922564 0.350348
C -1.461817 -1.712227 -0.091657
C -1.673342 0.637630 0.921436
C 2.981177 -0.451132 -0.088769
C 5.233176 2.333954 -0.804742
C 5.923273 0.583910 0.869373
C 0.531321 -0.158457 -0.040355
C -2.270247 -2.634163 0.626478
C -1.376267 -1.838055 -1.496494
C -2.385582 1.193783 -0.168901
C -1.787808 1.229636 2.201880
C 5.278727 3.594456 0.101290
C 7.305635 0.297993 0.254338
C -2.968944 -3.652652 -0.040819
C -2.071505 -2.862281 -2.181417
C -2.872027 -3.772263 -1.450869
C -3.200299 2.330928 0.019804
C -2.610559 2.363631 2.389718
C -3.317334 2.920576 1.300199
C -3.549249 -4.982399 -3.472178
H 3.433432 1.018640 1.455931
H 2.900138 1.712318 -0.099578
H 2.866584 -0.488498 -1.184860
H 3.623754 -1.274327 0.259757
H 6.200942 2.221982 -1.327585
H 4.471945 2.478432 -1.594375
H 6.034988 1.301143 1.720742
H 5.534004 -0.354766 1.308620
H -2.333783 -2.541804 1.714591
H -0.766642 -1.137630 -2.077414
H -2.308262 0.740877 -1.161769
H -1.241139 0.785058 3.037042
H 5.478692 4.494987 -0.508656
H 6.075409 3.521504 0.863940
H 4.316371 3.747479 0.623801
H 7.971530 -0.156240 1.010832
H 7.797366 1.217950 -0.109151
H 7.208542 -0.400524 -0.595492
H 0.456216 -1.570704 1.972005
H -3.594849 -4.365954 0.504154
H -1.979473 -2.934256 -3.269246
H -3.746035 2.754038 -0.831088
H -2.698608 2.810024 3.386940
H -3.954172 3.800593 1.446126
H -3.939961 -4.084342 -3.989465
H -2.516362 -5.187387 -3.815673
H -4.191800 -5.847063 -3.693994


