%chk=000245437.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245437

0 1
O -0.492287 0.427494 2.026649
O 1.105658 0.934642 0.092138
O 0.034780 -0.468287 -1.323511
O 4.469230 0.240723 -0.028852
C -1.101496 0.414562 0.733217
C -2.068560 -0.775869 0.783706
C -1.794633 1.758675 0.454107
C -2.959122 -0.818997 -0.461527
C -2.693612 1.677088 -0.784041
C -3.688641 0.513159 -0.676973
C 0.016975 0.188042 -0.315383
C 2.327693 0.867924 -0.696338
C 3.152830 -0.330146 -0.228071
C 5.440716 -0.711290 0.439677
H -2.679893 -0.685143 1.705843
H -1.503210 -1.721551 0.895249
H -1.047831 2.567164 0.341216
H -2.396386 2.025943 1.347812
H -3.689552 -1.644128 -0.369408
H -2.336549 -1.056831 -1.351685
H -2.072938 1.554824 -1.694640
H -3.238388 2.631598 -0.912203
H -4.303861 0.459925 -1.595031
H -4.395080 0.695932 0.155392
H 0.230160 1.098337 2.077871
H 2.069895 0.825602 -1.767976
H 2.825119 1.827254 -0.445901
H 3.210336 -1.133760 -0.981391
H 2.773651 -0.736548 0.727511
H 5.151212 -1.108651 1.416928
H 6.349063 -0.100925 0.523071
H 5.579818 -1.513660 -0.290555


%chk=000245437-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245437

0 1
O -0.752563 0.446197 2.256222
O 1.066548 1.079119 0.373435
O 0.180918 -0.570223 -1.018473
O 4.543110 0.109767 -0.472506
C -1.196661 0.400115 0.846198
C -2.167421 -0.794297 0.749934
C -1.909550 1.730759 0.467244
C -2.937419 -0.858012 -0.591837
C -2.632518 1.655262 -0.898462
C -3.639158 0.480909 -0.920163
C 0.046442 0.206864 -0.050412
C 2.351445 1.033560 -0.377772
C 3.247923 -0.076469 0.182425
C 5.512975 -0.913979 -0.085525
H -2.877953 -0.676177 1.590737
H -1.610365 -1.732731 0.922485
H -1.180072 2.563312 0.485561
H -2.649996 1.919314 1.269554
H -3.683694 -1.673602 -0.536154
H -2.233155 -1.115881 -1.403722
H -1.894616 1.524534 -1.715802
H -3.151611 2.613797 -1.089602
H -4.130180 0.417741 -1.910099
H -4.438205 0.674408 -0.174291
H -0.029287 1.124205 2.320564
H 2.146813 0.867315 -1.448508
H 2.810250 2.020727 -0.217474
H 2.823531 -1.075648 -0.051052
H 3.343915 0.025598 1.285756
H 5.717302 -0.887576 1.005986
H 6.437986 -0.685353 -0.637160
H 5.160358 -1.930451 -0.360184


