%chk=000181718.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181718

0 1
O -1.778310 -1.032054 -0.725853
O -3.699702 0.523758 -0.327240
O -2.935542 -2.654919 0.351670
O -5.313113 1.069176 1.167545
C -1.581050 -0.299614 0.516948
C -2.663754 0.822631 0.643826
C -0.284483 0.449111 0.342154
C -1.982585 2.151687 0.250417
C -0.518651 1.820735 0.192411
C 1.022484 -0.076997 0.314212
C 2.106859 0.827545 0.145456
C 0.548239 2.715307 0.021780
C 1.840936 2.212921 0.000531
C 3.468533 0.303570 0.125163
C 1.280508 -1.494890 0.453037
C 3.680830 -1.088154 0.269937
C 2.547592 -1.975832 0.432872
C 4.597176 1.150740 -0.035262
C -2.515259 -2.196935 -0.684722
C -5.020055 0.662200 0.070481
C 5.002821 -1.605284 0.253178
C 5.877467 0.630880 -0.049592
C 6.084040 -0.759723 0.096006
C -2.637327 -2.727632 -2.070316
C -5.896527 0.243269 -1.055376
H -1.604038 -1.009884 1.369918
H -3.108013 0.854154 1.662757
H -2.209320 2.959755 0.967715
H -2.351722 2.496520 -0.738166
H 0.360301 3.780110 -0.093493
H 2.680459 2.899818 -0.131684
H 0.422275 -2.157949 0.566204
H 2.748790 -3.042254 0.537888
H 4.443756 2.224915 -0.147879
H 5.153770 -2.678106 0.366342
H 6.737812 1.287090 -0.172749
H 7.098888 -1.153446 0.082974
H -1.648170 -2.890169 -2.528647
H -3.166002 -2.015669 -2.724146
H -3.183583 -3.682482 -2.080990
H -6.369600 -0.728330 -0.833664
H -5.343988 0.134931 -2.002085
H -6.708443 0.970901 -1.212361


%chk=000181718-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181718

0 1
O -1.780364 -0.863951 -1.205868
O -3.905403 0.688646 -0.269983
O -3.299287 -2.354895 -0.234846
O -4.746934 0.368238 1.891523
C -1.578284 -0.181491 0.123444
C -2.578221 1.004041 0.289056
C -0.248669 0.532351 0.048968
C -1.925145 2.202330 -0.438056
C -0.445167 1.886597 -0.279513
C 1.054254 -0.019212 0.225719
C 2.195017 0.856255 0.078515
C 0.670682 2.747670 -0.424505
C 1.963193 2.230523 -0.246155
C 3.543881 0.309596 0.260100
C 1.254794 -1.414966 0.544064
C 3.696769 -1.089366 0.581189
C 2.526046 -1.926578 0.715798
C 4.728731 1.099345 0.134340
C -2.694021 -1.923288 -1.243138
C -4.905526 0.309611 0.654743
C 5.003809 -1.639087 0.761460
C 6.001845 0.541073 0.314528
C 6.145345 -0.840313 0.631290
C -2.830733 -2.441795 -2.657900
C -6.129944 -0.181002 -0.076866
H -1.698089 -0.942831 0.912209
H -2.689307 1.206642 1.370794
H -2.221282 3.172146 -0.003082
H -2.220140 2.202512 -1.504673
H 0.530621 3.805070 -0.673726
H 2.813066 2.909783 -0.360766
H 0.380409 -2.066499 0.643453
H 2.670325 -2.985923 0.959015
H 4.655159 2.163764 -0.108434
H 5.097991 -2.703959 1.005314
H 6.892136 1.171136 0.211395
H 7.142905 -1.270251 0.771498
H -1.849278 -2.478661 -3.157087
H -3.472970 -1.753570 -3.237113
H -3.294969 -3.438933 -2.646023
H -5.965595 -1.241207 -0.345048
H -6.292218 0.386710 -1.006613
H -7.011135 -0.114858 0.578177


