%chk=000192493.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192493

0 1
O -0.119659 0.350510 2.287832
O 6.016566 -0.677673 0.793970
O 4.992542 -0.678681 -1.225161
N -0.548450 0.799089 0.036501
N -5.147132 -1.138964 0.532038
C -0.026053 -1.492871 0.613084
C 1.391656 -1.978971 0.969121
C -0.240455 -1.327508 -0.876175
C -1.080886 -2.411732 1.264442
C -0.221553 -0.039976 1.152226
C -0.545587 0.034891 -1.177073
C 2.495541 -1.159584 0.291080
C -0.164014 -2.261748 -1.892286
C -2.494385 -1.966158 1.003454
C -0.745719 0.460185 -2.485044
C -0.933472 2.182724 0.136036
C 3.881366 -1.622932 0.751916
C -0.384268 -1.840891 -3.217573
C -0.663710 -0.504968 -3.503604
C -3.225685 -2.493250 -0.070424
C -3.106138 -1.019021 1.837882
C -2.039402 2.662701 -0.586267
C -0.200236 3.034396 0.981324
C 4.961714 -0.947307 -0.048243
C -4.543997 -2.054642 -0.270145
C -4.427514 -0.632975 1.568448
C -2.386121 4.011344 -0.480565
C -0.568698 4.377266 1.077721
C -1.652964 4.870659 0.344010
C 7.196079 -0.014328 0.238152
C 6.916894 1.462473 0.053521
H 1.518848 -1.939966 2.072234
H 1.491387 -3.045227 0.684221
H -0.897899 -2.457563 2.361660
H -0.932344 -3.448834 0.897011
H 2.369755 -0.079946 0.512121
H 2.417933 -1.246630 -0.815494
H 0.068549 -3.302818 -1.678444
H -0.945312 1.502143 -2.724174
H 3.993671 -2.722320 0.631120
H 4.024800 -1.426384 1.837575
H -0.326040 -2.568119 -4.025044
H -0.819440 -0.193735 -4.537387
H -2.780186 -3.217314 -0.747201
H -2.564293 -0.578643 2.675365
H -2.633191 1.991607 -1.205459
H 0.631606 2.644036 1.568874
H -5.149866 -2.440295 -1.098250
H -4.940698 0.106926 2.194288
H -3.240479 4.391774 -1.040218
H -0.005681 5.043411 1.731351
H -1.929981 5.920015 0.420756
H 7.468083 -0.517005 -0.706820
H 7.942282 -0.222987 1.026328
H 7.825207 2.012431 -0.218599
H 6.177908 1.629768 -0.745068
H 6.512324 1.914216 0.968356


%chk=000192493-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192493

0 1
O -0.165484 0.610133 2.199550
O 6.266553 -1.052514 0.103982
O 4.915403 0.838107 -0.126336
N -0.748921 0.891277 -0.094321
N -5.253545 -1.419792 0.627341
C -0.012564 -1.296038 0.578819
C 1.449497 -1.698141 0.937137
C -0.290391 -1.239249 -0.914210
C -1.001387 -2.248309 1.352434
C -0.291628 0.163287 1.029788
C -0.732940 0.063169 -1.263174
C 2.536083 -0.805191 0.302566
C -0.153302 -2.222246 -1.905398
C -2.475315 -1.969006 1.108027
C -1.033120 0.412254 -2.593168
C -1.217705 2.249411 -0.039687
C 3.949406 -1.299887 0.670475
C -0.462496 -1.895941 -3.251456
C -0.894266 -0.590483 -3.584538
C -3.211569 -2.676572 0.124509
C -3.172997 -0.979289 1.848032
C -2.461227 2.591980 -0.627025
C -0.449858 3.232101 0.629975
C 5.046267 -0.370698 0.174520
C -4.576687 -2.374721 -0.078869
C -4.538858 -0.742107 1.576757
C -2.921971 3.924273 -0.561458
C -0.925335 4.559315 0.699430
C -2.156146 4.912903 0.099419
C 7.460774 -0.246730 -0.302666
C 8.085162 0.447755 0.910904
H 1.544129 -1.662146 2.041070
H 1.601593 -2.753187 0.628801
H -0.768841 -2.138928 2.428794
H -0.757223 -3.285908 1.055860
H 2.422678 0.238703 0.647941
H 2.425284 -0.789603 -0.797643
H 0.195179 -3.229851 -1.649179
H -1.348741 1.423893 -2.862584
H 4.143784 -2.315986 0.281338
H 4.051285 -1.368737 1.773472
H -0.361399 -2.653361 -4.035878
H -1.121384 -0.343946 -4.627619
H -2.731536 -3.454952 -0.478747
H -2.660973 -0.400014 2.623995
H -3.072823 1.817869 -1.102003
H 0.499175 2.954021 1.095678
H -5.162276 -2.912577 -0.833401
H -5.095052 0.017172 2.138144
H -3.884919 4.184799 -1.014018
H -0.330387 5.317688 1.219655
H -2.518130 5.945378 0.152119
H 7.145780 0.485845 -1.066540
H 8.138039 -0.994054 -0.746154
H 9.013637 0.966430 0.607619
H 7.394734 1.198103 1.331392
H 8.340157 -0.285101 1.695831


