%chk=000186560.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186560

0 1
O -2.536766 -1.978740 -0.868771
O -5.189079 -1.076966 -0.228535
C -2.762721 -0.901229 0.064177
C -1.557671 0.023658 -0.017469
C -4.073723 -0.199890 -0.413942
C -4.272668 1.134685 0.298722
C -1.755425 1.417958 -0.020809
C -3.117441 2.065841 -0.066568
C -0.240167 -0.493321 -0.029072
C 0.869046 0.401060 -0.017548
C -2.901687 -1.486393 1.473426
C -0.659344 2.292796 -0.016736
C 0.651409 1.805743 -0.010345
C 2.224570 -0.102652 -0.008636
C 0.054403 -1.919383 -0.050540
C 2.465198 -1.503563 -0.016180
C 3.326447 0.798061 0.009009
C 1.795077 2.704078 0.003996
C 1.321689 -2.395747 -0.043094
C 3.061948 2.227110 0.013536
C 3.785681 -1.981895 -0.003395
C 4.635265 0.290956 0.021357
C 4.857836 -1.088205 0.015619
H -4.054417 -0.085247 -1.525648
H -4.326237 0.993424 1.395171
H -5.242686 1.582106 0.005275
H -3.138460 2.952245 0.602257
H -3.272259 2.467299 -1.093916
H -3.763422 -2.156177 1.555411
H -2.012960 -2.078527 1.734613
H -2.991418 -0.700357 2.230914
H -0.827672 3.368872 -0.019625
H -0.795080 -2.612584 -0.101816
H -3.367624 -2.496239 -0.989132
H -5.410798 -1.176162 0.719976
H 1.592286 3.774556 0.006259
H 1.519337 -3.467395 -0.065008
H 3.920810 2.898097 0.024156
H 3.972655 -3.054399 -0.009816
H 5.481667 0.975406 0.034879
H 5.878298 -1.469478 0.025049


%chk=000186560-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186560

0 1
O -2.652332 -2.085071 -0.854703
O -5.239840 -1.125554 -0.299818
C -2.792743 -0.924099 0.063277
C -1.568629 0.005982 -0.049267
C -4.090837 -0.197496 -0.400798
C -4.312640 1.135076 0.311510
C -1.768128 1.418859 -0.030106
C -3.150671 2.075075 -0.068828
C -0.226876 -0.516614 -0.055384
C 0.898986 0.392158 -0.030667
C -2.912732 -1.458243 1.518762
C -0.656579 2.290342 -0.012571
C 0.673340 1.815663 -0.010924
C 2.250681 -0.103489 -0.016278
C 0.068554 -1.940075 -0.076664
C 2.502593 -1.522018 -0.025593
C 3.365586 0.814276 0.010780
C 1.805374 2.717565 0.015357
C 1.367723 -2.413415 -0.059281
C 3.100422 2.237072 0.023909
C 3.842751 -1.995826 -0.009421
C 4.690084 0.300262 0.026367
C 4.924435 -1.091535 0.016075
H -4.004141 -0.034040 -1.490529
H -4.351776 0.986670 1.409050
H -5.279433 1.569604 -0.001325
H -3.151408 2.967110 0.584920
H -3.325209 2.450511 -1.098546
H -3.757562 -2.166514 1.612409
H -1.993164 -2.002670 1.786070
H -3.041742 -0.639585 2.248995
H -0.831532 3.374042 0.001698
H -0.767506 -2.636684 -0.157314
H -3.574002 -2.451771 -0.953901
H -5.527098 -1.179371 0.647444
H 1.610946 3.796443 0.027526
H 1.554207 -3.493811 -0.084344
H 3.951997 2.927344 0.042347
H 4.026823 -3.076417 -0.018311
H 5.533825 1.000018 0.047391
H 5.952153 -1.470374 0.027886


