%chk=000211322.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211322

0 1
O -1.583233 -0.034801 1.311479
O 1.860345 -0.926714 1.562526
O -0.545105 -2.052447 1.390969
N -2.945279 -1.198163 -1.029494
N 0.300720 0.671915 -2.640569
C 0.827686 -0.058525 1.071557
C -3.643038 -0.515670 0.107663
C -2.896249 -0.672760 1.433498
C -2.825648 -2.679672 -0.808010
C -3.654290 -0.896813 -2.321673
C 0.889909 1.198021 1.921173
C 1.087253 0.237144 -0.391490
C -0.493594 -0.849765 1.266667
C -1.848037 -3.284592 -1.815956
C -3.390800 0.541965 -2.762304
C 0.002934 2.253885 1.662819
C 1.838968 1.311941 2.944643
C 2.412573 0.435101 -0.807049
C 0.056572 0.355976 -1.343751
C 0.071886 3.420756 2.426402
C 1.902644 2.482996 3.706009
C 1.022341 3.537469 3.447208
C 2.672515 0.748326 -2.142215
C 1.588917 0.865009 -3.027973
H -3.691234 0.570849 -0.149922
H -4.692402 -0.859058 0.250995
H -3.367237 -0.089742 2.245298
H -2.769176 -1.730185 1.738853
H -2.415221 -2.842977 0.219471
H -3.803230 -3.203325 -0.855901
H -3.255701 -1.587537 -3.101030
H -4.747652 -1.086427 -2.260737
H -2.247248 -3.280840 -2.836476
H -0.907116 -2.716139 -1.836995
H -1.604773 -4.318619 -1.549894
H -3.725876 1.275889 -2.022274
H -2.313546 0.713668 -2.922573
H -3.897470 0.760641 -3.707805
H -0.746890 2.153830 0.875461
H 2.523988 0.483414 3.143727
H 3.225497 0.340156 -0.081817
H 1.708517 -1.859034 1.254203
H -1.006613 0.185297 -1.079877
H -0.615470 4.240646 2.226206
H 2.640335 2.570576 4.501735
H 1.074533 4.449054 4.039907
H 3.690729 0.903828 -2.489220
H 1.739769 1.119156 -4.083365


%chk=000211322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211322

0 1
O -1.526155 0.088327 1.193529
O 1.977901 -0.938849 1.360434
O -0.472577 -1.981809 1.403568
N -3.044189 -1.326169 -1.029251
N 0.319194 0.491255 -2.814546
C 0.916563 0.008216 0.987699
C -3.656964 -0.533647 0.061887
C -2.874083 -0.534582 1.380760
C -3.053628 -2.795885 -0.756506
C -3.683982 -1.006764 -2.345469
C 1.020661 1.227166 1.927296
C 1.100815 0.396717 -0.492802
C -0.433697 -0.739320 1.210881
C -2.028177 -3.571342 -1.604356
C -3.291118 0.362738 -2.931894
C 0.426243 2.463514 1.573526
C 1.692957 1.106194 3.166222
C 2.338151 0.971007 -0.880442
C 0.128005 0.170194 -1.495045
C 0.501121 3.565334 2.452215
C 1.768312 2.211519 4.044157
C 1.172022 3.443663 3.692167
C 2.549571 1.301157 -2.233189
C 1.513191 1.048047 -3.163986
H -3.747331 0.511203 -0.282500
H -4.695991 -0.881566 0.311900
H -3.377955 0.114332 2.116263
H -2.733797 -1.542805 1.804278
H -2.790297 -2.951306 0.303751
H -4.078672 -3.220871 -0.906997
H -3.371144 -1.788040 -3.059403
H -4.798808 -1.081461 -2.260716
H -2.239567 -3.513330 -2.686826
H -1.015615 -3.169818 -1.428762
H -2.034180 -4.639657 -1.319396
H -3.573281 1.203619 -2.271781
H -2.205177 0.416870 -3.121030
H -3.816487 0.514625 -3.893731
H -0.097110 2.561658 0.616699
H 2.166461 0.152857 3.415647
H 3.114602 1.141550 -0.127869
H 1.590346 -1.855421 1.279393
H -0.847085 -0.283635 -1.264898
H 0.039480 4.518202 2.169604
H 2.296168 2.110504 4.999289
H 1.232566 4.300893 4.372350
H 3.493357 1.744071 -2.566816
H 1.635880 1.294547 -4.225206


